changeset 0:05c95b16823b draft default tip

"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/openduck commit a10eecd64de8f147547c4e3929497f87773c43f9"
author bgruening
date Thu, 16 Apr 2020 08:25:46 -0400
parents
children
files macros.xml openduck_run_smd.xml test-data/1n2v_apo.pdb test-data/complex_system.pickle test-data/equil.chk test-data/ligand.mol test-data/ligand.pdb test-data/ligand_wqb.mol test-data/protein_out_prot.pdb
diffstat 9 files changed, 4054 insertions(+), 0 deletions(-) [+]
line wrap: on
line diff
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/macros.xml	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,53 @@
+<macros>
+    <token name="@VERSION@">0.1.1</token>
+    <xml name="requirements">
+        <requirements>
+            <requirement type="package" version="3.7">python</requirement>
+            <requirement type="package" version="0.25.2">yank</requirement>
+            <requirement type="package" version="1.6">pdbfixer</requirement>
+            <requirement type="package" version="0.6.0">openforcefield</requirement>
+            <requirement type="package" version="3.2.0">parmed</requirement>
+            <requirement type="package" version="@VERSION@">openduck</requirement>
+        </requirements>
+    </xml>
+    <xml name="interaction_params">
+        <section name="ia" title="Parameters for the protein-ligand interaction" expanded="true">
+            <param argument="chain_sel" type="text" label="Chain ID for selection" help="E.g. 'A', 'B', etc.">
+                <validator type="regex" message="Invalid chain ID">^[A-Z]$</validator>
+            </param>
+            <param argument="res_sel" type="text" label="Three letter residue code for selection" help="E.g. 'ASP', 'TYR', etc.">
+                <validator type="regex" message="Invalid chain ID">^[A-Z]{3}$</validator>
+            </param>
+            <param argument="resid_sel" type="text" label="Residue ID for selection" help="Position of residue in sequence, e.g. 163">
+                <validator type="regex" message="Invalid chain ID">^[0-9]+$</validator>
+            </param>
+            <param argument="atom_sel" type="text" label="Atom to select within the chosen residue" help="E.g. 'OD2'">
+                <validator type="regex" message="Invalid chain ID">^[A-Z0-9]+$</validator>
+            </param>
+        </section>
+    </xml>
+    <xml name="tar_param">
+        <param argument="return_tar" type="boolean" checked="true" label="Return a tar file?" help="Return a tar file containing all files produced during the simulations."/>
+    </xml>
+    <xml name="tar_output">
+        <data name="tar" format="tar" from_work_dir="allfiles.tar.gz" label="${tool.name} tarball">
+            <filter>return_tar</filter>
+        </data>
+    </xml>
+    <xml name="citations">
+    <citations>
+        <citation type="doi">10.1038/nchem.2660</citation>
+        <citation type="bibtex">
+@misc{Bradley2019,
+  author = {Bradley, Anthony},
+  title = {OpenDUck source code},
+  year = {2019},
+  publisher = {GitHub},
+  journal = {GitHub repository},
+  howpublished = {URL: https://github.com/xchem/duck},
+  commit = {b98bb78284e9c92837ac1e69fc2f06306ab1e28c}
+}
+        </citation>
+    </citations>
+    </xml>
+</macros>
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/openduck_run_smd.xml	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,107 @@
+<tool id="openduck_run_smd" name="Run OpenDUck" version="@VERSION@">
+    <description>steered molecular dynamics runs</description>
+    <macros>
+        <import>macros.xml</import>
+    </macros>
+    <expand macro="requirements" />
+    <command detect_errors="exit_code"><![CDATA[
+        ## to run on GPU set OPENDUCK_GPU_PARAM to something like "--gpu-id 1"
+        cp '$ligand' ./ligand.sdf &&
+        
+        duck_prepare_sys
+            -p '$protein'
+            -l ./ligand.sdf
+            -c '$chunk'
+            ## -i is interaction, e.g. A_ASP_156_OD2
+            -i '${ia.chain_sel}'_'${ia.res_sel}'_'${ia.resid_sel}'_'${ia.atom_sel}' 
+            \${OPENDUCK_GPU_PARAM} &&
+
+        mv equil.chk eql.chk &&
+        mv complex_system.pickle cs.pickle &&
+
+        duck_smd_runs
+            -i eql.chk
+            -p cs.pickle
+            -n '$num'
+            -l '$mdlen'
+            -d '$start_dist'
+            -v '$vel'
+            \${OPENDUCK_GPU_PARAM} &&
+        #if $return_tar:
+            tar -czf allfiles.tar.gz --exclude=allfiles.tar.gz * &&
+        #end if
+        get_wqb -l '$ligand' -o '$ligand_wqb'
+    ]]></command>
+    <inputs>
+        <param argument="protein" type="data" format='pdb' label="PDB file for apoprotein"/>
+        <param argument="chunk" type="data" format='pdb' label="Chunk (in PDB format)" help="PDB file produced by chunk tool."/>
+        <param argument="ligand" type="data" format='sdf,mol' label="SDF/MOL file containing a single ligand"/>
+        <expand macro="interaction_params" />
+        <param argument="mdlen" type="float" min="0" value="0.05" label="MD run length (ns)" help="Length of initial MD run (prior to steered molecular dynamics runs)."/>
+        <param argument="start_dist" type="float" min="0" value="2.5" label="Starting distance" help="Initial length of the selected interaction between protein and ligand."/>
+        <param argument="num" type="integer" min="0" value="1" label="Number of SMD runs" help="Number of steered molecular dynamics runs to perform."/>
+        <param argument="vel" type="float" min="0" value="0.00001" label="Velocity" help="Distance (in angstroms) to perturb the system per simulation step in the SMD runs. Decreasing this value will increase simulation time."/>
+        <expand macro="tar_param" />
+    </inputs>
+    <outputs>
+        <data name="ligand_wqb" format="sdf" label="SD-file with DUck score"/>
+        <expand macro="tar_output" />
+    </outputs>
+    <tests>
+        <test expect_num_outputs="2">
+            <param name="protein" value="1n2v_apo.pdb" />
+            <param name="ligand" value="ligand.mol" />
+            <param name="chunk" value="protein_out_prot.pdb" />
+            <param name="chain_sel" value="A" />
+            <param name="res_sel" value="ASP" />
+            <param name="resid_sel" value="156" />
+            <param name="atom_sel" value="OD2" />
+            <param name="num" value="1" />
+            <param name="mdlen" value="0.05" />
+            <param name="start_dist" value="2.5" />
+            <param name="vel" value="0.00001" />
+            <output name="ligand_wqb" file="ligand_wqb.mol" lines_diff="2" />
+            <output name="tar" >
+                <assert_contents>
+                    <has_size value="6718500" delta="500"/>
+                </assert_contents>
+            </output>
+        </test>
+    </tests>
+    <help><![CDATA[
+
+.. class:: infomark
+
+**What it does**
+
+Perform steered molecular dynamics runs for dynamic undocking (DUck), performing system preparation (topology calculation and minimization), an initial MD run, and SMD runs.
+
+This Galaxy tool uses OpenDUck, an open-source implementation of the original DUck method, using OpenMM and AmberTools.
+
+_____
+
+.. class:: infomark
+
+**Input**
+
+       - PDB file for apoprotein
+       - PDB file for chunk
+       - SDF/MOL file for ligand
+       - Parameters defining the protein-ligand interaction
+       - Parameters for MD and SMD runs
+
+_____
+
+
+.. class:: infomark
+
+**Output**
+
+       - Ligand in SDF/MOL format, with added `<SCORE.DUCK_WQB>` parameter.
+
+A tar file is also produced as a optional output, containing all files produced by the tool.
+
+    ]]></help>
+
+    <expand macro="citations" />
+</tool>
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/1n2v_apo.pdb	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,3648 @@
+HEADER    TRANSFERASE                             24-OCT-02   1N2V              
+TITLE     CRYSTAL STRUCTURE OF TGT IN COMPLEX WITH 2-BUTYL-5,6-DIHYDRO-1H-      
+TITLE    2 IMIDAZO[4,5-D]PYRIDAZINE-4,7-DIONE                                   
+COMPND    MOL_ID: 1;                                                            
+COMPND   2 MOLECULE: QUEUINE TRNA-RIBOSYLTRANSFERASE;                           
+COMPND   3 CHAIN: A;                                                            
+COMPND   4 SYNONYM: TRNA-GUANINE TRANSGLYCOSYLASE, GUANINE INSERTION ENZYME,    
+COMPND   5 TGT;                                                                 
+COMPND   6 EC: 2.4.2.29;                                                        
+COMPND   7 ENGINEERED: YES                                                      
+SOURCE    MOL_ID: 1;                                                            
+SOURCE   2 ORGANISM_SCIENTIFIC: ZYMOMONAS MOBILIS;                              
+SOURCE   3 ORGANISM_TAXID: 542;                                                 
+SOURCE   4 GENE: TGT;                                                           
+SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
+SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
+SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
+SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
+SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET9D                                     
+KEYWDS    PROTEIN-LIGAND COMPLEX, TRANSFERASE                                   
+EXPDTA    X-RAY DIFFRACTION                                                     
+AUTHOR    R.BRENK,L.NAERUM,U.GRAEDLER,H.-D.GERBER,G.A.GARCIA,K.REUTER,          
+AUTHOR   2 M.T.STUBBS,G.KLEBE                                                   
+REVDAT   4   31-JAN-18 1N2V    1       REMARK                                   
+REVDAT   3   13-JUL-11 1N2V    1       VERSN                                    
+REVDAT   2   24-FEB-09 1N2V    1       VERSN                                    
+REVDAT   1   08-APR-03 1N2V    0                                                
+JRNL        AUTH   R.BRENK,L.NAERUM,U.GRAEDLER,H.-D.GERBER,G.A.GARCIA,K.REUTER, 
+JRNL        AUTH 2 M.T.STUBBS,G.KLEBE                                           
+JRNL        TITL   VIRTUAL SCREENING FOR SUBMICROMOLAR LEADS OF TRNA-GUANINE    
+JRNL        TITL 2 TRANSGLYCOSYLASE BASED ON A NEW UNEXPECTED BINDING MODE      
+JRNL        TITL 3 DETECTED BY CRYSTAL STRUCTURE ANALYSIS                       
+JRNL        REF    J.MED.CHEM.                   V.  46  1133 2003              
+JRNL        REFN                   ISSN 0022-2623                               
+JRNL        PMID   12646024                                                     
+JRNL        DOI    10.1021/JM0209937                                            
+REMARK   2                                                                      
+REMARK   2 RESOLUTION.    2.10 ANGSTROMS.                                       
+REMARK   3                                                                      
+REMARK   3 REFINEMENT.                                                          
+REMARK   3   PROGRAM     : CNS                                                  
+REMARK   3   AUTHORS     : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE-              
+REMARK   3               : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU,              
+REMARK   3               : READ,RICE,SIMONSON,WARREN                            
+REMARK   3                                                                      
+REMARK   3  REFINEMENT TARGET : NULL                                            
+REMARK   3                                                                      
+REMARK   3  DATA USED IN REFINEMENT.                                            
+REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.10                           
+REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 30.00                          
+REMARK   3   DATA CUTOFF            (SIGMA(F)) : 0.000                          
+REMARK   3   DATA CUTOFF HIGH         (ABS(F)) : NULL                           
+REMARK   3   DATA CUTOFF LOW          (ABS(F)) : NULL                           
+REMARK   3   COMPLETENESS (WORKING+TEST)   (%) : 99.8                           
+REMARK   3   NUMBER OF REFLECTIONS             : 23607                          
+REMARK   3                                                                      
+REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
+REMARK   3   CROSS-VALIDATION METHOD          : THROUGHOUT                      
+REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM                          
+REMARK   3   R VALUE            (WORKING SET) : 0.188                           
+REMARK   3   FREE R VALUE                     : 0.233                           
+REMARK   3   FREE R VALUE TEST SET SIZE   (%) : NULL                            
+REMARK   3   FREE R VALUE TEST SET COUNT      : 2380                            
+REMARK   3   ESTIMATED ERROR OF FREE R VALUE  : NULL                            
+REMARK   3                                                                      
+REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
+REMARK   3   TOTAL NUMBER OF BINS USED           : NULL                         
+REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : 2.10                         
+REMARK   3   BIN RESOLUTION RANGE LOW        (A) : 2.12                         
+REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : NULL                         
+REMARK   3   REFLECTIONS IN BIN    (WORKING SET) : NULL                         
+REMARK   3   BIN R VALUE           (WORKING SET) : 0.2000                       
+REMARK   3   BIN FREE R VALUE                    : 0.2340                       
+REMARK   3   BIN FREE R VALUE TEST SET SIZE  (%) : NULL                         
+REMARK   3   BIN FREE R VALUE TEST SET COUNT     : 65                           
+REMARK   3   ESTIMATED ERROR OF BIN FREE R VALUE : NULL                         
+REMARK   3                                                                      
+REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
+REMARK   3   PROTEIN ATOMS            : 2902                                    
+REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
+REMARK   3   HETEROGEN ATOMS          : 16                                      
+REMARK   3   SOLVENT ATOMS            : 282                                     
+REMARK   3                                                                      
+REMARK   3  B VALUES.                                                           
+REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
+REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
+REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
+REMARK   3    B11 (A**2) : -0.79000                                             
+REMARK   3    B22 (A**2) : 0.29500                                              
+REMARK   3    B33 (A**2) : 0.49500                                              
+REMARK   3    B12 (A**2) : 0.00000                                              
+REMARK   3    B13 (A**2) : 1.00700                                              
+REMARK   3    B23 (A**2) : 0.00000                                              
+REMARK   3                                                                      
+REMARK   3  ESTIMATED COORDINATE ERROR.                                         
+REMARK   3   ESD FROM LUZZATI PLOT        (A) : NULL                            
+REMARK   3   ESD FROM SIGMAA              (A) : NULL                            
+REMARK   3   LOW RESOLUTION CUTOFF        (A) : NULL                            
+REMARK   3                                                                      
+REMARK   3  CROSS-VALIDATED ESTIMATED COORDINATE ERROR.                         
+REMARK   3   ESD FROM C-V LUZZATI PLOT    (A) : NULL                            
+REMARK   3   ESD FROM C-V SIGMAA          (A) : NULL                            
+REMARK   3                                                                      
+REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES.                                   
+REMARK   3   BOND LENGTHS                 (A) : 0.005                           
+REMARK   3   BOND ANGLES            (DEGREES) : 1.209                           
+REMARK   3   DIHEDRAL ANGLES        (DEGREES) : NULL                            
+REMARK   3   IMPROPER ANGLES        (DEGREES) : NULL                            
+REMARK   3                                                                      
+REMARK   3  ISOTROPIC THERMAL MODEL : NULL                                      
+REMARK   3                                                                      
+REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.    RMS    SIGMA                
+REMARK   3   MAIN-CHAIN BOND              (A**2) : 1.450 ; 1.500                
+REMARK   3   MAIN-CHAIN ANGLE             (A**2) : 2.297 ; 2.000                
+REMARK   3   SIDE-CHAIN BOND              (A**2) : 2.107 ; 2.000                
+REMARK   3   SIDE-CHAIN ANGLE             (A**2) : 2.998 ; 2.500                
+REMARK   3                                                                      
+REMARK   3  BULK SOLVENT MODELING.                                              
+REMARK   3   METHOD USED : NULL                                                 
+REMARK   3   KSOL        : NULL                                                 
+REMARK   3   BSOL        : NULL                                                 
+REMARK   3                                                                      
+REMARK   3  NCS MODEL : NULL                                                    
+REMARK   3                                                                      
+REMARK   3  NCS RESTRAINTS.                         RMS   SIGMA/WEIGHT          
+REMARK   3   GROUP  1  POSITIONAL            (A) : NULL  ; NULL                 
+REMARK   3   GROUP  1  B-FACTOR           (A**2) : NULL  ; NULL                 
+REMARK   3                                                                      
+REMARK   3  PARAMETER FILE  1  : PROTEIN_REP.PARAM                              
+REMARK   3  PARAMETER FILE  2  : WATER_REP.PARAM                                
+REMARK   3  PARAMETER FILE  3  : ION.PARAM                                      
+REMARK   3  PARAMETER FILE  4  : LN4.PAR                                        
+REMARK   3  PARAMETER FILE  5  : NULL                                           
+REMARK   3  TOPOLOGY FILE  1   : PROTEIN.TOP                                    
+REMARK   3  TOPOLOGY FILE  2   : WATER.TOP                                      
+REMARK   3  TOPOLOGY FILE  3   : ION.TOP                                        
+REMARK   3  TOPOLOGY FILE  4   : NULL                                           
+REMARK   3  TOPOLOGY FILE  5   : NULL                                           
+REMARK   3                                                                      
+REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
+REMARK   4                                                                      
+REMARK   4 1N2V COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
+REMARK 100                                                                      
+REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 29-OCT-02.                  
+REMARK 100 THE DEPOSITION ID IS D_1000017449.                                   
+REMARK 200                                                                      
+REMARK 200 EXPERIMENTAL DETAILS                                                 
+REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
+REMARK 200  DATE OF DATA COLLECTION        : 28-SEP-00                          
+REMARK 200  TEMPERATURE           (KELVIN) : 100                                
+REMARK 200  PH                             : 8.5                                
+REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
+REMARK 200                                                                      
+REMARK 200  SYNCHROTRON              (Y/N) : N                                  
+REMARK 200  RADIATION SOURCE               : ROTATING ANODE                     
+REMARK 200  BEAMLINE                       : NULL                               
+REMARK 200  X-RAY GENERATOR MODEL          : RIGAKU RU300                       
+REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
+REMARK 200  WAVELENGTH OR RANGE        (A) : 1.54                               
+REMARK 200  MONOCHROMATOR                  : YALE MIRROR                        
+REMARK 200  OPTICS                         : MIRRORS                            
+REMARK 200                                                                      
+REMARK 200  DETECTOR TYPE                  : IMAGE PLATE                        
+REMARK 200  DETECTOR MANUFACTURER          : RIGAKU RAXIS IV                    
+REMARK 200  INTENSITY-INTEGRATION SOFTWARE : DENZO                              
+REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
+REMARK 200                                                                      
+REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 23842                              
+REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.100                              
+REMARK 200  RESOLUTION RANGE LOW       (A) : 30.000                             
+REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
+REMARK 200                                                                      
+REMARK 200 OVERALL.                                                             
+REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.8                               
+REMARK 200  DATA REDUNDANCY                : 3.700                              
+REMARK 200  R MERGE                    (I) : NULL                               
+REMARK 200  R SYM                      (I) : 0.09500                            
+REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 13.6000                            
+REMARK 200                                                                      
+REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
+REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.10                     
+REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.18                     
+REMARK 200  COMPLETENESS FOR SHELL     (%) : 99.4                               
+REMARK 200  DATA REDUNDANCY IN SHELL       : NULL                               
+REMARK 200  R MERGE FOR SHELL          (I) : NULL                               
+REMARK 200  R SYM FOR SHELL            (I) : NULL                               
+REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
+REMARK 200                                                                      
+REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
+REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: FOURIER SYNTHESIS            
+REMARK 200 SOFTWARE USED: CNS                                                   
+REMARK 200 STARTING MODEL: NULL                                                 
+REMARK 200                                                                      
+REMARK 200 REMARK: NULL                                                         
+REMARK 280                                                                      
+REMARK 280 CRYSTAL                                                              
+REMARK 280 SOLVENT CONTENT, VS   (%): 48.75                                     
+REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.40                     
+REMARK 280                                                                      
+REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 8000, TRIS, DMSO, DTT, PH 8.5,       
+REMARK 280  VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 395K, TEMPERATURE        
+REMARK 280  295.0K                                                              
+REMARK 290                                                                      
+REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
+REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1                          
+REMARK 290                                                                      
+REMARK 290      SYMOP   SYMMETRY                                                
+REMARK 290     NNNMMM   OPERATOR                                                
+REMARK 290       1555   X,Y,Z                                                   
+REMARK 290       2555   -X,Y,-Z                                                 
+REMARK 290       3555   X+1/2,Y+1/2,Z                                           
+REMARK 290       4555   -X+1/2,Y+1/2,-Z                                         
+REMARK 290                                                                      
+REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
+REMARK 290           MMM -> TRANSLATION VECTOR                                  
+REMARK 290                                                                      
+REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
+REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
+REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
+REMARK 290 RELATED MOLECULES.                                                   
+REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
+REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
+REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
+REMARK 290   SMTRY1   2 -1.000000  0.000000  0.000000        0.00000            
+REMARK 290   SMTRY2   2  0.000000  1.000000  0.000000        0.00000            
+REMARK 290   SMTRY3   2  0.000000  0.000000 -1.000000        0.00000            
+REMARK 290   SMTRY1   3  1.000000  0.000000  0.000000       45.53000            
+REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       32.19000            
+REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000        0.00000            
+REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000       45.53000            
+REMARK 290   SMTRY2   4  0.000000  1.000000  0.000000       32.19000            
+REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
+REMARK 290                                                                      
+REMARK 290 REMARK: NULL                                                         
+REMARK 300                                                                      
+REMARK 300 BIOMOLECULE: 1, 2                                                    
+REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
+REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
+REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
+REMARK 300 BURIED SURFACE AREA.                                                 
+REMARK 300 REMARK: PROTEIN IS A MONOMER                                         
+REMARK 350                                                                      
+REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
+REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
+REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
+REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
+REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
+REMARK 350                                                                      
+REMARK 350 BIOMOLECULE: 1                                                       
+REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC                         
+REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
+REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
+REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
+REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
+REMARK 350                                                                      
+REMARK 350 BIOMOLECULE: 2                                                       
+REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC                    
+REMARK 350 SOFTWARE USED: PISA,PQS                                              
+REMARK 350 TOTAL BURIED SURFACE AREA: 4180 ANGSTROM**2                          
+REMARK 350 SURFACE AREA OF THE COMPLEX: 26460 ANGSTROM**2                       
+REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -7.0 KCAL/MOL                         
+REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
+REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
+REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
+REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
+REMARK 350   BIOMT1   2 -1.000000  0.000000  0.000000        0.00000            
+REMARK 350   BIOMT2   2  0.000000  1.000000  0.000000        0.00000            
+REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000        0.00000            
+REMARK 465                                                                      
+REMARK 465 MISSING RESIDUES                                                     
+REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
+REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
+REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                
+REMARK 465                                                                      
+REMARK 465   M RES C SSSEQI                                                     
+REMARK 465     MET A     1                                                      
+REMARK 465     VAL A     2                                                      
+REMARK 465     GLU A     3                                                      
+REMARK 465     ALA A     4                                                      
+REMARK 465     THR A     5                                                      
+REMARK 465     ALA A     6                                                      
+REMARK 465     GLN A     7                                                      
+REMARK 465     GLU A     8                                                      
+REMARK 465     THR A     9                                                      
+REMARK 465     ASP A    10                                                      
+REMARK 465     ALA A   383                                                      
+REMARK 465     ARG A   384                                                      
+REMARK 465     ASN A   385                                                      
+REMARK 465     SER A   386                                                      
+REMARK 500                                                                      
+REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
+REMARK 500 SUBTOPIC: TORSION ANGLES                                             
+REMARK 500                                                                      
+REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
+REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
+REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
+REMARK 500                                                                      
+REMARK 500 STANDARD TABLE:                                                      
+REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
+REMARK 500                                                                      
+REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
+REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
+REMARK 500                                                                      
+REMARK 500  M RES CSSEQI        PSI       PHI                                   
+REMARK 500    GLU A  22      107.74   -162.52                                   
+REMARK 500    ALA A  48       57.28   -110.02                                   
+REMARK 500    LYS A  52      115.78    -29.88                                   
+REMARK 500    LEU A  76      -73.32    -93.28                                   
+REMARK 500    ARG A  77      -73.51    -48.90                                   
+REMARK 500    SER A 112      170.46    -56.79                                   
+REMARK 500    LEU A 128      -74.77   -110.70                                   
+REMARK 500    GLN A 203     -163.84   -123.51                                   
+REMARK 500    SER A 205     -132.08     53.54                                   
+REMARK 500    ALA A 232       59.84   -102.08                                   
+REMARK 500    CYS A 281      148.19   -176.43                                   
+REMARK 500                                                                      
+REMARK 500 REMARK: NULL                                                         
+REMARK 615                                                                      
+REMARK 615 ZERO OCCUPANCY ATOM                                                  
+REMARK 615 THE FOLLOWING RESIDUES HAVE ATOMS MODELED WITH ZERO                  
+REMARK 615 OCCUPANCY. THE LOCATION AND PROPERTIES OF THESE ATOMS                
+REMARK 615 MAY NOT BE RELIABLE. (M=MODEL NUMBER; RES=RESIDUE NAME;              
+REMARK 615 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):         
+REMARK 615   M RES C  SSEQI                                                     
+REMARK 620                                                                      
+REMARK 620 METAL COORDINATION                                                   
+REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
+REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                             
+REMARK 620                                                                      
+REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
+REMARK 620                              ZN A 400  ZN                            
+REMARK 620 N RES CSSEQI ATOM                                                    
+REMARK 620 1 CYS A 320   SG                                                     
+REMARK 620 2 CYS A 318   SG  103.0                                              
+REMARK 620 3 CYS A 323   SG  116.4 114.4                                        
+REMARK 620 4 HIS A 349   ND1 117.2 105.7 100.2                                  
+REMARK 620 N                    1     2     3                                   
+REMARK 800                                                                      
+REMARK 800 SITE                                                                 
+REMARK 800 SITE_IDENTIFIER: AC1                                                 
+REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
+REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 400                  
+REMARK 800                                                                      
+REMARK 800 SITE_IDENTIFIER: AC2                                                 
+REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
+REMARK 900                                                                      
+REMARK 900 RELATED ENTRIES                                                      
+REMARK 900 RELATED ID: 1ENU   RELATED DB: PDB                                   
+REMARK 900 A NEW TARGET FOR SHIGELLOSIS: RATIONAL DESIGN AND CRYSTALLOGRAPHIC   
+REMARK 900 STUDIES OF INHIBITORS OF TRNA-GUANINE TRANSGLYCOSYLASE               
+REMARK 900 RELATED ID: 1PUD   RELATED DB: PDB                                   
+REMARK 900 APO-STRUCTURE OF TRNA-GUANINE TRANSGLYCOSYLASE                       
+DBREF  1N2V A    1   386  UNP    P28720   TGT_ZYMMO        0    385             
+SEQRES   1 A  386  MET VAL GLU ALA THR ALA GLN GLU THR ASP ARG PRO ARG          
+SEQRES   2 A  386  PHE SER PHE SER ILE ALA ALA ARG GLU GLY LYS ALA ARG          
+SEQRES   3 A  386  THR GLY THR ILE GLU MET LYS ARG GLY VAL ILE ARG THR          
+SEQRES   4 A  386  PRO ALA PHE MET PRO VAL GLY THR ALA ALA THR VAL LYS          
+SEQRES   5 A  386  ALA LEU LYS PRO GLU THR VAL ARG ALA THR GLY ALA ASP          
+SEQRES   6 A  386  ILE ILE LEU GLY ASN THR TYR HIS LEU MET LEU ARG PRO          
+SEQRES   7 A  386  GLY ALA GLU ARG ILE ALA LYS LEU GLY GLY LEU HIS SER          
+SEQRES   8 A  386  PHE MET GLY TRP ASP ARG PRO ILE LEU THR ASP SER GLY          
+SEQRES   9 A  386  GLY TYR GLN VAL MET SER LEU SER SER LEU THR LYS GLN          
+SEQRES  10 A  386  SER GLU GLU GLY VAL THR PHE LYS SER HIS LEU ASP GLY          
+SEQRES  11 A  386  SER ARG HIS MET LEU SER PRO GLU ARG SER ILE GLU ILE          
+SEQRES  12 A  386  GLN HIS LEU LEU GLY SER ASP ILE VAL MET ALA PHE ASP          
+SEQRES  13 A  386  GLU CYS THR PRO TYR PRO ALA THR PRO SER ARG ALA ALA          
+SEQRES  14 A  386  SER SER MET GLU ARG SER MET ARG TRP ALA LYS ARG SER          
+SEQRES  15 A  386  ARG ASP ALA PHE ASP SER ARG LYS GLU GLN ALA GLU ASN          
+SEQRES  16 A  386  ALA ALA LEU PHE GLY ILE GLN GLN GLY SER VAL PHE GLU          
+SEQRES  17 A  386  ASN LEU ARG GLN GLN SER ALA ASP ALA LEU ALA GLU ILE          
+SEQRES  18 A  386  GLY PHE ASP GLY TYR ALA VAL GLY GLY LEU ALA VAL GLY          
+SEQRES  19 A  386  GLU GLY GLN ASP GLU MET PHE ARG VAL LEU ASP PHE SER          
+SEQRES  20 A  386  VAL PRO MET LEU PRO ASP ASP LYS PRO HIS TYR LEU MET          
+SEQRES  21 A  386  GLY VAL GLY LYS PRO ASP ASP ILE VAL GLY ALA VAL GLU          
+SEQRES  22 A  386  ARG GLY ILE ASP MET PHE ASP CYS VAL LEU PRO THR ARG          
+SEQRES  23 A  386  SER GLY ARG ASN GLY GLN ALA PHE THR TRP ASP GLY PRO          
+SEQRES  24 A  386  ILE ASN ILE ARG ASN ALA ARG PHE SER GLU ASP LEU LYS          
+SEQRES  25 A  386  PRO LEU ASP SER GLU CYS HIS CYS ALA VAL CYS GLN LYS          
+SEQRES  26 A  386  TRP SER ARG ALA TYR ILE HIS HIS LEU ILE ARG ALA GLY          
+SEQRES  27 A  386  GLU ILE LEU GLY ALA MET LEU MET THR GLU HIS ASN ILE          
+SEQRES  28 A  386  ALA PHE TYR GLN GLN LEU MET GLN LYS ILE ARG ASP SER          
+SEQRES  29 A  386  ILE SER GLU GLY ARG PHE SER GLN PHE ALA GLN ASP PHE          
+SEQRES  30 A  386  ARG ALA ARG TYR PHE ALA ARG ASN SER                          
+HET     ZN  A 400       1                                                       
+HETNAM      ZN ZINC ION                                                         
+FORMUL   2   ZN    ZN 2+                                                        
+FORMUL   4  HOH   *282(H2 O)                                                    
+HELIX    1   1 LYS A   55  THR A   62  1                                   8    
+HELIX    2   2 ASN A   70  ARG A   77  1                                   8    
+HELIX    3   3 GLY A   79  LEU A   86  1                                   8    
+HELIX    4   4 GLY A   88  GLY A   94  1                                   7    
+HELIX    5   5 GLY A  104  MET A  109  1                                   6    
+HELIX    6   6 SER A  136  GLY A  148  1                                  13    
+HELIX    7   7 THR A  164  ARG A  189  1                                  26    
+HELIX    8   8 ARG A  189  ALA A  196  1                                   8    
+HELIX    9   9 PHE A  207  GLY A  222  1                                  16    
+HELIX   10  10 GLY A  236  VAL A  248  1                                  13    
+HELIX   11  11 PRO A  249  LEU A  251  5                                   3    
+HELIX   12  12 LYS A  264  ARG A  274  1                                  11    
+HELIX   13  13 VAL A  282  GLY A  291  1                                  10    
+HELIX   14  14 ASN A  304  SER A  308  5                                   5    
+HELIX   15  15 CYS A  320  TRP A  326  1                                   7    
+HELIX   16  16 SER A  327  ALA A  337  1                                  11    
+HELIX   17  17 GLU A  339  GLU A  367  1                                  29    
+HELIX   18  18 ARG A  369  PHE A  382  1                                  14    
+SHEET    1   A 3 PHE A  14  GLU A  22  0                                        
+SHEET    2   A 3 ALA A  25  MET A  32 -1  O  GLU A  31   N  SER A  15           
+SHEET    3   A 3 GLY A  35  THR A  39 -1  O  ILE A  37   N  ILE A  30           
+SHEET    1   B 9 ALA A  41  MET A  43  0                                        
+SHEET    2   B 9 MET A 278  ASP A 280  1  O  PHE A 279   N  MET A  43           
+SHEET    3   B 9 HIS A 257  LEU A 259  1  N  LEU A 259   O  MET A 278           
+SHEET    4   B 9 GLY A 225  VAL A 228  1  N  VAL A 228   O  TYR A 258           
+SHEET    5   B 9 ALA A 197  GLN A 202  1  N  GLN A 202   O  ALA A 227           
+SHEET    6   B 9 ILE A 151  MET A 153  1  N  VAL A 152   O  ALA A 197           
+SHEET    7   B 9 ILE A  99  THR A 101  1  N  THR A 101   O  ILE A 151           
+SHEET    8   B 9 ILE A  67  GLY A  69  1  N  GLY A  69   O  LEU A 100           
+SHEET    9   B 9 VAL A  45  GLY A  46  1  N  GLY A  46   O  LEU A  68           
+SHEET    1   C 3 SER A 113  GLN A 117  0                                        
+SHEET    2   C 3 VAL A 122  LYS A 125 -1  O  THR A 123   N  LYS A 116           
+SHEET    3   C 3 ARG A 132  LEU A 135 -1  O  LEU A 135   N  VAL A 122           
+SHEET    1   D 2 GLN A 292  ALA A 293  0                                        
+SHEET    2   D 2 ILE A 300  ASN A 301 -1  O  ILE A 300   N  ALA A 293           
+LINK        ZN    ZN A 400                 SG  CYS A 320     1555   1555  2.24  
+LINK        ZN    ZN A 400                 SG  CYS A 318     1555   1555  2.30  
+LINK        ZN    ZN A 400                 SG  CYS A 323     1555   1555  2.23  
+LINK        ZN    ZN A 400                 ND1 HIS A 349     1555   1555  2.16  
+CISPEP   1 THR A   39    PRO A   40          0         0.13                     
+CISPEP   2 TYR A  161    PRO A  162          0        -0.06                     
+SITE     1 AC1  4 CYS A 318  CYS A 320  CYS A 323  HIS A 349                    
+SITE     1 AC2 13 TYR A 106  ASP A 156  CYS A 158  ILE A 201                    
+SITE     2 AC2 13 GLN A 203  GLY A 229  GLY A 230  MET A 260                    
+SITE     3 AC2 13 GLY A 261  HOH A1400  HOH A1401  HOH A1403                    
+SITE     4 AC2 13 HOH A1404                                                     
+CRYST1   91.060   64.380   70.770  90.00  96.50  90.00 C 1 2 1       4          
+ORIGX1      1.000000  0.000000  0.000000        0.00000                         
+ORIGX2      0.000000  1.000000  0.000000        0.00000                         
+ORIGX3      0.000000  0.000000  1.000000        0.00000                         
+SCALE1      0.010982  0.000000  0.001251        0.00000                         
+SCALE2      0.000000  0.015533  0.000000        0.00000                         
+SCALE3      0.000000  0.000000  0.014222        0.00000                         
+ATOM      1  N   ARG A  11       7.468 -10.777  25.571  1.00 30.72           N  
+ATOM      2  CA  ARG A  11       8.797 -10.130  25.757  1.00 28.18           C  
+ATOM      3  C   ARG A  11       8.819  -9.351  27.066  1.00 26.23           C  
+ATOM      4  O   ARG A  11       7.782  -9.163  27.707  1.00 25.57           O  
+ATOM      5  CB  ARG A  11       9.080  -9.153  24.616  1.00 32.36           C  
+ATOM      6  CG  ARG A  11       8.902  -9.702  23.215  1.00 37.48           C  
+ATOM      7  CD  ARG A  11       9.272  -8.642  22.184  1.00 37.78           C  
+ATOM      8  NE  ARG A  11       8.836  -9.006  20.842  1.00 43.47           N  
+ATOM      9  CZ  ARG A  11       7.564  -9.067  20.458  1.00 43.88           C  
+ATOM     10  NH1 ARG A  11       6.589  -8.782  21.314  1.00 44.60           N  
+ATOM     11  NH2 ARG A  11       7.266  -9.416  19.215  1.00 46.37           N  
+ATOM     12  N   PRO A  12      10.007  -8.887  27.483  1.00 22.42           N  
+ATOM     13  CA  PRO A  12      10.116  -8.119  28.726  1.00 22.51           C  
+ATOM     14  C   PRO A  12       9.759  -6.650  28.492  1.00 22.30           C  
+ATOM     15  O   PRO A  12       9.563  -6.218  27.355  1.00 22.55           O  
+ATOM     16  CB  PRO A  12      11.583  -8.284  29.100  1.00 23.11           C  
+ATOM     17  CG  PRO A  12      12.251  -8.288  27.753  1.00 23.10           C  
+ATOM     18  CD  PRO A  12      11.341  -9.196  26.938  1.00 22.93           C  
+ATOM     19  N   ARG A  13       9.662  -5.896  29.580  1.00 22.39           N  
+ATOM     20  CA  ARG A  13       9.368  -4.478  29.508  1.00 20.97           C  
+ATOM     21  C   ARG A  13      10.473  -3.823  28.687  1.00 22.29           C  
+ATOM     22  O   ARG A  13      10.206  -3.015  27.796  1.00 20.74           O  
+ATOM     23  CB  ARG A  13       9.362  -3.875  30.913  1.00 20.50           C  
+ATOM     24  CG  ARG A  13       9.281  -2.357  30.948  1.00 20.01           C  
+ATOM     25  CD  ARG A  13       9.587  -1.842  32.344  1.00 20.43           C  
+ATOM     26  NE  ARG A  13      10.990  -2.044  32.707  1.00 18.29           N  
+ATOM     27  CZ  ARG A  13      11.980  -1.221  32.367  1.00 18.88           C  
+ATOM     28  NH1 ARG A  13      11.723  -0.131  31.652  1.00 16.82           N  
+ATOM     29  NH2 ARG A  13      13.227  -1.482  32.747  1.00 14.10           N  
+ATOM     30  N   PHE A  14      11.716  -4.198  28.979  1.00 19.60           N  
+ATOM     31  CA  PHE A  14      12.863  -3.620  28.287  1.00 20.61           C  
+ATOM     32  C   PHE A  14      14.123  -4.454  28.498  1.00 20.48           C  
+ATOM     33  O   PHE A  14      14.533  -4.701  29.633  1.00 20.15           O  
+ATOM     34  CB  PHE A  14      13.111  -2.204  28.811  1.00 18.91           C  
+ATOM     35  CG  PHE A  14      14.182  -1.457  28.069  1.00 20.00           C  
+ATOM     36  CD1 PHE A  14      13.873  -0.726  26.922  1.00 18.61           C  
+ATOM     37  CD2 PHE A  14      15.501  -1.470  28.524  1.00 20.43           C  
+ATOM     38  CE1 PHE A  14      14.865  -0.016  26.242  1.00 19.34           C  
+ATOM     39  CE2 PHE A  14      16.496  -0.763  27.847  1.00 20.91           C  
+ATOM     40  CZ  PHE A  14      16.177  -0.036  26.708  1.00 17.77           C  
+ATOM     41  N   SER A  15      14.743  -4.868  27.400  1.00 21.07           N  
+ATOM     42  CA  SER A  15      15.959  -5.663  27.471  1.00 21.99           C  
+ATOM     43  C   SER A  15      16.874  -5.385  26.287  1.00 20.72           C  
+ATOM     44  O   SER A  15      16.581  -5.776  25.158  1.00 21.93           O  
+ATOM     45  CB  SER A  15      15.616  -7.152  27.505  1.00 22.63           C  
+ATOM     46  OG  SER A  15      16.795  -7.922  27.628  1.00 26.64           O  
+ATOM     47  N   PHE A  16      17.988  -4.719  26.555  1.00 19.72           N  
+ATOM     48  CA  PHE A  16      18.958  -4.384  25.521  1.00 19.87           C  
+ATOM     49  C   PHE A  16      20.098  -5.387  25.582  1.00 20.33           C  
+ATOM     50  O   PHE A  16      20.694  -5.580  26.630  1.00 21.00           O  
+ATOM     51  CB  PHE A  16      19.479  -2.956  25.756  1.00 19.59           C  
+ATOM     52  CG  PHE A  16      20.609  -2.545  24.848  1.00 18.65           C  
+ATOM     53  CD1 PHE A  16      20.473  -2.600  23.466  1.00 17.08           C  
+ATOM     54  CD2 PHE A  16      21.805  -2.076  25.384  1.00 18.02           C  
+ATOM     55  CE1 PHE A  16      21.512  -2.191  22.627  1.00 16.96           C  
+ATOM     56  CE2 PHE A  16      22.849  -1.665  24.555  1.00 16.65           C  
+ATOM     57  CZ  PHE A  16      22.703  -1.723  23.177  1.00 16.92           C  
+ATOM     58  N   SER A  17      20.384  -6.046  24.466  1.00 21.19           N  
+ATOM     59  CA  SER A  17      21.476  -7.007  24.429  1.00 23.83           C  
+ATOM     60  C   SER A  17      22.375  -6.742  23.230  1.00 22.60           C  
+ATOM     61  O   SER A  17      21.905  -6.596  22.102  1.00 24.63           O  
+ATOM     62  CB  SER A  17      20.939  -8.443  24.378  1.00 25.94           C  
+ATOM     63  OG  SER A  17      20.177  -8.664  23.206  1.00 33.53           O  
+ATOM     64  N   ILE A  18      23.673  -6.663  23.491  1.00 20.75           N  
+ATOM     65  CA  ILE A  18      24.663  -6.419  22.456  1.00 20.80           C  
+ATOM     66  C   ILE A  18      25.168  -7.765  21.956  1.00 21.77           C  
+ATOM     67  O   ILE A  18      25.697  -8.562  22.734  1.00 22.21           O  
+ATOM     68  CB  ILE A  18      25.843  -5.602  23.023  1.00 21.14           C  
+ATOM     69  CG1 ILE A  18      25.322  -4.260  23.545  1.00 20.20           C  
+ATOM     70  CG2 ILE A  18      26.905  -5.400  21.960  1.00 18.03           C  
+ATOM     71  CD1 ILE A  18      26.341  -3.457  24.321  1.00 22.20           C  
+ATOM     72  N   ALA A  19      24.997  -8.020  20.662  1.00 20.66           N  
+ATOM     73  CA  ALA A  19      25.432  -9.283  20.076  1.00 19.89           C  
+ATOM     74  C   ALA A  19      26.816  -9.207  19.449  1.00 20.33           C  
+ATOM     75  O   ALA A  19      27.521 -10.206  19.390  1.00 21.11           O  
+ATOM     76  CB  ALA A  19      24.422  -9.758  19.036  1.00 18.42           C  
+ATOM     77  N   ALA A  20      27.207  -8.030  18.972  1.00 20.53           N  
+ATOM     78  CA  ALA A  20      28.520  -7.886  18.351  1.00 20.04           C  
+ATOM     79  C   ALA A  20      29.079  -6.480  18.487  1.00 19.87           C  
+ATOM     80  O   ALA A  20      28.329  -5.504  18.617  1.00 18.15           O  
+ATOM     81  CB  ALA A  20      28.448  -8.273  16.881  1.00 19.36           C  
+ATOM     82  N   ARG A  21      30.406  -6.390  18.456  1.00 19.83           N  
+ATOM     83  CA  ARG A  21      31.103  -5.117  18.573  1.00 21.76           C  
+ATOM     84  C   ARG A  21      32.265  -5.020  17.605  1.00 21.50           C  
+ATOM     85  O   ARG A  21      32.758  -6.022  17.104  1.00 22.90           O  
+ATOM     86  CB  ARG A  21      31.675  -4.931  19.979  1.00 21.30           C  
+ATOM     87  CG  ARG A  21      30.675  -4.792  21.089  1.00 24.36           C  
+ATOM     88  CD  ARG A  21      31.433  -4.597  22.388  1.00 24.85           C  
+ATOM     89  NE  ARG A  21      30.566  -4.593  23.556  1.00 26.57           N  
+ATOM     90  CZ  ARG A  21      30.102  -3.497  24.142  1.00 26.36           C  
+ATOM     91  NH1 ARG A  21      30.417  -2.292  23.670  1.00 25.17           N  
+ATOM     92  NH2 ARG A  21      29.330  -3.613  25.212  1.00 27.88           N  
+ATOM     93  N   GLU A  22      32.693  -3.788  17.364  1.00 21.45           N  
+ATOM     94  CA  GLU A  22      33.829  -3.487  16.510  1.00 22.58           C  
+ATOM     95  C   GLU A  22      34.196  -2.066  16.889  1.00 23.42           C  
+ATOM     96  O   GLU A  22      33.473  -1.121  16.559  1.00 23.10           O  
+ATOM     97  CB  GLU A  22      33.467  -3.549  15.025  1.00 23.13           C  
+ATOM     98  CG  GLU A  22      34.713  -3.522  14.139  1.00 22.03           C  
+ATOM     99  CD  GLU A  22      34.405  -3.580  12.662  1.00 20.99           C  
+ATOM    100  OE1 GLU A  22      33.532  -4.384  12.269  1.00 20.39           O  
+ATOM    101  OE2 GLU A  22      35.050  -2.829  11.896  1.00 19.02           O  
+ATOM    102  N   GLY A  23      35.313  -1.911  17.592  1.00 21.77           N  
+ATOM    103  CA  GLY A  23      35.701  -0.585  18.027  1.00 22.37           C  
+ATOM    104  C   GLY A  23      34.607  -0.150  18.980  1.00 21.23           C  
+ATOM    105  O   GLY A  23      34.173  -0.945  19.809  1.00 24.38           O  
+ATOM    106  N   LYS A  24      34.137   1.086  18.861  1.00 20.98           N  
+ATOM    107  CA  LYS A  24      33.071   1.570  19.736  1.00 21.19           C  
+ATOM    108  C   LYS A  24      31.685   1.162  19.223  1.00 20.38           C  
+ATOM    109  O   LYS A  24      30.686   1.298  19.929  1.00 21.06           O  
+ATOM    110  CB  LYS A  24      33.142   3.094  19.855  1.00 21.42           C  
+ATOM    111  CG  LYS A  24      34.388   3.605  20.568  1.00 20.29           C  
+ATOM    112  CD  LYS A  24      34.369   5.114  20.653  1.00 20.03           C  
+ATOM    113  CE  LYS A  24      35.521   5.651  21.496  1.00 23.87           C  
+ATOM    114  NZ  LYS A  24      35.408   7.131  21.682  1.00 22.31           N  
+ATOM    115  N   ALA A  25      31.633   0.657  17.995  1.00 19.65           N  
+ATOM    116  CA  ALA A  25      30.375   0.248  17.381  1.00 18.24           C  
+ATOM    117  C   ALA A  25      29.772  -1.019  17.987  1.00 18.89           C  
+ATOM    118  O   ALA A  25      30.483  -1.965  18.339  1.00 18.69           O  
+ATOM    119  CB  ALA A  25      30.573   0.070  15.868  1.00 17.83           C  
+ATOM    120  N   ARG A  26      28.451  -1.022  18.112  1.00 17.08           N  
+ATOM    121  CA  ARG A  26      27.736  -2.163  18.659  1.00 17.73           C  
+ATOM    122  C   ARG A  26      26.503  -2.454  17.812  1.00 17.98           C  
+ATOM    123  O   ARG A  26      25.938  -1.566  17.168  1.00 15.66           O  
+ATOM    124  CB  ARG A  26      27.270  -1.891  20.098  1.00 19.38           C  
+ATOM    125  CG  ARG A  26      28.313  -1.278  21.025  1.00 19.81           C  
+ATOM    126  CD  ARG A  26      28.109   0.226  21.149  1.00 21.04           C  
+ATOM    127  NE  ARG A  26      26.893   0.570  21.888  1.00 19.56           N  
+ATOM    128  CZ  ARG A  26      26.750   0.434  23.205  1.00 21.36           C  
+ATOM    129  NH1 ARG A  26      27.746  -0.042  23.941  1.00 20.54           N  
+ATOM    130  NH2 ARG A  26      25.609   0.778  23.791  1.00 18.53           N  
+ATOM    131  N   THR A  27      26.095  -3.710  17.810  1.00 17.47           N  
+ATOM    132  CA  THR A  27      24.898  -4.097  17.096  1.00 18.47           C  
+ATOM    133  C   THR A  27      24.218  -5.100  18.005  1.00 17.80           C  
+ATOM    134  O   THR A  27      24.878  -5.937  18.623  1.00 17.74           O  
+ATOM    135  CB  THR A  27      25.211  -4.731  15.719  1.00 18.24           C  
+ATOM    136  OG1 THR A  27      23.981  -4.961  15.021  1.00 20.80           O  
+ATOM    137  CG2 THR A  27      25.961  -6.046  15.873  1.00 17.86           C  
+ATOM    138  N   GLY A  28      22.903  -4.994  18.109  1.00 16.66           N  
+ATOM    139  CA  GLY A  28      22.167  -5.900  18.966  1.00 17.51           C  
+ATOM    140  C   GLY A  28      20.679  -5.647  18.876  1.00 17.50           C  
+ATOM    141  O   GLY A  28      20.169  -5.271  17.817  1.00 19.16           O  
+ATOM    142  N   THR A  29      19.978  -5.831  19.986  1.00 17.20           N  
+ATOM    143  CA  THR A  29      18.541  -5.633  19.983  1.00 18.91           C  
+ATOM    144  C   THR A  29      18.000  -5.146  21.307  1.00 18.99           C  
+ATOM    145  O   THR A  29      18.571  -5.404  22.367  1.00 18.02           O  
+ATOM    146  CB  THR A  29      17.806  -6.939  19.683  1.00 21.39           C  
+ATOM    147  OG1 THR A  29      18.144  -7.901  20.694  1.00 25.21           O  
+ATOM    148  CG2 THR A  29      18.193  -7.482  18.321  1.00 20.83           C  
+ATOM    149  N   ILE A  30      16.885  -4.432  21.230  1.00 17.71           N  
+ATOM    150  CA  ILE A  30      16.204  -3.957  22.418  1.00 17.90           C  
+ATOM    151  C   ILE A  30      14.866  -4.686  22.366  1.00 19.70           C  
+ATOM    152  O   ILE A  30      14.128  -4.559  21.385  1.00 18.79           O  
+ATOM    153  CB  ILE A  30      15.906  -2.446  22.379  1.00 17.06           C  
+ATOM    154  CG1 ILE A  30      17.198  -1.639  22.302  1.00 18.48           C  
+ATOM    155  CG2 ILE A  30      15.115  -2.056  23.612  1.00 17.46           C  
+ATOM    156  CD1 ILE A  30      16.964  -0.143  22.185  1.00 16.38           C  
+ATOM    157  N   GLU A  31      14.564  -5.469  23.395  1.00 19.31           N  
+ATOM    158  CA  GLU A  31      13.290  -6.170  23.435  1.00 19.87           C  
+ATOM    159  C   GLU A  31      12.313  -5.400  24.295  1.00 17.81           C  
+ATOM    160  O   GLU A  31      12.622  -5.031  25.430  1.00 16.16           O  
+ATOM    161  CB  GLU A  31      13.449  -7.589  23.991  1.00 21.70           C  
+ATOM    162  CG  GLU A  31      13.999  -8.569  22.981  1.00 26.45           C  
+ATOM    163  CD  GLU A  31      13.954  -9.998  23.472  1.00 31.42           C  
+ATOM    164  OE1 GLU A  31      14.221 -10.906  22.661  1.00 34.30           O  
+ATOM    165  OE2 GLU A  31      13.657 -10.213  24.666  1.00 34.45           O  
+ATOM    166  N   MET A  32      11.130  -5.159  23.745  1.00 17.13           N  
+ATOM    167  CA  MET A  32      10.089  -4.441  24.460  1.00 16.11           C  
+ATOM    168  C   MET A  32       8.778  -5.177  24.266  1.00 15.15           C  
+ATOM    169  O   MET A  32       8.657  -6.021  23.380  1.00 16.44           O  
+ATOM    170  CB  MET A  32       9.986  -3.003  23.946  1.00 16.72           C  
+ATOM    171  CG  MET A  32      11.251  -2.182  24.192  1.00 16.38           C  
+ATOM    172  SD  MET A  32      11.013  -0.392  24.027  1.00 18.45           S  
+ATOM    173  CE  MET A  32      10.244  -0.011  25.613  1.00 16.66           C  
+ATOM    174  N   LYS A  33       7.791  -4.867  25.089  1.00 15.02           N  
+ATOM    175  CA  LYS A  33       6.513  -5.549  24.966  1.00 18.71           C  
+ATOM    176  C   LYS A  33       5.918  -5.521  23.563  1.00 17.67           C  
+ATOM    177  O   LYS A  33       5.465  -6.548  23.068  1.00 17.86           O  
+ATOM    178  CB  LYS A  33       5.519  -4.987  25.983  1.00 20.81           C  
+ATOM    179  CG  LYS A  33       5.814  -5.475  27.393  1.00 26.92           C  
+ATOM    180  CD  LYS A  33       4.815  -4.968  28.411  1.00 31.54           C  
+ATOM    181  CE  LYS A  33       4.985  -5.714  29.730  1.00 34.48           C  
+ATOM    182  NZ  LYS A  33       6.401  -5.698  30.190  1.00 38.01           N  
+ATOM    183  N   ARG A  34       5.942  -4.369  22.904  1.00 17.70           N  
+ATOM    184  CA  ARG A  34       5.357  -4.281  21.564  1.00 17.46           C  
+ATOM    185  C   ARG A  34       6.235  -4.767  20.422  1.00 18.24           C  
+ATOM    186  O   ARG A  34       5.808  -4.750  19.266  1.00 19.32           O  
+ATOM    187  CB  ARG A  34       4.905  -2.853  21.276  1.00 19.21           C  
+ATOM    188  CG  ARG A  34       3.734  -2.405  22.123  1.00 18.56           C  
+ATOM    189  CD  ARG A  34       3.340  -0.994  21.759  1.00 20.43           C  
+ATOM    190  NE  ARG A  34       2.312  -0.475  22.649  1.00 24.07           N  
+ATOM    191  CZ  ARG A  34       1.008  -0.604  22.440  1.00 26.94           C  
+ATOM    192  NH1 ARG A  34       0.563  -1.236  21.358  1.00 27.77           N  
+ATOM    193  NH2 ARG A  34       0.152  -0.098  23.319  1.00 27.40           N  
+ATOM    194  N   GLY A  35       7.459  -5.188  20.727  1.00 17.22           N  
+ATOM    195  CA  GLY A  35       8.322  -5.677  19.670  1.00 17.42           C  
+ATOM    196  C   GLY A  35       9.810  -5.546  19.929  1.00 18.60           C  
+ATOM    197  O   GLY A  35      10.242  -5.008  20.954  1.00 16.62           O  
+ATOM    198  N   VAL A  36      10.595  -6.047  18.981  1.00 17.25           N  
+ATOM    199  CA  VAL A  36      12.047  -5.995  19.073  1.00 17.09           C  
+ATOM    200  C   VAL A  36      12.574  -4.875  18.185  1.00 16.00           C  
+ATOM    201  O   VAL A  36      12.068  -4.647  17.090  1.00 16.25           O  
+ATOM    202  CB  VAL A  36      12.684  -7.329  18.615  1.00 18.01           C  
+ATOM    203  CG1 VAL A  36      14.202  -7.258  18.749  1.00 18.56           C  
+ATOM    204  CG2 VAL A  36      12.116  -8.491  19.439  1.00 17.04           C  
+ATOM    205  N   ILE A  37      13.587  -4.173  18.670  1.00 15.02           N  
+ATOM    206  CA  ILE A  37      14.193  -3.093  17.914  1.00 15.40           C  
+ATOM    207  C   ILE A  37      15.635  -3.483  17.634  1.00 14.81           C  
+ATOM    208  O   ILE A  37      16.411  -3.724  18.560  1.00 14.59           O  
+ATOM    209  CB  ILE A  37      14.192  -1.768  18.711  1.00 16.32           C  
+ATOM    210  CG1 ILE A  37      12.758  -1.375  19.077  1.00 14.57           C  
+ATOM    211  CG2 ILE A  37      14.845  -0.669  17.884  1.00 13.93           C  
+ATOM    212  CD1 ILE A  37      12.655  -0.610  20.383  1.00 14.50           C  
+ATOM    213  N   ARG A  38      15.984  -3.547  16.357  1.00 14.22           N  
+ATOM    214  CA  ARG A  38      17.337  -3.890  15.945  1.00 13.45           C  
+ATOM    215  C   ARG A  38      18.185  -2.626  15.977  1.00 13.03           C  
+ATOM    216  O   ARG A  38      17.767  -1.584  15.475  1.00 14.08           O  
+ATOM    217  CB  ARG A  38      17.306  -4.480  14.537  1.00 13.37           C  
+ATOM    218  CG  ARG A  38      16.538  -5.789  14.449  1.00 16.65           C  
+ATOM    219  CD  ARG A  38      16.285  -6.184  12.997  1.00 18.01           C  
+ATOM    220  NE  ARG A  38      15.298  -5.308  12.371  1.00 16.59           N  
+ATOM    221  CZ  ARG A  38      14.995  -5.322  11.077  1.00 18.78           C  
+ATOM    222  NH1 ARG A  38      15.607  -6.168  10.255  1.00 18.45           N  
+ATOM    223  NH2 ARG A  38      14.074  -4.493  10.605  1.00 17.79           N  
+ATOM    224  N   THR A  39      19.371  -2.711  16.577  1.00 13.85           N  
+ATOM    225  CA  THR A  39      20.257  -1.556  16.673  1.00 13.57           C  
+ATOM    226  C   THR A  39      21.607  -1.863  16.029  1.00 14.35           C  
+ATOM    227  O   THR A  39      22.064  -2.997  16.055  1.00 14.86           O  
+ATOM    228  CB  THR A  39      20.502  -1.138  18.145  1.00 14.68           C  
+ATOM    229  OG1 THR A  39      21.315  -2.119  18.803  1.00 17.06           O  
+ATOM    230  CG2 THR A  39      19.184  -1.008  18.889  1.00 14.37           C  
+ATOM    231  N   PRO A  40      22.277  -0.841  15.469  1.00 14.57           N  
+ATOM    232  CA  PRO A  40      21.826   0.557  15.422  1.00 14.23           C  
+ATOM    233  C   PRO A  40      20.473   0.701  14.721  1.00 15.31           C  
+ATOM    234  O   PRO A  40      20.205   0.028  13.723  1.00 16.25           O  
+ATOM    235  CB  PRO A  40      22.956   1.258  14.671  1.00 12.64           C  
+ATOM    236  CG  PRO A  40      24.170   0.441  15.074  1.00 13.72           C  
+ATOM    237  CD  PRO A  40      23.647  -0.969  14.938  1.00 14.57           C  
+ATOM    238  N   ALA A  41      19.629   1.585  15.242  1.00 12.90           N  
+ATOM    239  CA  ALA A  41      18.298   1.777  14.680  1.00 12.87           C  
+ATOM    240  C   ALA A  41      18.001   3.192  14.204  1.00 12.73           C  
+ATOM    241  O   ALA A  41      18.477   4.166  14.789  1.00  9.41           O  
+ATOM    242  CB  ALA A  41      17.248   1.362  15.715  1.00 11.44           C  
+ATOM    243  N   PHE A  42      17.226   3.297  13.126  1.00 11.43           N  
+ATOM    244  CA  PHE A  42      16.809   4.599  12.624  1.00 11.48           C  
+ATOM    245  C   PHE A  42      15.304   4.665  12.818  1.00 11.06           C  
+ATOM    246  O   PHE A  42      14.568   3.783  12.361  1.00 10.68           O  
+ATOM    247  CB  PHE A  42      17.105   4.796  11.145  1.00 15.08           C  
+ATOM    248  CG  PHE A  42      16.683   6.147  10.647  1.00 18.67           C  
+ATOM    249  CD1 PHE A  42      17.453   7.271  10.926  1.00 20.33           C  
+ATOM    250  CD2 PHE A  42      15.470   6.312   9.980  1.00 19.06           C  
+ATOM    251  CE1 PHE A  42      17.022   8.550  10.551  1.00 24.54           C  
+ATOM    252  CE2 PHE A  42      15.025   7.582   9.601  1.00 22.29           C  
+ATOM    253  CZ  PHE A  42      15.805   8.706   9.889  1.00 21.53           C  
+ATOM    254  N   MET A  43      14.854   5.716  13.486  1.00  9.74           N  
+ATOM    255  CA  MET A  43      13.446   5.889  13.782  1.00 13.05           C  
+ATOM    256  C   MET A  43      12.772   6.943  12.926  1.00 14.15           C  
+ATOM    257  O   MET A  43      13.097   8.134  13.022  1.00 13.80           O  
+ATOM    258  CB  MET A  43      13.269   6.276  15.250  1.00 14.19           C  
+ATOM    259  CG  MET A  43      13.875   5.297  16.240  1.00 14.37           C  
+ATOM    260  SD  MET A  43      13.635   5.872  17.931  1.00 18.22           S  
+ATOM    261  CE  MET A  43      15.027   6.995  18.113  1.00 12.44           C  
+ATOM    262  N   PRO A  44      11.837   6.521  12.060  1.00 14.44           N  
+ATOM    263  CA  PRO A  44      11.149   7.508  11.225  1.00 13.90           C  
+ATOM    264  C   PRO A  44      10.377   8.402  12.189  1.00 14.60           C  
+ATOM    265  O   PRO A  44       9.999   7.963  13.276  1.00 10.67           O  
+ATOM    266  CB  PRO A  44      10.224   6.653  10.364  1.00 14.34           C  
+ATOM    267  CG  PRO A  44      11.003   5.357  10.218  1.00 13.47           C  
+ATOM    268  CD  PRO A  44      11.509   5.146  11.637  1.00 13.15           C  
+ATOM    269  N   VAL A  45      10.147   9.648  11.802  1.00 15.70           N  
+ATOM    270  CA  VAL A  45       9.433  10.566  12.670  1.00 20.05           C  
+ATOM    271  C   VAL A  45       7.986  10.801  12.262  1.00 21.80           C  
+ATOM    272  O   VAL A  45       7.679  11.040  11.092  1.00 22.65           O  
+ATOM    273  CB  VAL A  45      10.169  11.917  12.748  1.00 19.90           C  
+ATOM    274  CG1 VAL A  45       9.414  12.887  13.658  1.00 21.19           C  
+ATOM    275  CG2 VAL A  45      11.577  11.688  13.277  1.00 20.37           C  
+ATOM    276  N   GLY A  46       7.101  10.703  13.246  1.00 22.92           N  
+ATOM    277  CA  GLY A  46       5.688  10.938  13.023  1.00 26.87           C  
+ATOM    278  C   GLY A  46       5.387  12.240  13.732  1.00 28.62           C  
+ATOM    279  O   GLY A  46       5.233  12.267  14.950  1.00 31.78           O  
+ATOM    280  N   THR A  47       5.319  13.328  12.977  1.00 30.30           N  
+ATOM    281  CA  THR A  47       5.070  14.643  13.559  1.00 31.77           C  
+ATOM    282  C   THR A  47       3.707  14.802  14.230  1.00 32.02           C  
+ATOM    283  O   THR A  47       3.628  15.005  15.442  1.00 36.31           O  
+ATOM    284  CB  THR A  47       5.239  15.739  12.494  1.00 33.37           C  
+ATOM    285  OG1 THR A  47       6.561  15.659  11.946  1.00 33.64           O  
+ATOM    286  CG2 THR A  47       5.025  17.121  13.106  1.00 32.24           C  
+ATOM    287  N   ALA A  48       2.637  14.721  13.450  1.00 28.49           N  
+ATOM    288  CA  ALA A  48       1.298  14.866  14.008  1.00 27.19           C  
+ATOM    289  C   ALA A  48       0.565  13.535  13.979  1.00 23.67           C  
+ATOM    290  O   ALA A  48      -0.508  13.426  13.397  1.00 22.31           O  
+ATOM    291  CB  ALA A  48       0.511  15.911  13.220  1.00 28.51           C  
+ATOM    292  N   ALA A  49       1.156  12.527  14.613  1.00 21.24           N  
+ATOM    293  CA  ALA A  49       0.572  11.191  14.662  1.00 19.39           C  
+ATOM    294  C   ALA A  49       0.534  10.570  13.279  1.00 17.03           C  
+ATOM    295  O   ALA A  49      -0.389   9.836  12.945  1.00 18.31           O  
+ATOM    296  CB  ALA A  49      -0.838  11.237  15.256  1.00 17.38           C  
+ATOM    297  N   THR A  50       1.539  10.880  12.471  1.00 18.22           N  
+ATOM    298  CA  THR A  50       1.640  10.314  11.132  1.00 18.26           C  
+ATOM    299  C   THR A  50       3.038  10.460  10.565  1.00 19.02           C  
+ATOM    300  O   THR A  50       3.650  11.526  10.672  1.00 20.56           O  
+ATOM    301  CB  THR A  50       0.637  10.966  10.126  1.00 16.34           C  
+ATOM    302  OG1 THR A  50       0.890  10.452   8.811  1.00 17.43           O  
+ATOM    303  CG2 THR A  50       0.778  12.482  10.095  1.00 15.48           C  
+ATOM    304  N   VAL A  51       3.564   9.378   9.997  1.00 16.93           N  
+ATOM    305  CA  VAL A  51       4.866   9.462   9.364  1.00 17.02           C  
+ATOM    306  C   VAL A  51       4.459  10.025   8.004  1.00 18.05           C  
+ATOM    307  O   VAL A  51       3.788   9.360   7.215  1.00 19.04           O  
+ATOM    308  CB  VAL A  51       5.548   8.077   9.211  1.00 16.44           C  
+ATOM    309  CG1 VAL A  51       6.845   8.226   8.429  1.00 13.23           C  
+ATOM    310  CG2 VAL A  51       5.855   7.487  10.594  1.00 17.10           C  
+ATOM    311  N   LYS A  52       4.843  11.273   7.771  1.00 19.04           N  
+ATOM    312  CA  LYS A  52       4.511  12.015   6.558  1.00 20.93           C  
+ATOM    313  C   LYS A  52       4.325  11.219   5.276  1.00 19.22           C  
+ATOM    314  O   LYS A  52       5.253  10.589   4.785  1.00 18.10           O  
+ATOM    315  CB  LYS A  52       5.558  13.117   6.335  1.00 24.61           C  
+ATOM    316  CG  LYS A  52       5.313  14.017   5.123  1.00 29.89           C  
+ATOM    317  CD  LYS A  52       6.251  15.228   5.150  1.00 32.84           C  
+ATOM    318  CE  LYS A  52       6.174  16.050   3.870  1.00 35.84           C  
+ATOM    319  NZ  LYS A  52       6.768  15.330   2.706  1.00 37.50           N  
+ATOM    320  N   ALA A  53       3.100  11.252   4.755  1.00 18.30           N  
+ATOM    321  CA  ALA A  53       2.745  10.598   3.496  1.00 16.90           C  
+ATOM    322  C   ALA A  53       2.876   9.076   3.425  1.00 17.54           C  
+ATOM    323  O   ALA A  53       2.972   8.517   2.329  1.00 16.93           O  
+ATOM    324  CB  ALA A  53       3.545  11.234   2.365  1.00 18.33           C  
+ATOM    325  N   LEU A  54       2.863   8.404   4.572  1.00 13.59           N  
+ATOM    326  CA  LEU A  54       2.990   6.955   4.578  1.00 15.41           C  
+ATOM    327  C   LEU A  54       2.007   6.264   5.516  1.00 14.59           C  
+ATOM    328  O   LEU A  54       1.753   6.739   6.625  1.00 13.39           O  
+ATOM    329  CB  LEU A  54       4.413   6.548   4.988  1.00 16.37           C  
+ATOM    330  CG  LEU A  54       5.602   6.992   4.130  1.00 18.08           C  
+ATOM    331  CD1 LEU A  54       6.901   6.587   4.830  1.00 21.32           C  
+ATOM    332  CD2 LEU A  54       5.518   6.366   2.751  1.00 15.61           C  
+ATOM    333  N   LYS A  55       1.438   5.152   5.063  1.00 13.90           N  
+ATOM    334  CA  LYS A  55       0.553   4.381   5.929  1.00 13.91           C  
+ATOM    335  C   LYS A  55       1.519   3.644   6.846  1.00 13.02           C  
+ATOM    336  O   LYS A  55       2.651   3.367   6.454  1.00 11.44           O  
+ATOM    337  CB  LYS A  55      -0.255   3.344   5.148  1.00 12.37           C  
+ATOM    338  CG  LYS A  55      -1.472   3.889   4.418  1.00 12.17           C  
+ATOM    339  CD  LYS A  55      -2.186   2.772   3.676  1.00 14.13           C  
+ATOM    340  CE  LYS A  55      -3.458   3.261   2.994  1.00 10.98           C  
+ATOM    341  NZ  LYS A  55      -4.075   2.162   2.196  1.00 13.18           N  
+ATOM    342  N   PRO A  56       1.089   3.325   8.075  1.00 14.18           N  
+ATOM    343  CA  PRO A  56       1.933   2.612   9.039  1.00 14.98           C  
+ATOM    344  C   PRO A  56       2.504   1.320   8.450  1.00 14.38           C  
+ATOM    345  O   PRO A  56       3.652   0.947   8.729  1.00 13.48           O  
+ATOM    346  CB  PRO A  56       0.970   2.326  10.192  1.00 15.77           C  
+ATOM    347  CG  PRO A  56       0.039   3.480  10.140  1.00 15.52           C  
+ATOM    348  CD  PRO A  56      -0.223   3.643   8.665  1.00 13.89           C  
+ATOM    349  N   GLU A  57       1.699   0.626   7.650  1.00 13.35           N  
+ATOM    350  CA  GLU A  57       2.155  -0.621   7.041  1.00 14.00           C  
+ATOM    351  C   GLU A  57       3.321  -0.357   6.105  1.00 14.11           C  
+ATOM    352  O   GLU A  57       4.247  -1.158   6.015  1.00 15.54           O  
+ATOM    353  CB  GLU A  57       1.015  -1.300   6.281  1.00 18.88           C  
+ATOM    354  CG  GLU A  57       0.272  -0.373   5.342  1.00 23.60           C  
+ATOM    355  CD  GLU A  57      -0.967  -1.021   4.759  1.00 27.35           C  
+ATOM    356  OE1 GLU A  57      -0.824  -1.899   3.880  1.00 31.67           O  
+ATOM    357  OE2 GLU A  57      -2.083  -0.659   5.190  1.00 23.97           O  
+ATOM    358  N   THR A  58       3.283   0.773   5.410  1.00 14.30           N  
+ATOM    359  CA  THR A  58       4.366   1.120   4.498  1.00 14.78           C  
+ATOM    360  C   THR A  58       5.628   1.450   5.298  1.00 15.30           C  
+ATOM    361  O   THR A  58       6.740   1.100   4.900  1.00 16.07           O  
+ATOM    362  CB  THR A  58       3.984   2.321   3.624  1.00 14.68           C  
+ATOM    363  OG1 THR A  58       2.715   2.070   3.008  1.00 15.32           O  
+ATOM    364  CG2 THR A  58       5.016   2.529   2.539  1.00 13.72           C  
+ATOM    365  N   VAL A  59       5.457   2.123   6.430  1.00 14.65           N  
+ATOM    366  CA  VAL A  59       6.599   2.456   7.278  1.00 14.40           C  
+ATOM    367  C   VAL A  59       7.267   1.145   7.704  1.00 13.34           C  
+ATOM    368  O   VAL A  59       8.484   0.992   7.617  1.00 15.17           O  
+ATOM    369  CB  VAL A  59       6.146   3.250   8.533  1.00 14.56           C  
+ATOM    370  CG1 VAL A  59       7.315   3.434   9.504  1.00 14.67           C  
+ATOM    371  CG2 VAL A  59       5.607   4.603   8.107  1.00 10.70           C  
+ATOM    372  N   ARG A  60       6.457   0.193   8.148  1.00 13.98           N  
+ATOM    373  CA  ARG A  60       6.968  -1.101   8.577  1.00 13.51           C  
+ATOM    374  C   ARG A  60       7.606  -1.837   7.400  1.00 14.99           C  
+ATOM    375  O   ARG A  60       8.636  -2.493   7.554  1.00 15.36           O  
+ATOM    376  CB  ARG A  60       5.838  -1.954   9.165  1.00 14.35           C  
+ATOM    377  CG  ARG A  60       6.260  -3.388   9.492  1.00 13.99           C  
+ATOM    378  CD  ARG A  60       7.457  -3.389  10.439  1.00 15.37           C  
+ATOM    379  NE  ARG A  60       7.933  -4.738  10.724  1.00 16.55           N  
+ATOM    380  CZ  ARG A  60       9.011  -5.013  11.453  1.00 17.67           C  
+ATOM    381  NH1 ARG A  60       9.733  -4.033  11.977  1.00 13.75           N  
+ATOM    382  NH2 ARG A  60       9.368  -6.273  11.658  1.00 18.50           N  
+ATOM    383  N   ALA A  61       7.001  -1.717   6.224  1.00 13.82           N  
+ATOM    384  CA  ALA A  61       7.528  -2.392   5.041  1.00 16.84           C  
+ATOM    385  C   ALA A  61       8.943  -1.927   4.687  1.00 17.22           C  
+ATOM    386  O   ALA A  61       9.725  -2.694   4.118  1.00 17.73           O  
+ATOM    387  CB  ALA A  61       6.587  -2.191   3.856  1.00 16.44           C  
+ATOM    388  N   THR A  62       9.278  -0.682   5.024  1.00 16.47           N  
+ATOM    389  CA  THR A  62      10.621  -0.159   4.745  1.00 16.48           C  
+ATOM    390  C   THR A  62      11.659  -0.811   5.667  1.00 16.20           C  
+ATOM    391  O   THR A  62      12.860  -0.741   5.407  1.00 16.64           O  
+ATOM    392  CB  THR A  62      10.710   1.368   4.966  1.00 16.67           C  
+ATOM    393  OG1 THR A  62      10.573   1.657   6.364  1.00 17.23           O  
+ATOM    394  CG2 THR A  62       9.613   2.096   4.195  1.00 19.88           C  
+ATOM    395  N   GLY A  63      11.195  -1.420   6.757  1.00 14.43           N  
+ATOM    396  CA  GLY A  63      12.108  -2.069   7.683  1.00 13.46           C  
+ATOM    397  C   GLY A  63      12.156  -1.458   9.075  1.00 13.76           C  
+ATOM    398  O   GLY A  63      12.823  -1.997   9.964  1.00 10.97           O  
+ATOM    399  N   ALA A  64      11.439  -0.354   9.284  1.00 10.71           N  
+ATOM    400  CA  ALA A  64      11.436   0.311  10.586  1.00 11.15           C  
+ATOM    401  C   ALA A  64      10.850  -0.559  11.703  1.00 12.31           C  
+ATOM    402  O   ALA A  64       9.796  -1.179  11.529  1.00 11.09           O  
+ATOM    403  CB  ALA A  64      10.668   1.634  10.496  1.00  7.98           C  
+ATOM    404  N   ASP A  65      11.538  -0.605  12.845  1.00 11.96           N  
+ATOM    405  CA  ASP A  65      11.074  -1.389  14.000  1.00 13.50           C  
+ATOM    406  C   ASP A  65      10.406  -0.488  15.029  1.00 13.00           C  
+ATOM    407  O   ASP A  65       9.710  -0.965  15.933  1.00 12.06           O  
+ATOM    408  CB  ASP A  65      12.231  -2.080  14.728  1.00 12.70           C  
+ATOM    409  CG  ASP A  65      12.948  -3.083  13.874  1.00 14.21           C  
+ATOM    410  OD1 ASP A  65      12.270  -3.837  13.145  1.00 15.75           O  
+ATOM    411  OD2 ASP A  65      14.192  -3.125  13.953  1.00 13.57           O  
+ATOM    412  N   ILE A  66      10.638   0.811  14.893  1.00 10.70           N  
+ATOM    413  CA  ILE A  66      10.108   1.778  15.838  1.00 12.56           C  
+ATOM    414  C   ILE A  66      10.055   3.151  15.190  1.00 13.19           C  
+ATOM    415  O   ILE A  66      10.847   3.450  14.297  1.00 14.97           O  
+ATOM    416  CB  ILE A  66      11.024   1.833  17.089  1.00 10.65           C  
+ATOM    417  CG1 ILE A  66      10.646   3.005  17.996  1.00 13.34           C  
+ATOM    418  CG2 ILE A  66      12.476   1.944  16.644  1.00 12.30           C  
+ATOM    419  CD1 ILE A  66      11.367   2.989  19.336  1.00 13.81           C  
+ATOM    420  N   ILE A  67       9.117   3.978  15.635  1.00 13.69           N  
+ATOM    421  CA  ILE A  67       8.992   5.329  15.108  1.00 14.17           C  
+ATOM    422  C   ILE A  67       9.014   6.304  16.278  1.00 17.48           C  
+ATOM    423  O   ILE A  67       8.847   5.905  17.437  1.00 15.92           O  
+ATOM    424  CB  ILE A  67       7.685   5.511  14.287  1.00 13.57           C  
+ATOM    425  CG1 ILE A  67       6.453   5.214  15.145  1.00 14.58           C  
+ATOM    426  CG2 ILE A  67       7.689   4.579  13.087  1.00  5.22           C  
+ATOM    427  CD1 ILE A  67       6.069   6.320  16.073  1.00 25.21           C  
+ATOM    428  N   LEU A  68       9.233   7.579  15.979  1.00 17.92           N  
+ATOM    429  CA  LEU A  68       9.275   8.593  17.020  1.00 19.66           C  
+ATOM    430  C   LEU A  68       8.040   9.477  16.941  1.00 18.88           C  
+ATOM    431  O   LEU A  68       7.640   9.902  15.861  1.00 19.25           O  
+ATOM    432  CB  LEU A  68      10.547   9.439  16.875  1.00 20.38           C  
+ATOM    433  CG  LEU A  68      10.789  10.571  17.883  1.00 22.51           C  
+ATOM    434  CD1 LEU A  68      12.269  10.907  17.918  1.00 23.39           C  
+ATOM    435  CD2 LEU A  68       9.980  11.803  17.497  1.00 24.38           C  
+ATOM    436  N   GLY A  69       7.427   9.734  18.089  1.00 20.01           N  
+ATOM    437  CA  GLY A  69       6.258  10.594  18.123  1.00 22.14           C  
+ATOM    438  C   GLY A  69       6.628  11.891  18.820  1.00 24.05           C  
+ATOM    439  O   GLY A  69       7.258  11.864  19.869  1.00 23.48           O  
+ATOM    440  N   ASN A  70       6.257  13.028  18.243  1.00 27.34           N  
+ATOM    441  CA  ASN A  70       6.569  14.322  18.849  1.00 30.33           C  
+ATOM    442  C   ASN A  70       5.489  14.729  19.852  1.00 31.40           C  
+ATOM    443  O   ASN A  70       4.325  14.903  19.489  1.00 34.38           O  
+ATOM    444  CB  ASN A  70       6.714  15.393  17.758  1.00 30.67           C  
+ATOM    445  CG  ASN A  70       8.018  15.265  16.976  1.00 31.88           C  
+ATOM    446  OD1 ASN A  70       8.067  15.561  15.784  1.00 32.00           O  
+ATOM    447  ND2 ASN A  70       9.080  14.837  17.650  1.00 30.11           N  
+ATOM    448  N   THR A  71       5.882  14.873  21.114  1.00 32.75           N  
+ATOM    449  CA  THR A  71       4.953  15.244  22.179  1.00 33.90           C  
+ATOM    450  C   THR A  71       4.392  16.658  22.038  1.00 34.91           C  
+ATOM    451  O   THR A  71       3.183  16.868  22.152  1.00 35.20           O  
+ATOM    452  CB  THR A  71       5.623  15.105  23.569  1.00 34.10           C  
+ATOM    453  OG1 THR A  71       5.821  13.716  23.865  1.00 35.06           O  
+ATOM    454  CG2 THR A  71       4.756  15.721  24.657  1.00 34.94           C  
+ATOM    455  N   TYR A  72       5.268  17.625  21.791  1.00 34.49           N  
+ATOM    456  CA  TYR A  72       4.843  19.010  21.646  1.00 34.72           C  
+ATOM    457  C   TYR A  72       3.644  19.132  20.714  1.00 33.52           C  
+ATOM    458  O   TYR A  72       2.596  19.656  21.092  1.00 32.63           O  
+ATOM    459  CB  TYR A  72       5.993  19.866  21.108  1.00 36.23           C  
+ATOM    460  CG  TYR A  72       5.602  21.300  20.826  1.00 37.85           C  
+ATOM    461  CD1 TYR A  72       5.284  22.174  21.865  1.00 38.50           C  
+ATOM    462  CD2 TYR A  72       5.538  21.778  19.518  1.00 38.67           C  
+ATOM    463  CE1 TYR A  72       4.912  23.487  21.609  1.00 40.19           C  
+ATOM    464  CE2 TYR A  72       5.167  23.091  19.250  1.00 40.28           C  
+ATOM    465  CZ  TYR A  72       4.854  23.941  20.300  1.00 40.66           C  
+ATOM    466  OH  TYR A  72       4.474  25.241  20.042  1.00 41.22           O  
+ATOM    467  N   HIS A  73       3.802  18.640  19.494  1.00 32.06           N  
+ATOM    468  CA  HIS A  73       2.738  18.715  18.506  1.00 30.82           C  
+ATOM    469  C   HIS A  73       1.460  18.005  18.932  1.00 28.99           C  
+ATOM    470  O   HIS A  73       0.363  18.537  18.769  1.00 26.11           O  
+ATOM    471  CB  HIS A  73       3.234  18.141  17.182  1.00 34.69           C  
+ATOM    472  CG  HIS A  73       4.336  18.940  16.559  1.00 39.29           C  
+ATOM    473  ND1 HIS A  73       4.131  20.191  16.016  1.00 40.50           N  
+ATOM    474  CD2 HIS A  73       5.655  18.675  16.409  1.00 40.07           C  
+ATOM    475  CE1 HIS A  73       5.277  20.662  15.558  1.00 41.74           C  
+ATOM    476  NE2 HIS A  73       6.217  19.762  15.784  1.00 42.44           N  
+ATOM    477  N   LEU A  74       1.609  16.804  19.482  1.00 29.06           N  
+ATOM    478  CA  LEU A  74       0.468  16.005  19.918  1.00 28.87           C  
+ATOM    479  C   LEU A  74      -0.332  16.646  21.049  1.00 28.23           C  
+ATOM    480  O   LEU A  74      -1.560  16.578  21.063  1.00 25.62           O  
+ATOM    481  CB  LEU A  74       0.948  14.613  20.345  1.00 29.73           C  
+ATOM    482  CG  LEU A  74       1.528  13.743  19.223  1.00 31.16           C  
+ATOM    483  CD1 LEU A  74       2.261  12.554  19.809  1.00 31.50           C  
+ATOM    484  CD2 LEU A  74       0.406  13.290  18.302  1.00 31.14           C  
+ATOM    485  N   MET A  75       0.359  17.266  21.999  1.00 27.84           N  
+ATOM    486  CA  MET A  75      -0.325  17.893  23.119  1.00 28.96           C  
+ATOM    487  C   MET A  75      -1.142  19.086  22.646  1.00 29.95           C  
+ATOM    488  O   MET A  75      -2.085  19.508  23.314  1.00 29.98           O  
+ATOM    489  CB  MET A  75       0.678  18.332  24.192  1.00 28.44           C  
+ATOM    490  CG  MET A  75       1.608  19.463  23.784  1.00 30.86           C  
+ATOM    491  SD  MET A  75       2.686  19.994  25.141  1.00 32.32           S  
+ATOM    492  CE  MET A  75       4.109  18.963  24.872  1.00 36.11           C  
+ATOM    493  N   LEU A  76      -0.781  19.625  21.487  1.00 31.04           N  
+ATOM    494  CA  LEU A  76      -1.494  20.769  20.935  1.00 34.57           C  
+ATOM    495  C   LEU A  76      -2.611  20.384  19.968  1.00 36.09           C  
+ATOM    496  O   LEU A  76      -3.792  20.476  20.305  1.00 36.35           O  
+ATOM    497  CB  LEU A  76      -0.519  21.712  20.221  1.00 34.39           C  
+ATOM    498  CG  LEU A  76       0.444  22.533  21.081  1.00 34.77           C  
+ATOM    499  CD1 LEU A  76       1.362  23.344  20.180  1.00 36.06           C  
+ATOM    500  CD2 LEU A  76      -0.343  23.453  22.005  1.00 33.44           C  
+ATOM    501  N   ARG A  77      -2.234  19.945  18.771  1.00 38.60           N  
+ATOM    502  CA  ARG A  77      -3.210  19.594  17.744  1.00 39.97           C  
+ATOM    503  C   ARG A  77      -4.345  18.672  18.207  1.00 39.67           C  
+ATOM    504  O   ARG A  77      -5.480  19.127  18.368  1.00 42.18           O  
+ATOM    505  CB  ARG A  77      -2.503  19.001  16.519  1.00 42.32           C  
+ATOM    506  CG  ARG A  77      -3.430  18.742  15.343  1.00 43.83           C  
+ATOM    507  CD  ARG A  77      -3.737  20.013  14.568  1.00 45.91           C  
+ATOM    508  NE  ARG A  77      -2.586  20.449  13.780  1.00 47.53           N  
+ATOM    509  CZ  ARG A  77      -2.603  21.464  12.921  1.00 47.76           C  
+ATOM    510  NH1 ARG A  77      -3.714  22.163  12.733  1.00 47.01           N  
+ATOM    511  NH2 ARG A  77      -1.508  21.770  12.237  1.00 47.87           N  
+ATOM    512  N   PRO A  78      -4.070  17.372  18.430  1.00 37.00           N  
+ATOM    513  CA  PRO A  78      -5.187  16.524  18.868  1.00 35.21           C  
+ATOM    514  C   PRO A  78      -5.449  16.541  20.375  1.00 32.19           C  
+ATOM    515  O   PRO A  78      -6.599  16.471  20.809  1.00 32.52           O  
+ATOM    516  CB  PRO A  78      -4.782  15.146  18.361  1.00 35.57           C  
+ATOM    517  CG  PRO A  78      -3.303  15.164  18.575  1.00 36.90           C  
+ATOM    518  CD  PRO A  78      -2.892  16.550  18.095  1.00 35.35           C  
+ATOM    519  N   GLY A  79      -4.381  16.633  21.165  1.00 29.84           N  
+ATOM    520  CA  GLY A  79      -4.521  16.656  22.614  1.00 27.16           C  
+ATOM    521  C   GLY A  79      -4.138  15.332  23.254  1.00 25.73           C  
+ATOM    522  O   GLY A  79      -4.553  14.272  22.789  1.00 23.85           O  
+ATOM    523  N   ALA A  80      -3.347  15.385  24.323  1.00 24.23           N  
+ATOM    524  CA  ALA A  80      -2.911  14.169  25.006  1.00 23.78           C  
+ATOM    525  C   ALA A  80      -4.095  13.404  25.576  1.00 22.24           C  
+ATOM    526  O   ALA A  80      -4.243  12.202  25.339  1.00 21.91           O  
+ATOM    527  CB  ALA A  80      -1.930  14.511  26.124  1.00 20.06           C  
+ATOM    528  N   GLU A  81      -4.928  14.104  26.337  1.00 22.02           N  
+ATOM    529  CA  GLU A  81      -6.107  13.497  26.948  1.00 22.87           C  
+ATOM    530  C   GLU A  81      -7.021  12.875  25.892  1.00 20.99           C  
+ATOM    531  O   GLU A  81      -7.556  11.786  26.086  1.00 19.39           O  
+ATOM    532  CB  GLU A  81      -6.901  14.545  27.738  1.00 23.56           C  
+ATOM    533  CG  GLU A  81      -6.350  14.899  29.127  1.00 28.05           C  
+ATOM    534  CD  GLU A  81      -4.952  15.489  29.092  1.00 27.55           C  
+ATOM    535  OE1 GLU A  81      -4.606  16.160  28.096  1.00 27.86           O  
+ATOM    536  OE2 GLU A  81      -4.204  15.291  30.073  1.00 29.46           O  
+ATOM    537  N   ARG A  82      -7.200  13.569  24.774  1.00 19.92           N  
+ATOM    538  CA  ARG A  82      -8.071  13.060  23.717  1.00 21.21           C  
+ATOM    539  C   ARG A  82      -7.574  11.739  23.134  1.00 19.47           C  
+ATOM    540  O   ARG A  82      -8.347  10.797  22.954  1.00 20.26           O  
+ATOM    541  CB  ARG A  82      -8.227  14.101  22.602  1.00 20.72           C  
+ATOM    542  CG  ARG A  82      -9.070  13.619  21.425  1.00 22.43           C  
+ATOM    543  CD  ARG A  82      -9.446  14.770  20.504  1.00 24.87           C  
+ATOM    544  NE  ARG A  82     -10.426  15.658  21.127  1.00 29.62           N  
+ATOM    545  CZ  ARG A  82     -10.791  16.838  20.633  1.00 31.37           C  
+ATOM    546  NH1 ARG A  82     -10.259  17.286  19.503  1.00 33.09           N  
+ATOM    547  NH2 ARG A  82     -11.692  17.573  21.268  1.00 31.49           N  
+ATOM    548  N   ILE A  83      -6.282  11.667  22.840  1.00 19.56           N  
+ATOM    549  CA  ILE A  83      -5.712  10.446  22.281  1.00 19.10           C  
+ATOM    550  C   ILE A  83      -5.865   9.279  23.255  1.00 18.80           C  
+ATOM    551  O   ILE A  83      -6.184   8.160  22.845  1.00 18.15           O  
+ATOM    552  CB  ILE A  83      -4.228  10.650  21.920  1.00 17.55           C  
+ATOM    553  CG1 ILE A  83      -4.131  11.582  20.711  1.00 21.17           C  
+ATOM    554  CG2 ILE A  83      -3.560   9.316  21.619  1.00 17.35           C  
+ATOM    555  CD1 ILE A  83      -2.705  11.842  20.234  1.00 23.52           C  
+ATOM    556  N   ALA A  84      -5.649   9.540  24.542  1.00 18.69           N  
+ATOM    557  CA  ALA A  84      -5.787   8.492  25.552  1.00 19.52           C  
+ATOM    558  C   ALA A  84      -7.221   7.973  25.539  1.00 20.89           C  
+ATOM    559  O   ALA A  84      -7.451   6.763  25.538  1.00 22.39           O  
+ATOM    560  CB  ALA A  84      -5.446   9.035  26.931  1.00 17.63           C  
+ATOM    561  N   LYS A  85      -8.183   8.891  25.515  1.00 23.12           N  
+ATOM    562  CA  LYS A  85      -9.592   8.512  25.497  1.00 26.94           C  
+ATOM    563  C   LYS A  85      -9.918   7.716  24.238  1.00 26.48           C  
+ATOM    564  O   LYS A  85     -10.805   6.868  24.242  1.00 26.37           O  
+ATOM    565  CB  LYS A  85     -10.479   9.756  25.573  1.00 30.32           C  
+ATOM    566  CG  LYS A  85     -10.364  10.501  26.894  1.00 37.26           C  
+ATOM    567  CD  LYS A  85     -11.279  11.719  26.964  1.00 41.65           C  
+ATOM    568  CE  LYS A  85     -12.756  11.335  26.950  1.00 45.87           C  
+ATOM    569  NZ  LYS A  85     -13.188  10.736  25.655  1.00 47.92           N  
+ATOM    570  N   LEU A  86      -9.187   7.991  23.163  1.00 26.33           N  
+ATOM    571  CA  LEU A  86      -9.392   7.299  21.896  1.00 25.06           C  
+ATOM    572  C   LEU A  86      -8.667   5.952  21.849  1.00 24.06           C  
+ATOM    573  O   LEU A  86      -8.756   5.229  20.857  1.00 22.64           O  
+ATOM    574  CB  LEU A  86      -8.936   8.195  20.738  1.00 25.32           C  
+ATOM    575  CG  LEU A  86      -9.997   9.062  20.046  1.00 26.78           C  
+ATOM    576  CD1 LEU A  86     -11.071   9.504  21.021  1.00 27.88           C  
+ATOM    577  CD2 LEU A  86      -9.316  10.256  19.401  1.00 24.84           C  
+ATOM    578  N   GLY A  87      -7.952   5.620  22.923  1.00 23.14           N  
+ATOM    579  CA  GLY A  87      -7.252   4.348  22.983  1.00 21.46           C  
+ATOM    580  C   GLY A  87      -5.738   4.403  22.879  1.00 21.68           C  
+ATOM    581  O   GLY A  87      -5.076   3.363  22.812  1.00 21.11           O  
+ATOM    582  N   GLY A  88      -5.176   5.606  22.863  1.00 21.37           N  
+ATOM    583  CA  GLY A  88      -3.731   5.721  22.768  1.00 20.21           C  
+ATOM    584  C   GLY A  88      -3.247   5.950  21.349  1.00 19.14           C  
+ATOM    585  O   GLY A  88      -3.972   5.699  20.387  1.00 18.77           O  
+ATOM    586  N   LEU A  89      -2.006   6.412  21.225  1.00 17.17           N  
+ATOM    587  CA  LEU A  89      -1.405   6.714  19.929  1.00 16.41           C  
+ATOM    588  C   LEU A  89      -1.281   5.514  18.984  1.00 15.91           C  
+ATOM    589  O   LEU A  89      -1.547   5.639  17.791  1.00 14.63           O  
+ATOM    590  CB  LEU A  89      -0.032   7.364  20.149  1.00 15.11           C  
+ATOM    591  CG  LEU A  89       0.758   7.910  18.958  1.00 16.07           C  
+ATOM    592  CD1 LEU A  89      -0.114   8.880  18.178  1.00 15.70           C  
+ATOM    593  CD2 LEU A  89       2.035   8.615  19.462  1.00 10.40           C  
+ATOM    594  N   HIS A  90      -0.880   4.357  19.507  1.00 15.67           N  
+ATOM    595  CA  HIS A  90      -0.732   3.171  18.673  1.00 15.87           C  
+ATOM    596  C   HIS A  90      -2.038   2.869  17.955  1.00 16.20           C  
+ATOM    597  O   HIS A  90      -2.071   2.693  16.739  1.00 17.41           O  
+ATOM    598  CB  HIS A  90      -0.325   1.950  19.511  1.00 13.81           C  
+ATOM    599  CG  HIS A  90       1.052   2.044  20.093  1.00 13.52           C  
+ATOM    600  ND1 HIS A  90       1.322   2.716  21.266  1.00 12.66           N  
+ATOM    601  CD2 HIS A  90       2.240   1.571  19.648  1.00 10.05           C  
+ATOM    602  CE1 HIS A  90       2.618   2.656  21.518  1.00 11.46           C  
+ATOM    603  NE2 HIS A  90       3.198   1.966  20.552  1.00 11.44           N  
+ATOM    604  N   SER A  91      -3.109   2.802  18.732  1.00 16.84           N  
+ATOM    605  CA  SER A  91      -4.432   2.528  18.206  1.00 17.51           C  
+ATOM    606  C   SER A  91      -4.874   3.656  17.275  1.00 17.45           C  
+ATOM    607  O   SER A  91      -5.362   3.413  16.174  1.00 16.78           O  
+ATOM    608  CB  SER A  91      -5.415   2.387  19.374  1.00 17.13           C  
+ATOM    609  OG  SER A  91      -6.744   2.280  18.915  1.00 22.60           O  
+ATOM    610  N   PHE A  92      -4.686   4.889  17.732  1.00 15.87           N  
+ATOM    611  CA  PHE A  92      -5.062   6.087  16.982  1.00 16.80           C  
+ATOM    612  C   PHE A  92      -4.497   6.114  15.557  1.00 16.82           C  
+ATOM    613  O   PHE A  92      -5.248   6.254  14.589  1.00 17.53           O  
+ATOM    614  CB  PHE A  92      -4.594   7.325  17.765  1.00 13.63           C  
+ATOM    615  CG  PHE A  92      -5.113   8.633  17.234  1.00 13.96           C  
+ATOM    616  CD1 PHE A  92      -6.476   8.860  17.108  1.00 14.41           C  
+ATOM    617  CD2 PHE A  92      -4.235   9.660  16.915  1.00 11.41           C  
+ATOM    618  CE1 PHE A  92      -6.957  10.094  16.675  1.00 14.98           C  
+ATOM    619  CE2 PHE A  92      -4.701  10.894  16.482  1.00 13.34           C  
+ATOM    620  CZ  PHE A  92      -6.066  11.115  16.361  1.00 13.41           C  
+ATOM    621  N   MET A  93      -3.182   5.951  15.426  1.00 15.61           N  
+ATOM    622  CA  MET A  93      -2.546   5.999  14.112  1.00 15.32           C  
+ATOM    623  C   MET A  93      -2.355   4.651  13.407  1.00 14.48           C  
+ATOM    624  O   MET A  93      -1.973   4.611  12.235  1.00 15.12           O  
+ATOM    625  CB  MET A  93      -1.198   6.738  14.210  1.00 16.43           C  
+ATOM    626  CG  MET A  93      -0.085   5.983  14.926  1.00 18.94           C  
+ATOM    627  SD  MET A  93       1.435   6.990  15.075  1.00 18.96           S  
+ATOM    628  CE  MET A  93       2.031   6.957  13.380  1.00 16.76           C  
+ATOM    629  N   GLY A  94      -2.619   3.553  14.107  1.00 12.58           N  
+ATOM    630  CA  GLY A  94      -2.475   2.246  13.487  1.00 12.06           C  
+ATOM    631  C   GLY A  94      -1.068   1.676  13.395  1.00 13.84           C  
+ATOM    632  O   GLY A  94      -0.740   0.980  12.434  1.00 12.94           O  
+ATOM    633  N   TRP A  95      -0.231   1.981  14.381  1.00 13.15           N  
+ATOM    634  CA  TRP A  95       1.139   1.457  14.448  1.00 15.98           C  
+ATOM    635  C   TRP A  95       1.180   0.692  15.769  1.00 14.67           C  
+ATOM    636  O   TRP A  95       1.046   1.298  16.830  1.00 15.00           O  
+ATOM    637  CB  TRP A  95       2.157   2.609  14.456  1.00 14.98           C  
+ATOM    638  CG  TRP A  95       3.571   2.167  14.718  1.00 16.59           C  
+ATOM    639  CD1 TRP A  95       4.204   2.110  15.929  1.00 15.44           C  
+ATOM    640  CD2 TRP A  95       4.525   1.711  13.747  1.00 16.29           C  
+ATOM    641  NE1 TRP A  95       5.491   1.650  15.774  1.00 16.70           N  
+ATOM    642  CE2 TRP A  95       5.716   1.398  14.445  1.00 16.45           C  
+ATOM    643  CE3 TRP A  95       4.490   1.536  12.356  1.00 13.56           C  
+ATOM    644  CZ2 TRP A  95       6.864   0.921  13.797  1.00 16.79           C  
+ATOM    645  CZ3 TRP A  95       5.634   1.061  11.713  1.00 15.24           C  
+ATOM    646  CH2 TRP A  95       6.804   0.760  12.437  1.00 13.99           C  
+ATOM    647  N   ASP A  96       1.330  -0.632  15.708  1.00 15.48           N  
+ATOM    648  CA  ASP A  96       1.324  -1.436  16.930  1.00 16.20           C  
+ATOM    649  C   ASP A  96       2.685  -1.812  17.496  1.00 14.84           C  
+ATOM    650  O   ASP A  96       2.762  -2.583  18.451  1.00 14.81           O  
+ATOM    651  CB  ASP A  96       0.496  -2.715  16.737  1.00 18.27           C  
+ATOM    652  CG  ASP A  96       1.060  -3.635  15.665  1.00 21.60           C  
+ATOM    653  OD1 ASP A  96       2.262  -3.543  15.343  1.00 21.74           O  
+ATOM    654  OD2 ASP A  96       0.295  -4.475  15.153  1.00 24.16           O  
+ATOM    655  N   ARG A  97       3.749  -1.260  16.924  1.00 14.92           N  
+ATOM    656  CA  ARG A  97       5.098  -1.541  17.398  1.00 15.05           C  
+ATOM    657  C   ARG A  97       5.576  -0.437  18.341  1.00 14.00           C  
+ATOM    658  O   ARG A  97       4.831   0.497  18.631  1.00 13.43           O  
+ATOM    659  CB  ARG A  97       6.042  -1.723  16.202  1.00 15.63           C  
+ATOM    660  CG  ARG A  97       5.844  -3.080  15.527  1.00 19.35           C  
+ATOM    661  CD  ARG A  97       6.611  -3.230  14.228  1.00 19.18           C  
+ATOM    662  NE  ARG A  97       6.368  -4.547  13.647  1.00 23.51           N  
+ATOM    663  CZ  ARG A  97       6.964  -5.668  14.044  1.00 26.96           C  
+ATOM    664  NH1 ARG A  97       7.856  -5.639  15.027  1.00 26.35           N  
+ATOM    665  NH2 ARG A  97       6.657  -6.824  13.465  1.00 26.11           N  
+ATOM    666  N   PRO A  98       6.809  -0.545  18.859  1.00 12.40           N  
+ATOM    667  CA  PRO A  98       7.279   0.498  19.770  1.00 13.50           C  
+ATOM    668  C   PRO A  98       7.253   1.912  19.204  1.00 14.17           C  
+ATOM    669  O   PRO A  98       7.412   2.132  18.001  1.00 13.57           O  
+ATOM    670  CB  PRO A  98       8.699   0.048  20.111  1.00 13.24           C  
+ATOM    671  CG  PRO A  98       8.606  -1.439  20.019  1.00 11.02           C  
+ATOM    672  CD  PRO A  98       7.800  -1.633  18.761  1.00 11.69           C  
+ATOM    673  N   ILE A  99       7.048   2.864  20.102  1.00 13.80           N  
+ATOM    674  CA  ILE A  99       7.022   4.272  19.758  1.00 14.23           C  
+ATOM    675  C   ILE A  99       7.807   5.012  20.823  1.00 13.39           C  
+ATOM    676  O   ILE A  99       7.565   4.837  22.013  1.00 15.85           O  
+ATOM    677  CB  ILE A  99       5.588   4.840  19.767  1.00 14.09           C  
+ATOM    678  CG1 ILE A  99       4.808   4.335  18.549  1.00 12.14           C  
+ATOM    679  CG2 ILE A  99       5.632   6.359  19.806  1.00 13.31           C  
+ATOM    680  CD1 ILE A  99       3.366   4.833  18.517  1.00 11.81           C  
+ATOM    681  N   LEU A 100       8.755   5.825  20.393  1.00 15.28           N  
+ATOM    682  CA  LEU A 100       9.530   6.634  21.318  1.00 15.25           C  
+ATOM    683  C   LEU A 100       8.996   8.056  21.154  1.00 15.73           C  
+ATOM    684  O   LEU A 100       8.836   8.541  20.037  1.00 15.80           O  
+ATOM    685  CB  LEU A 100      11.024   6.572  20.963  1.00 15.84           C  
+ATOM    686  CG  LEU A 100      12.007   7.356  21.849  1.00 15.28           C  
+ATOM    687  CD1 LEU A 100      13.388   6.724  21.744  1.00 13.06           C  
+ATOM    688  CD2 LEU A 100      12.049   8.824  21.434  1.00 12.89           C  
+ATOM    689  N   THR A 101       8.678   8.716  22.258  1.00 15.63           N  
+ATOM    690  CA  THR A 101       8.187  10.085  22.177  1.00 17.26           C  
+ATOM    691  C   THR A 101       9.202  11.028  22.811  1.00 17.93           C  
+ATOM    692  O   THR A 101       9.809  10.689  23.833  1.00 17.16           O  
+ATOM    693  CB  THR A 101       6.840  10.250  22.912  1.00 18.23           C  
+ATOM    694  OG1 THR A 101       6.959   9.745  24.250  1.00 18.72           O  
+ATOM    695  CG2 THR A 101       5.736   9.492  22.179  1.00 18.38           C  
+ATOM    696  N   ASP A 102       9.420  12.190  22.198  1.00 16.97           N  
+ATOM    697  CA  ASP A 102      10.343  13.151  22.789  1.00 20.26           C  
+ATOM    698  C   ASP A 102       9.553  13.812  23.917  1.00 20.99           C  
+ATOM    699  O   ASP A 102       8.350  13.604  24.027  1.00 19.06           O  
+ATOM    700  CB  ASP A 102      10.818  14.197  21.768  1.00 22.17           C  
+ATOM    701  CG  ASP A 102       9.677  14.900  21.057  1.00 25.16           C  
+ATOM    702  OD1 ASP A 102       8.543  14.915  21.575  1.00 28.38           O  
+ATOM    703  OD2 ASP A 102       9.926  15.460  19.973  1.00 30.38           O  
+ATOM    704  N   SER A 103      10.215  14.604  24.749  1.00 22.98           N  
+ATOM    705  CA  SER A 103       9.544  15.237  25.878  1.00 24.65           C  
+ATOM    706  C   SER A 103       8.758  16.513  25.565  1.00 25.69           C  
+ATOM    707  O   SER A 103       7.943  16.950  26.375  1.00 25.64           O  
+ATOM    708  CB  SER A 103      10.568  15.527  26.973  1.00 25.69           C  
+ATOM    709  OG  SER A 103      11.621  16.331  26.476  1.00 28.44           O  
+ATOM    710  N   GLY A 104       9.005  17.113  24.406  1.00 26.80           N  
+ATOM    711  CA  GLY A 104       8.299  18.331  24.047  1.00 28.70           C  
+ATOM    712  C   GLY A 104       9.081  19.575  24.425  1.00 32.25           C  
+ATOM    713  O   GLY A 104       8.888  20.641  23.845  1.00 33.85           O  
+ATOM    714  N   GLY A 105       9.972  19.438  25.399  1.00 34.64           N  
+ATOM    715  CA  GLY A 105      10.771  20.571  25.830  1.00 38.50           C  
+ATOM    716  C   GLY A 105      11.495  21.290  24.704  1.00 40.54           C  
+ATOM    717  O   GLY A 105      11.478  22.520  24.638  1.00 40.64           O  
+ATOM    718  N   TYR A 106      12.128  20.528  23.815  1.00 41.20           N  
+ATOM    719  CA  TYR A 106      12.869  21.103  22.698  1.00 42.81           C  
+ATOM    720  C   TYR A 106      12.008  21.992  21.809  1.00 43.34           C  
+ATOM    721  O   TYR A 106      12.275  23.183  21.671  1.00 42.45           O  
+ATOM    722  CB  TYR A 106      13.474  19.995  21.841  1.00 45.98           C  
+ATOM    723  CG  TYR A 106      14.374  20.492  20.731  1.00 48.42           C  
+ATOM    724  CD1 TYR A 106      15.734  20.702  20.952  1.00 50.56           C  
+ATOM    725  CD2 TYR A 106      13.865  20.749  19.456  1.00 51.17           C  
+ATOM    726  CE1 TYR A 106      16.572  21.154  19.928  1.00 52.44           C  
+ATOM    727  CE2 TYR A 106      14.692  21.204  18.425  1.00 52.73           C  
+ATOM    728  CZ  TYR A 106      16.046  21.403  18.668  1.00 53.64           C  
+ATOM    729  OH  TYR A 106      16.874  21.841  17.653  1.00 54.96           O  
+ATOM    730  N   GLN A 107      10.984  21.402  21.199  1.00 43.98           N  
+ATOM    731  CA  GLN A 107      10.092  22.136  20.307  1.00 45.79           C  
+ATOM    732  C   GLN A 107       9.485  23.374  20.953  1.00 47.35           C  
+ATOM    733  O   GLN A 107       9.273  24.382  20.281  1.00 48.49           O  
+ATOM    734  CB  GLN A 107       8.965  21.231  19.801  1.00 44.48           C  
+ATOM    735  CG  GLN A 107       9.402  20.106  18.873  1.00 43.66           C  
+ATOM    736  CD  GLN A 107      10.343  19.129  19.541  1.00 43.94           C  
+ATOM    737  OE1 GLN A 107      10.230  18.862  20.740  1.00 43.73           O  
+ATOM    738  NE2 GLN A 107      11.270  18.574  18.766  1.00 44.47           N  
+ATOM    739  N   VAL A 108       9.195  23.300  22.248  1.00 49.33           N  
+ATOM    740  CA  VAL A 108       8.616  24.443  22.948  1.00 51.52           C  
+ATOM    741  C   VAL A 108       9.572  25.630  22.885  1.00 52.77           C  
+ATOM    742  O   VAL A 108       9.146  26.782  22.868  1.00 53.21           O  
+ATOM    743  CB  VAL A 108       8.325  24.122  24.433  1.00 50.31           C  
+ATOM    744  CG1 VAL A 108       7.824  25.369  25.145  1.00 52.80           C  
+ATOM    745  CG2 VAL A 108       7.285  23.026  24.534  1.00 51.38           C  
+ATOM    746  N   MET A 109      10.867  25.340  22.846  1.00 54.31           N  
+ATOM    747  CA  MET A 109      11.878  26.386  22.785  1.00 56.68           C  
+ATOM    748  C   MET A 109      12.239  26.763  21.355  1.00 58.15           C  
+ATOM    749  O   MET A 109      13.077  27.635  21.132  1.00 59.09           O  
+ATOM    750  CB  MET A 109      13.136  25.941  23.532  1.00 57.73           C  
+ATOM    751  CG  MET A 109      12.957  25.861  25.036  1.00 58.85           C  
+ATOM    752  SD  MET A 109      12.290  27.410  25.682  1.00 62.41           S  
+ATOM    753  CE  MET A 109      13.673  28.515  25.370  1.00 61.32           C  
+ATOM    754  N   SER A 110      11.601  26.111  20.388  1.00 59.43           N  
+ATOM    755  CA  SER A 110      11.870  26.379  18.979  1.00 60.17           C  
+ATOM    756  C   SER A 110      10.653  26.930  18.238  1.00 60.53           C  
+ATOM    757  O   SER A 110      10.689  28.034  17.699  1.00 60.97           O  
+ATOM    758  CB  SER A 110      12.345  25.099  18.283  1.00 60.35           C  
+ATOM    759  OG  SER A 110      13.508  24.578  18.902  1.00 60.73           O  
+ATOM    760  N   LEU A 111       9.578  26.151  18.220  1.00 61.10           N  
+ATOM    761  CA  LEU A 111       8.352  26.533  17.528  1.00 62.37           C  
+ATOM    762  C   LEU A 111       7.427  27.436  18.341  1.00 63.20           C  
+ATOM    763  O   LEU A 111       6.857  28.389  17.810  1.00 63.91           O  
+ATOM    764  CB  LEU A 111       7.589  25.277  17.103  1.00 62.61           C  
+ATOM    765  CG  LEU A 111       8.211  24.391  16.019  1.00 62.51           C  
+ATOM    766  CD1 LEU A 111       9.643  24.020  16.371  1.00 62.03           C  
+ATOM    767  CD2 LEU A 111       7.361  23.146  15.865  1.00 62.25           C  
+ATOM    768  N   SER A 112       7.273  27.129  19.624  1.00 63.67           N  
+ATOM    769  CA  SER A 112       6.406  27.908  20.502  1.00 64.10           C  
+ATOM    770  C   SER A 112       6.778  29.390  20.550  1.00 64.81           C  
+ATOM    771  O   SER A 112       7.820  29.801  20.036  1.00 64.98           O  
+ATOM    772  CB  SER A 112       6.440  27.325  21.914  1.00 63.29           C  
+ATOM    773  OG  SER A 112       5.658  28.104  22.798  1.00 62.62           O  
+ATOM    774  N   SER A 113       5.914  30.189  21.172  1.00 65.36           N  
+ATOM    775  CA  SER A 113       6.142  31.625  21.294  1.00 66.03           C  
+ATOM    776  C   SER A 113       5.838  32.126  22.704  1.00 65.82           C  
+ATOM    777  O   SER A 113       4.995  31.565  23.405  1.00 65.81           O  
+ATOM    778  CB  SER A 113       5.280  32.385  20.281  1.00 66.23           C  
+ATOM    779  OG  SER A 113       5.623  32.032  18.952  1.00 67.04           O  
+ATOM    780  N   LEU A 114       6.536  33.183  23.110  1.00 65.68           N  
+ATOM    781  CA  LEU A 114       6.358  33.781  24.431  1.00 65.17           C  
+ATOM    782  C   LEU A 114       6.541  32.759  25.551  1.00 63.91           C  
+ATOM    783  O   LEU A 114       5.755  32.704  26.499  1.00 63.54           O  
+ATOM    784  CB  LEU A 114       4.972  34.429  24.535  1.00 66.01           C  
+ATOM    785  CG  LEU A 114       4.685  35.570  23.551  1.00 66.75           C  
+ATOM    786  CD1 LEU A 114       3.294  36.133  23.810  1.00 66.53           C  
+ATOM    787  CD2 LEU A 114       5.741  36.661  23.703  1.00 66.54           C  
+ATOM    788  N   THR A 115       7.595  31.958  25.435  1.00 62.47           N  
+ATOM    789  CA  THR A 115       7.892  30.933  26.426  1.00 60.83           C  
+ATOM    790  C   THR A 115       8.497  31.526  27.692  1.00 59.10           C  
+ATOM    791  O   THR A 115       9.446  32.308  27.632  1.00 59.77           O  
+ATOM    792  CB  THR A 115       8.879  29.890  25.870  1.00 60.54           C  
+ATOM    793  OG1 THR A 115      10.090  30.544  25.477  1.00 61.20           O  
+ATOM    794  CG2 THR A 115       8.282  29.179  24.671  1.00 60.68           C  
+ATOM    795  N   LYS A 116       7.939  31.148  28.837  1.00 56.66           N  
+ATOM    796  CA  LYS A 116       8.426  31.616  30.128  1.00 53.51           C  
+ATOM    797  C   LYS A 116       9.003  30.395  30.844  1.00 50.25           C  
+ATOM    798  O   LYS A 116       8.279  29.449  31.154  1.00 49.20           O  
+ATOM    799  CB  LYS A 116       7.277  32.224  30.937  1.00 54.62           C  
+ATOM    800  CG  LYS A 116       7.727  33.046  32.132  1.00 56.82           C  
+ATOM    801  CD  LYS A 116       6.546  33.696  32.842  1.00 57.85           C  
+ATOM    802  CE  LYS A 116       7.014  34.604  33.973  1.00 58.50           C  
+ATOM    803  NZ  LYS A 116       5.875  35.226  34.707  1.00 58.76           N  
+ATOM    804  N   GLN A 117      10.308  30.417  31.093  1.00 46.68           N  
+ATOM    805  CA  GLN A 117      10.985  29.299  31.739  1.00 43.61           C  
+ATOM    806  C   GLN A 117      11.322  29.546  33.199  1.00 41.55           C  
+ATOM    807  O   GLN A 117      11.722  30.645  33.582  1.00 41.26           O  
+ATOM    808  CB  GLN A 117      12.267  28.974  30.985  1.00 44.03           C  
+ATOM    809  CG  GLN A 117      12.067  28.811  29.497  1.00 47.25           C  
+ATOM    810  CD  GLN A 117      13.376  28.691  28.762  1.00 49.06           C  
+ATOM    811  OE1 GLN A 117      14.097  27.704  28.914  1.00 49.64           O  
+ATOM    812  NE2 GLN A 117      13.701  29.704  27.965  1.00 49.79           N  
+ATOM    813  N   SER A 118      11.166  28.503  34.006  1.00 38.21           N  
+ATOM    814  CA  SER A 118      11.456  28.572  35.431  1.00 35.47           C  
+ATOM    815  C   SER A 118      11.888  27.189  35.889  1.00 33.88           C  
+ATOM    816  O   SER A 118      11.871  26.236  35.109  1.00 31.47           O  
+ATOM    817  CB  SER A 118      10.214  28.998  36.212  1.00 35.49           C  
+ATOM    818  OG  SER A 118       9.245  27.967  36.214  1.00 36.79           O  
+ATOM    819  N   GLU A 119      12.269  27.078  37.156  1.00 32.26           N  
+ATOM    820  CA  GLU A 119      12.702  25.800  37.697  1.00 31.12           C  
+ATOM    821  C   GLU A 119      11.557  24.792  37.670  1.00 30.83           C  
+ATOM    822  O   GLU A 119      11.786  23.581  37.694  1.00 31.79           O  
+ATOM    823  CB  GLU A 119      13.205  25.972  39.134  1.00 29.77           C  
+ATOM    824  CG  GLU A 119      13.736  24.693  39.753  1.00 28.12           C  
+ATOM    825  CD  GLU A 119      14.966  24.168  39.042  1.00 28.63           C  
+ATOM    826  OE1 GLU A 119      15.314  22.992  39.259  1.00 31.51           O  
+ATOM    827  OE2 GLU A 119      15.588  24.929  38.274  1.00 26.18           O  
+ATOM    828  N   GLU A 120      10.326  25.287  37.613  1.00 29.01           N  
+ATOM    829  CA  GLU A 120       9.174  24.397  37.600  1.00 31.97           C  
+ATOM    830  C   GLU A 120       8.925  23.802  36.217  1.00 31.56           C  
+ATOM    831  O   GLU A 120       8.480  22.663  36.097  1.00 30.46           O  
+ATOM    832  CB  GLU A 120       7.922  25.130  38.082  1.00 33.91           C  
+ATOM    833  CG  GLU A 120       6.718  24.215  38.244  1.00 40.84           C  
+ATOM    834  CD  GLU A 120       6.959  23.093  39.251  1.00 44.37           C  
+ATOM    835  OE1 GLU A 120       6.090  22.198  39.359  1.00 45.87           O  
+ATOM    836  OE2 GLU A 120       8.011  23.105  39.938  1.00 45.31           O  
+ATOM    837  N   GLY A 121       9.219  24.573  35.175  1.00 31.55           N  
+ATOM    838  CA  GLY A 121       9.021  24.082  33.825  1.00 33.31           C  
+ATOM    839  C   GLY A 121       9.050  25.195  32.802  1.00 34.75           C  
+ATOM    840  O   GLY A 121       9.838  26.136  32.906  1.00 34.56           O  
+ATOM    841  N   VAL A 122       8.190  25.090  31.799  1.00 35.00           N  
+ATOM    842  CA  VAL A 122       8.126  26.111  30.771  1.00 36.09           C  
+ATOM    843  C   VAL A 122       6.683  26.425  30.408  1.00 37.81           C  
+ATOM    844  O   VAL A 122       5.851  25.528  30.271  1.00 37.65           O  
+ATOM    845  CB  VAL A 122       8.901  25.679  29.503  1.00 35.67           C  
+ATOM    846  CG1 VAL A 122       8.417  24.320  29.029  1.00 35.25           C  
+ATOM    847  CG2 VAL A 122       8.727  26.724  28.409  1.00 36.74           C  
+ATOM    848  N   THR A 123       6.393  27.714  30.282  1.00 39.70           N  
+ATOM    849  CA  THR A 123       5.065  28.179  29.916  1.00 42.01           C  
+ATOM    850  C   THR A 123       5.191  28.687  28.493  1.00 42.88           C  
+ATOM    851  O   THR A 123       6.215  29.265  28.133  1.00 43.30           O  
+ATOM    852  CB  THR A 123       4.607  29.324  30.832  1.00 42.90           C  
+ATOM    853  OG1 THR A 123       4.476  28.833  32.171  1.00 43.99           O  
+ATOM    854  CG2 THR A 123       3.271  29.883  30.367  1.00 44.34           C  
+ATOM    855  N   PHE A 124       4.166  28.473  27.678  1.00 44.09           N  
+ATOM    856  CA  PHE A 124       4.239  28.907  26.292  1.00 46.30           C  
+ATOM    857  C   PHE A 124       2.886  29.019  25.607  1.00 47.44           C  
+ATOM    858  O   PHE A 124       1.893  28.456  26.066  1.00 47.02           O  
+ATOM    859  CB  PHE A 124       5.106  27.931  25.500  1.00 46.20           C  
+ATOM    860  CG  PHE A 124       4.560  26.527  25.464  1.00 47.31           C  
+ATOM    861  CD1 PHE A 124       4.677  25.689  26.571  1.00 47.75           C  
+ATOM    862  CD2 PHE A 124       3.912  26.047  24.330  1.00 47.12           C  
+ATOM    863  CE1 PHE A 124       4.157  24.394  26.547  1.00 47.37           C  
+ATOM    864  CE2 PHE A 124       3.388  24.755  24.297  1.00 46.64           C  
+ATOM    865  CZ  PHE A 124       3.511  23.927  25.407  1.00 47.36           C  
+ATOM    866  N   LYS A 125       2.867  29.750  24.497  1.00 49.84           N  
+ATOM    867  CA  LYS A 125       1.660  29.936  23.702  1.00 52.98           C  
+ATOM    868  C   LYS A 125       1.771  29.120  22.416  1.00 53.97           C  
+ATOM    869  O   LYS A 125       2.759  29.221  21.686  1.00 54.36           O  
+ATOM    870  CB  LYS A 125       1.458  31.416  23.361  1.00 54.03           C  
+ATOM    871  CG  LYS A 125       0.994  32.270  24.533  1.00 56.80           C  
+ATOM    872  CD  LYS A 125       0.670  33.693  24.090  1.00 58.51           C  
+ATOM    873  CE  LYS A 125       0.135  34.530  25.245  1.00 59.68           C  
+ATOM    874  NZ  LYS A 125      -0.152  35.937  24.837  1.00 60.56           N  
+ATOM    875  N   SER A 126       0.754  28.309  22.148  1.00 55.37           N  
+ATOM    876  CA  SER A 126       0.732  27.468  20.957  1.00 56.84           C  
+ATOM    877  C   SER A 126       0.892  28.286  19.682  1.00 58.28           C  
+ATOM    878  O   SER A 126       0.260  29.331  19.523  1.00 57.89           O  
+ATOM    879  CB  SER A 126      -0.582  26.687  20.892  1.00 56.46           C  
+ATOM    880  OG  SER A 126      -0.655  25.918  19.705  1.00 55.87           O  
+ATOM    881  N   HIS A 127       1.737  27.808  18.774  1.00 59.88           N  
+ATOM    882  CA  HIS A 127       1.945  28.504  17.512  1.00 62.20           C  
+ATOM    883  C   HIS A 127       0.728  28.305  16.614  1.00 63.71           C  
+ATOM    884  O   HIS A 127       0.746  28.668  15.439  1.00 63.95           O  
+ATOM    885  CB  HIS A 127       3.210  27.998  16.808  1.00 62.53           C  
+ATOM    886  CG  HIS A 127       3.192  26.533  16.498  1.00 62.87           C  
+ATOM    887  ND1 HIS A 127       3.234  25.563  17.477  1.00 62.84           N  
+ATOM    888  CD2 HIS A 127       3.154  25.872  15.316  1.00 63.05           C  
+ATOM    889  CE1 HIS A 127       3.225  24.369  16.911  1.00 63.33           C  
+ATOM    890  NE2 HIS A 127       3.176  24.528  15.601  1.00 62.49           N  
+ATOM    891  N   LEU A 128      -0.326  27.723  17.181  1.00 65.79           N  
+ATOM    892  CA  LEU A 128      -1.571  27.481  16.458  1.00 67.86           C  
+ATOM    893  C   LEU A 128      -2.681  28.383  16.993  1.00 69.42           C  
+ATOM    894  O   LEU A 128      -3.062  29.364  16.355  1.00 70.30           O  
+ATOM    895  CB  LEU A 128      -2.018  26.020  16.599  1.00 67.57           C  
+ATOM    896  CG  LEU A 128      -1.247  24.892  15.908  1.00 67.59           C  
+ATOM    897  CD1 LEU A 128       0.123  24.753  16.527  1.00 67.37           C  
+ATOM    898  CD2 LEU A 128      -2.019  23.586  16.048  1.00 66.81           C  
+ATOM    899  N   ASP A 129      -3.192  28.040  18.173  1.00 71.07           N  
+ATOM    900  CA  ASP A 129      -4.273  28.790  18.802  1.00 72.27           C  
+ATOM    901  C   ASP A 129      -3.783  29.951  19.657  1.00 72.71           C  
+ATOM    902  O   ASP A 129      -4.582  30.768  20.115  1.00 72.99           O  
+ATOM    903  CB  ASP A 129      -5.122  27.859  19.672  1.00 73.54           C  
+ATOM    904  CG  ASP A 129      -5.741  26.720  18.882  1.00 75.07           C  
+ATOM    905  OD1 ASP A 129      -4.983  25.906  18.311  1.00 75.76           O  
+ATOM    906  OD2 ASP A 129      -6.987  26.638  18.832  1.00 75.60           O  
+ATOM    907  N   GLY A 130      -2.475  30.027  19.874  1.00 72.90           N  
+ATOM    908  CA  GLY A 130      -1.936  31.097  20.693  1.00 72.81           C  
+ATOM    909  C   GLY A 130      -2.237  30.846  22.159  1.00 73.10           C  
+ATOM    910  O   GLY A 130      -1.885  31.647  23.026  1.00 73.39           O  
+ATOM    911  N   SER A 131      -2.897  29.724  22.431  1.00 72.72           N  
+ATOM    912  CA  SER A 131      -3.257  29.335  23.791  1.00 72.39           C  
+ATOM    913  C   SER A 131      -2.016  29.071  24.642  1.00 71.94           C  
+ATOM    914  O   SER A 131      -0.951  28.754  24.114  1.00 71.67           O  
+ATOM    915  CB  SER A 131      -4.138  28.083  23.751  1.00 72.72           C  
+ATOM    916  OG  SER A 131      -3.558  27.074  22.939  1.00 72.15           O  
+ATOM    917  N   ARG A 132      -2.158  29.200  25.959  1.00 71.53           N  
+ATOM    918  CA  ARG A 132      -1.042  28.981  26.875  1.00 70.83           C  
+ATOM    919  C   ARG A 132      -0.997  27.557  27.415  1.00 69.40           C  
+ATOM    920  O   ARG A 132      -2.016  26.868  27.474  1.00 69.39           O  
+ATOM    921  CB  ARG A 132      -1.113  29.954  28.054  1.00 72.60           C  
+ATOM    922  CG  ARG A 132       0.048  29.811  29.032  1.00 74.83           C  
+ATOM    923  CD  ARG A 132      -0.232  30.517  30.349  1.00 77.10           C  
+ATOM    924  NE  ARG A 132      -0.460  31.949  30.175  1.00 79.24           N  
+ATOM    925  CZ  ARG A 132      -0.783  32.778  31.164  1.00 80.07           C  
+ATOM    926  NH1 ARG A 132      -0.917  32.317  32.402  1.00 80.38           N  
+ATOM    927  NH2 ARG A 132      -0.975  34.067  30.916  1.00 80.46           N  
+ATOM    928  N   HIS A 133       0.198  27.132  27.815  1.00 67.31           N  
+ATOM    929  CA  HIS A 133       0.417  25.798  28.359  1.00 64.56           C  
+ATOM    930  C   HIS A 133       1.641  25.818  29.276  1.00 61.57           C  
+ATOM    931  O   HIS A 133       2.588  26.570  29.040  1.00 60.65           O  
+ATOM    932  CB  HIS A 133       0.657  24.794  27.225  1.00 66.21           C  
+ATOM    933  CG  HIS A 133      -0.458  24.722  26.227  1.00 67.68           C  
+ATOM    934  ND1 HIS A 133      -1.709  24.236  26.539  1.00 68.66           N  
+ATOM    935  CD2 HIS A 133      -0.508  25.077  24.921  1.00 68.14           C  
+ATOM    936  CE1 HIS A 133      -2.482  24.294  25.469  1.00 68.47           C  
+ATOM    937  NE2 HIS A 133      -1.778  24.801  24.473  1.00 67.83           N  
+ATOM    938  N   MET A 134       1.610  25.000  30.325  1.00 57.90           N  
+ATOM    939  CA  MET A 134       2.728  24.902  31.261  1.00 53.53           C  
+ATOM    940  C   MET A 134       3.255  23.477  31.247  1.00 49.90           C  
+ATOM    941  O   MET A 134       2.686  22.585  31.879  1.00 51.37           O  
+ATOM    942  CB  MET A 134       2.300  25.287  32.684  1.00 54.73           C  
+ATOM    943  CG  MET A 134       3.200  24.736  33.808  1.00 55.76           C  
+ATOM    944  SD  MET A 134       4.995  25.030  33.650  1.00 58.12           S  
+ATOM    945  CE  MET A 134       5.231  26.447  34.735  1.00 55.76           C  
+ATOM    946  N   LEU A 135       4.345  23.277  30.516  1.00 43.27           N  
+ATOM    947  CA  LEU A 135       4.972  21.972  30.399  1.00 37.11           C  
+ATOM    948  C   LEU A 135       6.069  21.842  31.453  1.00 34.85           C  
+ATOM    949  O   LEU A 135       6.908  22.729  31.608  1.00 32.92           O  
+ATOM    950  CB  LEU A 135       5.556  21.816  28.993  1.00 35.77           C  
+ATOM    951  CG  LEU A 135       5.808  20.411  28.450  1.00 35.33           C  
+ATOM    952  CD1 LEU A 135       4.556  19.550  28.596  1.00 32.39           C  
+ATOM    953  CD2 LEU A 135       6.213  20.519  26.987  1.00 30.68           C  
+ATOM    954  N   SER A 136       6.050  20.731  32.179  1.00 32.77           N  
+ATOM    955  CA  SER A 136       7.027  20.472  33.228  1.00 30.58           C  
+ATOM    956  C   SER A 136       7.473  19.023  33.142  1.00 29.50           C  
+ATOM    957  O   SER A 136       6.949  18.256  32.338  1.00 29.30           O  
+ATOM    958  CB  SER A 136       6.388  20.719  34.594  1.00 29.75           C  
+ATOM    959  OG  SER A 136       5.268  19.868  34.777  1.00 29.05           O  
+ATOM    960  N   PRO A 137       8.457  18.626  33.965  1.00 28.51           N  
+ATOM    961  CA  PRO A 137       8.886  17.228  33.894  1.00 27.19           C  
+ATOM    962  C   PRO A 137       7.700  16.292  34.169  1.00 26.33           C  
+ATOM    963  O   PRO A 137       7.494  15.298  33.466  1.00 23.69           O  
+ATOM    964  CB  PRO A 137       9.960  17.144  34.979  1.00 27.57           C  
+ATOM    965  CG  PRO A 137      10.563  18.517  34.957  1.00 27.53           C  
+ATOM    966  CD  PRO A 137       9.345  19.409  34.847  1.00 27.70           C  
+ATOM    967  N   GLU A 138       6.910  16.633  35.184  1.00 24.09           N  
+ATOM    968  CA  GLU A 138       5.757  15.824  35.565  1.00 22.43           C  
+ATOM    969  C   GLU A 138       4.668  15.758  34.487  1.00 21.43           C  
+ATOM    970  O   GLU A 138       4.121  14.684  34.209  1.00 19.86           O  
+ATOM    971  CB  GLU A 138       5.160  16.344  36.883  1.00 22.27           C  
+ATOM    972  CG  GLU A 138       6.094  16.223  38.095  1.00 19.94           C  
+ATOM    973  CD  GLU A 138       7.209  17.269  38.116  1.00 21.08           C  
+ATOM    974  OE1 GLU A 138       8.205  17.065  38.845  1.00 20.60           O  
+ATOM    975  OE2 GLU A 138       7.090  18.298  37.417  1.00 18.99           O  
+ATOM    976  N   ARG A 139       4.359  16.900  33.881  1.00 21.14           N  
+ATOM    977  CA  ARG A 139       3.331  16.971  32.843  1.00 19.98           C  
+ATOM    978  C   ARG A 139       3.779  16.307  31.543  1.00 19.75           C  
+ATOM    979  O   ARG A 139       2.964  15.741  30.809  1.00 18.78           O  
+ATOM    980  CB  ARG A 139       2.955  18.432  32.576  1.00 21.06           C  
+ATOM    981  CG  ARG A 139       1.988  18.643  31.405  1.00 21.95           C  
+ATOM    982  CD  ARG A 139       0.676  17.892  31.600  1.00 23.77           C  
+ATOM    983  NE  ARG A 139      -0.235  18.078  30.467  1.00 24.27           N  
+ATOM    984  CZ  ARG A 139      -1.384  17.427  30.315  1.00 24.03           C  
+ATOM    985  NH1 ARG A 139      -1.770  16.542  31.224  1.00 23.29           N  
+ATOM    986  NH2 ARG A 139      -2.148  17.655  29.251  1.00 23.97           N  
+ATOM    987  N   SER A 140       5.075  16.384  31.261  1.00 17.69           N  
+ATOM    988  CA  SER A 140       5.633  15.781  30.056  1.00 18.14           C  
+ATOM    989  C   SER A 140       5.531  14.264  30.165  1.00 17.28           C  
+ATOM    990  O   SER A 140       5.120  13.588  29.224  1.00 18.46           O  
+ATOM    991  CB  SER A 140       7.100  16.183  29.891  1.00 15.63           C  
+ATOM    992  OG  SER A 140       7.679  15.537  28.771  1.00 18.04           O  
+ATOM    993  N   ILE A 141       5.913  13.739  31.324  1.00 17.46           N  
+ATOM    994  CA  ILE A 141       5.859  12.308  31.568  1.00 17.06           C  
+ATOM    995  C   ILE A 141       4.405  11.843  31.469  1.00 18.65           C  
+ATOM    996  O   ILE A 141       4.116  10.805  30.869  1.00 18.26           O  
+ATOM    997  CB  ILE A 141       6.425  11.962  32.975  1.00 19.23           C  
+ATOM    998  CG1 ILE A 141       7.914  12.310  33.040  1.00 19.53           C  
+ATOM    999  CG2 ILE A 141       6.189  10.487  33.302  1.00 18.82           C  
+ATOM   1000  CD1 ILE A 141       8.778  11.612  31.997  1.00 23.39           C  
+ATOM   1001  N   GLU A 142       3.494  12.619  32.052  1.00 17.78           N  
+ATOM   1002  CA  GLU A 142       2.076  12.279  32.022  1.00 19.96           C  
+ATOM   1003  C   GLU A 142       1.541  12.238  30.592  1.00 19.25           C  
+ATOM   1004  O   GLU A 142       0.818  11.320  30.219  1.00 18.67           O  
+ATOM   1005  CB  GLU A 142       1.260  13.284  32.842  1.00 20.19           C  
+ATOM   1006  CG  GLU A 142      -0.238  13.012  32.803  1.00 23.13           C  
+ATOM   1007  CD  GLU A 142      -1.048  14.026  33.591  1.00 23.85           C  
+ATOM   1008  OE1 GLU A 142      -0.801  15.240  33.436  1.00 24.02           O  
+ATOM   1009  OE2 GLU A 142      -1.940  13.610  34.356  1.00 26.59           O  
+ATOM   1010  N   ILE A 143       1.900  13.238  29.794  1.00 20.71           N  
+ATOM   1011  CA  ILE A 143       1.460  13.297  28.407  1.00 19.22           C  
+ATOM   1012  C   ILE A 143       1.969  12.080  27.629  1.00 18.34           C  
+ATOM   1013  O   ILE A 143       1.219  11.455  26.884  1.00 17.83           O  
+ATOM   1014  CB  ILE A 143       1.946  14.598  27.733  1.00 18.92           C  
+ATOM   1015  CG1 ILE A 143       1.219  15.795  28.354  1.00 22.33           C  
+ATOM   1016  CG2 ILE A 143       1.693  14.542  26.234  1.00 20.43           C  
+ATOM   1017  CD1 ILE A 143       1.588  17.143  27.744  1.00 23.84           C  
+ATOM   1018  N   GLN A 144       3.242  11.742  27.803  1.00 16.24           N  
+ATOM   1019  CA  GLN A 144       3.803  10.589  27.111  1.00 16.18           C  
+ATOM   1020  C   GLN A 144       3.082   9.313  27.558  1.00 17.22           C  
+ATOM   1021  O   GLN A 144       2.897   8.385  26.769  1.00 19.44           O  
+ATOM   1022  CB  GLN A 144       5.311  10.504  27.365  1.00 15.58           C  
+ATOM   1023  CG  GLN A 144       6.066  11.729  26.830  1.00 11.71           C  
+ATOM   1024  CD  GLN A 144       7.567  11.665  27.059  1.00 14.26           C  
+ATOM   1025  OE1 GLN A 144       8.252  10.789  26.525  1.00 13.84           O  
+ATOM   1026  NE2 GLN A 144       8.087  12.598  27.859  1.00 11.95           N  
+ATOM   1027  N   HIS A 145       2.658   9.272  28.817  1.00 17.07           N  
+ATOM   1028  CA  HIS A 145       1.918   8.119  29.320  1.00 17.29           C  
+ATOM   1029  C   HIS A 145       0.554   8.069  28.638  1.00 17.18           C  
+ATOM   1030  O   HIS A 145       0.103   7.011  28.193  1.00 15.71           O  
+ATOM   1031  CB  HIS A 145       1.692   8.233  30.821  1.00 16.64           C  
+ATOM   1032  CG  HIS A 145       0.620   7.323  31.332  1.00 18.34           C  
+ATOM   1033  ND1 HIS A 145       0.772   5.955  31.394  1.00 19.98           N  
+ATOM   1034  CD2 HIS A 145      -0.627   7.584  31.792  1.00 19.82           C  
+ATOM   1035  CE1 HIS A 145      -0.332   5.411  31.875  1.00 21.72           C  
+ATOM   1036  NE2 HIS A 145      -1.197   6.378  32.125  1.00 22.89           N  
+ATOM   1037  N   LEU A 146      -0.102   9.225  28.578  1.00 19.32           N  
+ATOM   1038  CA  LEU A 146      -1.421   9.338  27.962  1.00 19.09           C  
+ATOM   1039  C   LEU A 146      -1.372   8.879  26.507  1.00 19.58           C  
+ATOM   1040  O   LEU A 146      -2.316   8.264  26.005  1.00 19.51           O  
+ATOM   1041  CB  LEU A 146      -1.924  10.786  28.053  1.00 16.76           C  
+ATOM   1042  CG  LEU A 146      -2.435  11.243  29.427  1.00 17.96           C  
+ATOM   1043  CD1 LEU A 146      -2.639  12.755  29.453  1.00 15.57           C  
+ATOM   1044  CD2 LEU A 146      -3.737  10.526  29.743  1.00 17.16           C  
+ATOM   1045  N   LEU A 147      -0.260   9.171  25.839  1.00 18.75           N  
+ATOM   1046  CA  LEU A 147      -0.075   8.776  24.446  1.00 17.02           C  
+ATOM   1047  C   LEU A 147       0.203   7.282  24.346  1.00 17.38           C  
+ATOM   1048  O   LEU A 147      -0.003   6.670  23.294  1.00 18.15           O  
+ATOM   1049  CB  LEU A 147       1.094   9.545  23.831  1.00 16.38           C  
+ATOM   1050  CG  LEU A 147       0.939  11.060  23.704  1.00 17.66           C  
+ATOM   1051  CD1 LEU A 147       2.238  11.671  23.196  1.00 19.01           C  
+ATOM   1052  CD2 LEU A 147      -0.212  11.371  22.756  1.00 17.90           C  
+ATOM   1053  N   GLY A 148       0.672   6.695  25.444  1.00 16.87           N  
+ATOM   1054  CA  GLY A 148       0.975   5.275  25.446  1.00 16.83           C  
+ATOM   1055  C   GLY A 148       2.362   4.995  24.895  1.00 16.78           C  
+ATOM   1056  O   GLY A 148       2.611   3.946  24.302  1.00 18.11           O  
+ATOM   1057  N   SER A 149       3.268   5.946  25.091  1.00 16.99           N  
+ATOM   1058  CA  SER A 149       4.643   5.818  24.616  1.00 17.06           C  
+ATOM   1059  C   SER A 149       5.367   4.619  25.234  1.00 17.21           C  
+ATOM   1060  O   SER A 149       5.190   4.319  26.420  1.00 16.64           O  
+ATOM   1061  CB  SER A 149       5.413   7.103  24.935  1.00 18.20           C  
+ATOM   1062  OG  SER A 149       6.805   6.927  24.757  1.00 23.78           O  
+ATOM   1063  N   ASP A 150       6.183   3.946  24.424  1.00 15.19           N  
+ATOM   1064  CA  ASP A 150       6.959   2.795  24.875  1.00 16.51           C  
+ATOM   1065  C   ASP A 150       8.302   3.244  25.441  1.00 16.37           C  
+ATOM   1066  O   ASP A 150       8.772   2.696  26.434  1.00 15.86           O  
+ATOM   1067  CB  ASP A 150       7.192   1.821  23.725  1.00 15.53           C  
+ATOM   1068  CG  ASP A 150       5.900   1.279  23.161  1.00 18.00           C  
+ATOM   1069  OD1 ASP A 150       5.438   1.784  22.117  1.00 16.24           O  
+ATOM   1070  OD2 ASP A 150       5.337   0.353  23.778  1.00 19.64           O  
+ATOM   1071  N   ILE A 151       8.937   4.215  24.788  1.00 16.18           N  
+ATOM   1072  CA  ILE A 151      10.208   4.745  25.284  1.00 16.21           C  
+ATOM   1073  C   ILE A 151       9.959   6.216  25.589  1.00 16.67           C  
+ATOM   1074  O   ILE A 151       9.752   7.029  24.679  1.00 11.41           O  
+ATOM   1075  CB  ILE A 151      11.366   4.650  24.259  1.00 15.58           C  
+ATOM   1076  CG1 ILE A 151      11.702   3.189  23.939  1.00 18.06           C  
+ATOM   1077  CG2 ILE A 151      12.605   5.317  24.832  1.00 14.80           C  
+ATOM   1078  CD1 ILE A 151      10.670   2.505  23.070  1.00 23.45           C  
+ATOM   1079  N   VAL A 152       9.969   6.543  26.877  1.00 16.64           N  
+ATOM   1080  CA  VAL A 152       9.725   7.904  27.345  1.00 16.77           C  
+ATOM   1081  C   VAL A 152      11.028   8.690  27.545  1.00 17.61           C  
+ATOM   1082  O   VAL A 152      11.958   8.205  28.189  1.00 18.66           O  
+ATOM   1083  CB  VAL A 152       8.947   7.867  28.685  1.00 17.79           C  
+ATOM   1084  CG1 VAL A 152       8.660   9.279  29.177  1.00 15.15           C  
+ATOM   1085  CG2 VAL A 152       7.656   7.076  28.505  1.00 16.21           C  
+ATOM   1086  N   MET A 153      11.088   9.899  26.990  1.00 17.01           N  
+ATOM   1087  CA  MET A 153      12.271  10.745  27.127  1.00 17.82           C  
+ATOM   1088  C   MET A 153      12.092  11.676  28.325  1.00 19.24           C  
+ATOM   1089  O   MET A 153      11.019  12.247  28.520  1.00 17.28           O  
+ATOM   1090  CB  MET A 153      12.498  11.600  25.868  1.00 16.56           C  
+ATOM   1091  CG  MET A 153      12.814  10.824  24.593  1.00 15.65           C  
+ATOM   1092  SD  MET A 153      14.147   9.618  24.805  1.00 18.21           S  
+ATOM   1093  CE  MET A 153      15.543  10.697  25.179  1.00 14.98           C  
+ATOM   1094  N   ALA A 154      13.136  11.814  29.135  1.00 18.73           N  
+ATOM   1095  CA  ALA A 154      13.066  12.702  30.282  1.00 19.47           C  
+ATOM   1096  C   ALA A 154      12.914  14.118  29.735  1.00 19.45           C  
+ATOM   1097  O   ALA A 154      13.412  14.428  28.654  1.00 18.85           O  
+ATOM   1098  CB  ALA A 154      14.336  12.587  31.117  1.00 20.34           C  
+ATOM   1099  N   PHE A 155      12.206  14.965  30.474  1.00 21.15           N  
+ATOM   1100  CA  PHE A 155      11.982  16.349  30.067  1.00 22.08           C  
+ATOM   1101  C   PHE A 155      13.223  17.171  30.422  1.00 25.04           C  
+ATOM   1102  O   PHE A 155      13.659  17.198  31.578  1.00 24.11           O  
+ATOM   1103  CB  PHE A 155      10.738  16.890  30.776  1.00 22.75           C  
+ATOM   1104  CG  PHE A 155      10.422  18.318  30.454  1.00 23.59           C  
+ATOM   1105  CD1 PHE A 155      10.871  19.344  31.279  1.00 23.53           C  
+ATOM   1106  CD2 PHE A 155       9.669  18.640  29.335  1.00 22.41           C  
+ATOM   1107  CE1 PHE A 155      10.571  20.672  30.996  1.00 23.71           C  
+ATOM   1108  CE2 PHE A 155       9.364  19.968  29.044  1.00 24.92           C  
+ATOM   1109  CZ  PHE A 155       9.818  20.987  29.881  1.00 22.50           C  
+ATOM   1110  N   ASP A 156      13.794  17.834  29.424  1.00 24.65           N  
+ATOM   1111  CA  ASP A 156      15.000  18.614  29.639  1.00 28.29           C  
+ATOM   1112  C   ASP A 156      14.957  19.967  28.957  1.00 31.51           C  
+ATOM   1113  O   ASP A 156      13.940  20.366  28.393  1.00 32.26           O  
+ATOM   1114  CB  ASP A 156      16.212  17.830  29.129  1.00 27.15           C  
+ATOM   1115  CG  ASP A 156      16.225  17.690  27.612  1.00 26.80           C  
+ATOM   1116  OD1 ASP A 156      15.147  17.775  26.988  1.00 25.82           O  
+ATOM   1117  OD2 ASP A 156      17.317  17.483  27.041  1.00 28.30           O  
+ATOM   1118  N   GLU A 157      16.091  20.657  29.008  1.00 35.88           N  
+ATOM   1119  CA  GLU A 157      16.253  21.976  28.408  1.00 39.54           C  
+ATOM   1120  C   GLU A 157      17.442  21.903  27.445  1.00 42.71           C  
+ATOM   1121  O   GLU A 157      18.591  21.823  27.880  1.00 44.01           O  
+ATOM   1122  CB  GLU A 157      16.513  22.995  29.523  1.00 39.34           C  
+ATOM   1123  CG  GLU A 157      16.905  24.389  29.079  1.00 40.11           C  
+ATOM   1124  CD  GLU A 157      17.089  25.326  30.261  1.00 41.61           C  
+ATOM   1125  OE1 GLU A 157      16.075  25.734  30.868  1.00 40.88           O  
+ATOM   1126  OE2 GLU A 157      18.252  25.643  30.595  1.00 42.65           O  
+ATOM   1127  N   CYS A 158      17.163  21.906  26.143  1.00 44.84           N  
+ATOM   1128  CA  CYS A 158      18.219  21.828  25.130  1.00 47.70           C  
+ATOM   1129  C   CYS A 158      19.046  23.114  25.104  1.00 48.15           C  
+ATOM   1130  O   CYS A 158      18.541  24.186  24.766  1.00 49.32           O  
+ATOM   1131  CB  CYS A 158      17.611  21.567  23.745  1.00 48.43           C  
+ATOM   1132  SG  CYS A 158      18.818  21.304  22.408  1.00 53.13           S  
+ATOM   1133  N   THR A 159      20.321  22.991  25.461  1.00 48.11           N  
+ATOM   1134  CA  THR A 159      21.237  24.128  25.511  1.00 46.58           C  
+ATOM   1135  C   THR A 159      21.602  24.683  24.132  1.00 46.26           C  
+ATOM   1136  O   THR A 159      22.152  23.971  23.291  1.00 46.15           O  
+ATOM   1137  CB  THR A 159      22.541  23.738  26.227  1.00 47.24           C  
+ATOM   1138  OG1 THR A 159      22.231  23.085  27.465  1.00 46.05           O  
+ATOM   1139  CG2 THR A 159      23.383  24.978  26.504  1.00 47.11           C  
+ATOM   1140  N   PRO A 160      21.304  25.972  23.889  1.00 46.11           N  
+ATOM   1141  CA  PRO A 160      21.587  26.661  22.621  1.00 45.44           C  
+ATOM   1142  C   PRO A 160      23.072  26.706  22.246  1.00 44.07           C  
+ATOM   1143  O   PRO A 160      23.937  26.797  23.114  1.00 44.27           O  
+ATOM   1144  CB  PRO A 160      21.021  28.058  22.857  1.00 45.52           C  
+ATOM   1145  CG  PRO A 160      19.881  27.798  23.789  1.00 46.95           C  
+ATOM   1146  CD  PRO A 160      20.493  26.827  24.771  1.00 46.18           C  
+ATOM   1147  N   TYR A 161      23.355  26.649  20.947  1.00 43.03           N  
+ATOM   1148  CA  TYR A 161      24.729  26.688  20.451  1.00 42.05           C  
+ATOM   1149  C   TYR A 161      24.952  27.962  19.641  1.00 41.82           C  
+ATOM   1150  O   TYR A 161      24.155  28.294  18.763  1.00 41.84           O  
+ATOM   1151  CB  TYR A 161      25.015  25.473  19.563  1.00 42.31           C  
+ATOM   1152  CG  TYR A 161      26.433  25.411  19.032  1.00 40.83           C  
+ATOM   1153  CD1 TYR A 161      27.498  25.094  19.872  1.00 41.82           C  
+ATOM   1154  CD2 TYR A 161      26.712  25.682  17.692  1.00 41.42           C  
+ATOM   1155  CE1 TYR A 161      28.806  25.046  19.395  1.00 40.59           C  
+ATOM   1156  CE2 TYR A 161      28.021  25.638  17.202  1.00 40.11           C  
+ATOM   1157  CZ  TYR A 161      29.062  25.318  18.061  1.00 40.29           C  
+ATOM   1158  OH  TYR A 161      30.359  25.268  17.597  1.00 39.74           O  
+ATOM   1159  N   PRO A 162      26.050  28.684  19.914  1.00 41.04           N  
+ATOM   1160  CA  PRO A 162      27.068  28.371  20.923  1.00 40.49           C  
+ATOM   1161  C   PRO A 162      26.601  28.677  22.345  1.00 39.27           C  
+ATOM   1162  O   PRO A 162      25.633  29.407  22.542  1.00 40.03           O  
+ATOM   1163  CB  PRO A 162      28.238  29.250  20.500  1.00 40.56           C  
+ATOM   1164  CG  PRO A 162      27.541  30.476  20.004  1.00 40.89           C  
+ATOM   1165  CD  PRO A 162      26.416  29.900  19.165  1.00 40.91           C  
+ATOM   1166  N   ALA A 163      27.294  28.116  23.332  1.00 38.02           N  
+ATOM   1167  CA  ALA A 163      26.948  28.336  24.733  1.00 36.30           C  
+ATOM   1168  C   ALA A 163      28.191  28.502  25.599  1.00 34.84           C  
+ATOM   1169  O   ALA A 163      29.148  27.736  25.488  1.00 33.94           O  
+ATOM   1170  CB  ALA A 163      26.109  27.175  25.251  1.00 37.28           C  
+ATOM   1171  N   THR A 164      28.172  29.511  26.461  1.00 33.31           N  
+ATOM   1172  CA  THR A 164      29.295  29.761  27.349  1.00 32.53           C  
+ATOM   1173  C   THR A 164      29.304  28.670  28.411  1.00 32.13           C  
+ATOM   1174  O   THR A 164      28.262  28.091  28.728  1.00 31.83           O  
+ATOM   1175  CB  THR A 164      29.168  31.129  28.048  1.00 32.96           C  
+ATOM   1176  OG1 THR A 164      28.043  31.110  28.933  1.00 32.26           O  
+ATOM   1177  CG2 THR A 164      28.974  32.237  27.021  1.00 33.42           C  
+ATOM   1178  N   PRO A 165      30.481  28.376  28.979  1.00 31.83           N  
+ATOM   1179  CA  PRO A 165      30.609  27.344  30.010  1.00 32.42           C  
+ATOM   1180  C   PRO A 165      29.629  27.492  31.174  1.00 32.91           C  
+ATOM   1181  O   PRO A 165      29.072  26.499  31.648  1.00 31.41           O  
+ATOM   1182  CB  PRO A 165      32.064  27.483  30.451  1.00 32.37           C  
+ATOM   1183  CG  PRO A 165      32.744  27.879  29.179  1.00 31.87           C  
+ATOM   1184  CD  PRO A 165      31.801  28.934  28.635  1.00 31.73           C  
+ATOM   1185  N   SER A 166      29.410  28.723  31.631  1.00 32.73           N  
+ATOM   1186  CA  SER A 166      28.499  28.947  32.750  1.00 33.12           C  
+ATOM   1187  C   SER A 166      27.046  28.679  32.364  1.00 32.02           C  
+ATOM   1188  O   SER A 166      26.319  28.015  33.102  1.00 31.58           O  
+ATOM   1189  CB  SER A 166      28.641  30.376  33.292  1.00 33.89           C  
+ATOM   1190  OG  SER A 166      28.209  31.336  32.345  1.00 37.78           O  
+ATOM   1191  N   ARG A 167      26.622  29.196  31.215  1.00 31.12           N  
+ATOM   1192  CA  ARG A 167      25.252  28.983  30.763  1.00 31.97           C  
+ATOM   1193  C   ARG A 167      25.000  27.496  30.513  1.00 31.55           C  
+ATOM   1194  O   ARG A 167      23.950  26.962  30.883  1.00 30.80           O  
+ATOM   1195  CB  ARG A 167      24.976  29.770  29.480  1.00 34.53           C  
+ATOM   1196  CG  ARG A 167      25.127  31.270  29.630  1.00 40.44           C  
+ATOM   1197  CD  ARG A 167      24.584  32.030  28.421  1.00 45.76           C  
+ATOM   1198  NE  ARG A 167      23.142  32.277  28.502  1.00 50.09           N  
+ATOM   1199  CZ  ARG A 167      22.197  31.360  28.311  1.00 52.39           C  
+ATOM   1200  NH1 ARG A 167      22.522  30.107  28.020  1.00 54.54           N  
+ATOM   1201  NH2 ARG A 167      20.918  31.699  28.412  1.00 52.94           N  
+ATOM   1202  N   ALA A 168      25.969  26.835  29.886  1.00 29.45           N  
+ATOM   1203  CA  ALA A 168      25.861  25.413  29.588  1.00 27.77           C  
+ATOM   1204  C   ALA A 168      25.797  24.605  30.882  1.00 27.53           C  
+ATOM   1205  O   ALA A 168      25.112  23.582  30.954  1.00 26.55           O  
+ATOM   1206  CB  ALA A 168      27.052  24.963  28.747  1.00 27.49           C  
+ATOM   1207  N   ALA A 169      26.517  25.067  31.900  1.00 27.05           N  
+ATOM   1208  CA  ALA A 169      26.541  24.388  33.191  1.00 28.13           C  
+ATOM   1209  C   ALA A 169      25.187  24.494  33.887  1.00 28.93           C  
+ATOM   1210  O   ALA A 169      24.652  23.498  34.382  1.00 26.85           O  
+ATOM   1211  CB  ALA A 169      27.631  24.985  34.077  1.00 27.75           C  
+ATOM   1212  N   SER A 170      24.639  25.706  33.919  1.00 30.31           N  
+ATOM   1213  CA  SER A 170      23.348  25.952  34.557  1.00 32.86           C  
+ATOM   1214  C   SER A 170      22.228  25.134  33.914  1.00 32.04           C  
+ATOM   1215  O   SER A 170      21.437  24.500  34.617  1.00 32.21           O  
+ATOM   1216  CB  SER A 170      23.002  27.447  34.500  1.00 33.78           C  
+ATOM   1217  OG  SER A 170      23.881  28.214  35.316  1.00 35.03           O  
+ATOM   1218  N   SER A 171      22.163  25.151  32.585  1.00 31.13           N  
+ATOM   1219  CA  SER A 171      21.142  24.400  31.854  1.00 31.94           C  
+ATOM   1220  C   SER A 171      21.290  22.909  32.115  1.00 30.57           C  
+ATOM   1221  O   SER A 171      20.312  22.213  32.394  1.00 31.28           O  
+ATOM   1222  CB  SER A 171      21.266  24.648  30.351  1.00 33.02           C  
+ATOM   1223  OG  SER A 171      21.150  26.025  30.062  1.00 36.86           O  
+ATOM   1224  N   MET A 172      22.522  22.427  32.013  1.00 29.60           N  
+ATOM   1225  CA  MET A 172      22.823  21.023  32.235  1.00 28.95           C  
+ATOM   1226  C   MET A 172      22.415  20.618  33.644  1.00 28.73           C  
+ATOM   1227  O   MET A 172      21.756  19.595  33.837  1.00 27.01           O  
+ATOM   1228  CB  MET A 172      24.321  20.775  32.028  1.00 27.30           C  
+ATOM   1229  CG  MET A 172      24.772  19.350  32.272  1.00 22.90           C  
+ATOM   1230  SD  MET A 172      25.039  18.948  34.008  1.00 25.05           S  
+ATOM   1231  CE  MET A 172      26.812  19.324  34.178  1.00 18.24           C  
+ATOM   1232  N   GLU A 173      22.807  21.429  34.625  1.00 27.19           N  
+ATOM   1233  CA  GLU A 173      22.481  21.157  36.020  1.00 27.49           C  
+ATOM   1234  C   GLU A 173      20.969  21.116  36.213  1.00 26.68           C  
+ATOM   1235  O   GLU A 173      20.454  20.291  36.971  1.00 26.75           O  
+ATOM   1236  CB  GLU A 173      23.109  22.227  36.925  1.00 28.23           C  
+ATOM   1237  CG  GLU A 173      24.627  22.283  36.811  1.00 31.20           C  
+ATOM   1238  CD  GLU A 173      25.247  23.465  37.532  1.00 32.58           C  
+ATOM   1239  OE1 GLU A 173      24.671  24.572  37.476  1.00 33.98           O  
+ATOM   1240  OE2 GLU A 173      26.326  23.290  38.138  1.00 33.99           O  
+ATOM   1241  N   ARG A 174      20.261  22.002  35.519  1.00 24.90           N  
+ATOM   1242  CA  ARG A 174      18.810  22.050  35.615  1.00 25.83           C  
+ATOM   1243  C   ARG A 174      18.198  20.820  34.951  1.00 25.28           C  
+ATOM   1244  O   ARG A 174      17.267  20.217  35.484  1.00 24.03           O  
+ATOM   1245  CB  ARG A 174      18.266  23.322  34.958  1.00 25.77           C  
+ATOM   1246  CG  ARG A 174      16.775  23.261  34.658  1.00 27.93           C  
+ATOM   1247  CD  ARG A 174      16.217  24.612  34.284  1.00 31.62           C  
+ATOM   1248  NE  ARG A 174      16.051  25.471  35.453  1.00 34.92           N  
+ATOM   1249  CZ  ARG A 174      15.678  26.744  35.393  1.00 37.66           C  
+ATOM   1250  NH1 ARG A 174      15.433  27.308  34.218  1.00 37.95           N  
+ATOM   1251  NH2 ARG A 174      15.546  27.454  36.507  1.00 38.54           N  
+ATOM   1252  N   SER A 175      18.724  20.448  33.789  1.00 25.51           N  
+ATOM   1253  CA  SER A 175      18.207  19.284  33.090  1.00 24.78           C  
+ATOM   1254  C   SER A 175      18.403  18.074  33.978  1.00 25.49           C  
+ATOM   1255  O   SER A 175      17.544  17.195  34.039  1.00 25.74           O  
+ATOM   1256  CB  SER A 175      18.924  19.084  31.753  1.00 23.29           C  
+ATOM   1257  OG  SER A 175      18.480  20.037  30.800  1.00 21.85           O  
+ATOM   1258  N   MET A 176      19.532  18.030  34.678  1.00 24.07           N  
+ATOM   1259  CA  MET A 176      19.793  16.911  35.566  1.00 24.01           C  
+ATOM   1260  C   MET A 176      18.765  16.901  36.695  1.00 22.88           C  
+ATOM   1261  O   MET A 176      18.333  15.835  37.130  1.00 24.54           O  
+ATOM   1262  CB  MET A 176      21.220  16.979  36.122  1.00 23.07           C  
+ATOM   1263  CG  MET A 176      22.297  16.826  35.045  1.00 23.54           C  
+ATOM   1264  SD  MET A 176      22.021  15.404  33.919  1.00 24.93           S  
+ATOM   1265  CE  MET A 176      21.091  16.224  32.593  1.00 20.99           C  
+ATOM   1266  N   ARG A 177      18.367  18.081  37.162  1.00 21.16           N  
+ATOM   1267  CA  ARG A 177      17.364  18.159  38.221  1.00 22.40           C  
+ATOM   1268  C   ARG A 177      16.034  17.692  37.632  1.00 21.65           C  
+ATOM   1269  O   ARG A 177      15.279  16.959  38.269  1.00 21.31           O  
+ATOM   1270  CB  ARG A 177      17.222  19.593  38.748  1.00 21.72           C  
+ATOM   1271  CG  ARG A 177      18.435  20.112  39.518  1.00 23.81           C  
+ATOM   1272  CD  ARG A 177      18.076  21.350  40.349  1.00 23.85           C  
+ATOM   1273  NE  ARG A 177      17.858  22.544  39.538  1.00 18.05           N  
+ATOM   1274  CZ  ARG A 177      18.832  23.304  39.047  1.00 21.83           C  
+ATOM   1275  NH1 ARG A 177      20.101  22.998  39.287  1.00 24.34           N  
+ATOM   1276  NH2 ARG A 177      18.539  24.367  38.314  1.00 19.63           N  
+ATOM   1277  N   TRP A 178      15.757  18.123  36.407  1.00 21.46           N  
+ATOM   1278  CA  TRP A 178      14.532  17.729  35.725  1.00 22.53           C  
+ATOM   1279  C   TRP A 178      14.530  16.228  35.428  1.00 22.35           C  
+ATOM   1280  O   TRP A 178      13.473  15.592  35.426  1.00 22.88           O  
+ATOM   1281  CB  TRP A 178      14.369  18.540  34.436  1.00 21.37           C  
+ATOM   1282  CG  TRP A 178      13.834  19.919  34.685  1.00 21.99           C  
+ATOM   1283  CD1 TRP A 178      13.480  20.452  35.891  1.00 23.34           C  
+ATOM   1284  CD2 TRP A 178      13.587  20.940  33.711  1.00 23.02           C  
+ATOM   1285  NE1 TRP A 178      13.030  21.738  35.730  1.00 23.83           N  
+ATOM   1286  CE2 TRP A 178      13.085  22.065  34.402  1.00 22.45           C  
+ATOM   1287  CE3 TRP A 178      13.742  21.015  32.322  1.00 23.23           C  
+ATOM   1288  CZ2 TRP A 178      12.739  23.253  33.753  1.00 22.36           C  
+ATOM   1289  CZ3 TRP A 178      13.397  22.201  31.674  1.00 23.41           C  
+ATOM   1290  CH2 TRP A 178      12.901  23.303  32.393  1.00 22.85           C  
+ATOM   1291  N   ALA A 179      15.714  15.666  35.198  1.00 20.24           N  
+ATOM   1292  CA  ALA A 179      15.848  14.237  34.924  1.00 22.39           C  
+ATOM   1293  C   ALA A 179      15.382  13.436  36.136  1.00 22.29           C  
+ATOM   1294  O   ALA A 179      14.666  12.440  36.000  1.00 22.19           O  
+ATOM   1295  CB  ALA A 179      17.301  13.894  34.595  1.00 21.78           C  
+ATOM   1296  N   LYS A 180      15.796  13.872  37.323  1.00 22.12           N  
+ATOM   1297  CA  LYS A 180      15.393  13.209  38.559  1.00 20.72           C  
+ATOM   1298  C   LYS A 180      13.866  13.274  38.690  1.00 20.34           C  
+ATOM   1299  O   LYS A 180      13.218  12.283  39.027  1.00 21.22           O  
+ATOM   1300  CB  LYS A 180      16.055  13.890  39.767  1.00 23.48           C  
+ATOM   1301  CG  LYS A 180      15.582  13.374  41.120  1.00 25.07           C  
+ATOM   1302  CD  LYS A 180      15.711  11.861  41.212  1.00 28.34           C  
+ATOM   1303  CE  LYS A 180      15.177  11.331  42.538  1.00 31.26           C  
+ATOM   1304  NZ  LYS A 180      15.067   9.840  42.531  1.00 31.37           N  
+ATOM   1305  N   ARG A 181      13.294  14.444  38.422  1.00 19.00           N  
+ATOM   1306  CA  ARG A 181      11.843  14.612  38.503  1.00 20.04           C  
+ATOM   1307  C   ARG A 181      11.132  13.708  37.484  1.00 18.47           C  
+ATOM   1308  O   ARG A 181      10.120  13.088  37.799  1.00 17.20           O  
+ATOM   1309  CB  ARG A 181      11.473  16.084  38.283  1.00 20.90           C  
+ATOM   1310  CG  ARG A 181      11.839  16.972  39.481  1.00 24.03           C  
+ATOM   1311  CD  ARG A 181      11.770  18.458  39.158  1.00 21.70           C  
+ATOM   1312  NE  ARG A 181      10.434  18.898  38.768  1.00 22.31           N  
+ATOM   1313  CZ  ARG A 181      10.144  20.141  38.395  1.00 21.87           C  
+ATOM   1314  NH1 ARG A 181      11.099  21.061  38.360  1.00 22.48           N  
+ATOM   1315  NH2 ARG A 181       8.901  20.472  38.065  1.00 20.17           N  
+ATOM   1316  N   SER A 182      11.676  13.618  36.273  1.00 18.05           N  
+ATOM   1317  CA  SER A 182      11.088  12.762  35.243  1.00 16.71           C  
+ATOM   1318  C   SER A 182      11.110  11.324  35.747  1.00 17.78           C  
+ATOM   1319  O   SER A 182      10.108  10.603  35.671  1.00 18.05           O  
+ATOM   1320  CB  SER A 182      11.891  12.857  33.943  1.00 16.05           C  
+ATOM   1321  OG  SER A 182      11.830  14.156  33.390  1.00 14.61           O  
+ATOM   1322  N   ARG A 183      12.263  10.913  36.270  1.00 18.70           N  
+ATOM   1323  CA  ARG A 183      12.426   9.566  36.797  1.00 20.37           C  
+ATOM   1324  C   ARG A 183      11.389   9.242  37.870  1.00 21.59           C  
+ATOM   1325  O   ARG A 183      10.744   8.193  37.814  1.00 22.42           O  
+ATOM   1326  CB  ARG A 183      13.839   9.386  37.365  1.00 21.55           C  
+ATOM   1327  CG  ARG A 183      13.998   8.170  38.273  1.00 23.75           C  
+ATOM   1328  CD  ARG A 183      13.446   6.893  37.639  1.00 27.96           C  
+ATOM   1329  NE  ARG A 183      14.330   6.325  36.634  1.00 26.67           N  
+ATOM   1330  CZ  ARG A 183      14.043   5.247  35.908  1.00 27.91           C  
+ATOM   1331  NH1 ARG A 183      12.885   4.613  36.068  1.00 27.97           N  
+ATOM   1332  NH2 ARG A 183      14.926   4.790  35.033  1.00 26.14           N  
+ATOM   1333  N   ASP A 184      11.226  10.139  38.841  1.00 21.19           N  
+ATOM   1334  CA  ASP A 184      10.261   9.920  39.917  1.00 21.70           C  
+ATOM   1335  C   ASP A 184       8.825   9.944  39.406  1.00 20.97           C  
+ATOM   1336  O   ASP A 184       7.988   9.164  39.858  1.00 19.49           O  
+ATOM   1337  CB  ASP A 184      10.409  10.976  41.019  1.00 22.67           C  
+ATOM   1338  CG  ASP A 184      11.743  10.893  41.741  1.00 23.15           C  
+ATOM   1339  OD1 ASP A 184      12.279   9.777  41.903  1.00 25.39           O  
+ATOM   1340  OD2 ASP A 184      12.245  11.953  42.162  1.00 26.43           O  
+ATOM   1341  N   ALA A 185       8.537  10.841  38.467  1.00 20.96           N  
+ATOM   1342  CA  ALA A 185       7.187  10.932  37.923  1.00 20.61           C  
+ATOM   1343  C   ALA A 185       6.865   9.623  37.211  1.00 20.58           C  
+ATOM   1344  O   ALA A 185       5.797   9.045  37.397  1.00 20.25           O  
+ATOM   1345  CB  ALA A 185       7.087  12.104  36.956  1.00 18.84           C  
+ATOM   1346  N   PHE A 186       7.808   9.158  36.401  1.00 21.54           N  
+ATOM   1347  CA  PHE A 186       7.651   7.912  35.653  1.00 20.15           C  
+ATOM   1348  C   PHE A 186       7.434   6.719  36.597  1.00 20.77           C  
+ATOM   1349  O   PHE A 186       6.525   5.912  36.392  1.00 20.22           O  
+ATOM   1350  CB  PHE A 186       8.894   7.714  34.774  1.00 18.97           C  
+ATOM   1351  CG  PHE A 186       8.897   6.444  33.962  1.00 18.46           C  
+ATOM   1352  CD1 PHE A 186       9.304   5.239  34.527  1.00 15.93           C  
+ATOM   1353  CD2 PHE A 186       8.541   6.467  32.614  1.00 18.97           C  
+ATOM   1354  CE1 PHE A 186       9.362   4.074  33.758  1.00 16.33           C  
+ATOM   1355  CE2 PHE A 186       8.594   5.309  31.838  1.00 18.85           C  
+ATOM   1356  CZ  PHE A 186       9.008   4.109  32.414  1.00 17.38           C  
+ATOM   1357  N   ASP A 187       8.250   6.625  37.644  1.00 21.39           N  
+ATOM   1358  CA  ASP A 187       8.143   5.521  38.601  1.00 22.36           C  
+ATOM   1359  C   ASP A 187       6.882   5.506  39.459  1.00 23.29           C  
+ATOM   1360  O   ASP A 187       6.456   4.445  39.909  1.00 22.94           O  
+ATOM   1361  CB  ASP A 187       9.352   5.495  39.540  1.00 21.79           C  
+ATOM   1362  CG  ASP A 187      10.642   5.220  38.819  1.00 22.40           C  
+ATOM   1363  OD1 ASP A 187      10.610   4.562  37.759  1.00 22.32           O  
+ATOM   1364  OD2 ASP A 187      11.691   5.650  39.328  1.00 23.55           O  
+ATOM   1365  N   SER A 188       6.300   6.672  39.710  1.00 25.51           N  
+ATOM   1366  CA  SER A 188       5.089   6.741  40.525  1.00 28.56           C  
+ATOM   1367  C   SER A 188       3.862   6.217  39.788  1.00 28.82           C  
+ATOM   1368  O   SER A 188       2.887   5.797  40.410  1.00 30.77           O  
+ATOM   1369  CB  SER A 188       4.839   8.177  40.976  1.00 28.54           C  
+ATOM   1370  OG  SER A 188       5.883   8.614  41.825  1.00 32.67           O  
+ATOM   1371  N   ARG A 189       3.920   6.243  38.462  1.00 28.22           N  
+ATOM   1372  CA  ARG A 189       2.824   5.780  37.624  1.00 26.96           C  
+ATOM   1373  C   ARG A 189       3.080   4.305  37.323  1.00 27.18           C  
+ATOM   1374  O   ARG A 189       3.802   3.972  36.378  1.00 25.35           O  
+ATOM   1375  CB  ARG A 189       2.796   6.598  36.331  1.00 27.87           C  
+ATOM   1376  CG  ARG A 189       1.474   6.569  35.582  1.00 29.62           C  
+ATOM   1377  CD  ARG A 189       1.572   7.417  34.328  1.00 31.57           C  
+ATOM   1378  NE  ARG A 189       1.965   8.796  34.624  1.00 34.32           N  
+ATOM   1379  CZ  ARG A 189       1.144   9.715  35.117  1.00 33.49           C  
+ATOM   1380  NH1 ARG A 189      -0.119   9.405  35.367  1.00 38.75           N  
+ATOM   1381  NH2 ARG A 189       1.585  10.939  35.369  1.00 32.39           N  
+ATOM   1382  N   LYS A 190       2.478   3.435  38.132  1.00 27.33           N  
+ATOM   1383  CA  LYS A 190       2.653   1.988  38.026  1.00 28.88           C  
+ATOM   1384  C   LYS A 190       2.571   1.368  36.641  1.00 28.47           C  
+ATOM   1385  O   LYS A 190       3.471   0.636  36.234  1.00 25.06           O  
+ATOM   1386  CB  LYS A 190       1.662   1.264  38.944  1.00 32.81           C  
+ATOM   1387  CG  LYS A 190       1.871   1.534  40.429  1.00 37.54           C  
+ATOM   1388  CD  LYS A 190       1.066   0.558  41.288  1.00 42.39           C  
+ATOM   1389  CE  LYS A 190      -0.435   0.645  41.009  1.00 44.68           C  
+ATOM   1390  NZ  LYS A 190      -1.022   1.949  41.436  1.00 45.41           N  
+ATOM   1391  N   GLU A 191       1.483   1.640  35.928  1.00 28.65           N  
+ATOM   1392  CA  GLU A 191       1.293   1.081  34.598  1.00 28.49           C  
+ATOM   1393  C   GLU A 191       2.399   1.505  33.643  1.00 25.94           C  
+ATOM   1394  O   GLU A 191       2.841   0.728  32.802  1.00 26.27           O  
+ATOM   1395  CB  GLU A 191      -0.056   1.520  34.031  1.00 32.26           C  
+ATOM   1396  CG  GLU A 191      -0.337   0.966  32.643  1.00 39.10           C  
+ATOM   1397  CD  GLU A 191      -1.621   1.508  32.051  1.00 43.65           C  
+ATOM   1398  OE1 GLU A 191      -1.941   1.151  30.896  1.00 47.80           O  
+ATOM   1399  OE2 GLU A 191      -2.310   2.292  32.740  1.00 46.66           O  
+ATOM   1400  N   GLN A 192       2.838   2.748  33.776  1.00 23.79           N  
+ATOM   1401  CA  GLN A 192       3.884   3.269  32.913  1.00 22.28           C  
+ATOM   1402  C   GLN A 192       5.236   2.658  33.265  1.00 21.24           C  
+ATOM   1403  O   GLN A 192       5.935   2.136  32.397  1.00 20.27           O  
+ATOM   1404  CB  GLN A 192       3.934   4.795  33.026  1.00 19.02           C  
+ATOM   1405  CG  GLN A 192       5.031   5.452  32.217  1.00 18.63           C  
+ATOM   1406  CD  GLN A 192       4.867   6.955  32.139  1.00 19.60           C  
+ATOM   1407  OE1 GLN A 192       4.640   7.623  33.154  1.00 20.11           O  
+ATOM   1408  NE2 GLN A 192       4.983   7.499  30.933  1.00 17.49           N  
+ATOM   1409  N   ALA A 193       5.593   2.710  34.544  1.00 20.20           N  
+ATOM   1410  CA  ALA A 193       6.862   2.161  35.005  1.00 18.92           C  
+ATOM   1411  C   ALA A 193       7.028   0.690  34.641  1.00 20.17           C  
+ATOM   1412  O   ALA A 193       8.146   0.227  34.394  1.00 22.03           O  
+ATOM   1413  CB  ALA A 193       6.986   2.333  36.522  1.00 17.63           C  
+ATOM   1414  N   GLU A 194       5.916  -0.039  34.592  1.00 19.94           N  
+ATOM   1415  CA  GLU A 194       5.949  -1.471  34.299  1.00 20.57           C  
+ATOM   1416  C   GLU A 194       5.880  -1.891  32.831  1.00 18.40           C  
+ATOM   1417  O   GLU A 194       6.243  -3.018  32.494  1.00 16.88           O  
+ATOM   1418  CB  GLU A 194       4.832  -2.172  35.081  1.00 23.39           C  
+ATOM   1419  CG  GLU A 194       4.952  -1.983  36.590  1.00 28.18           C  
+ATOM   1420  CD  GLU A 194       3.790  -2.581  37.365  1.00 31.77           C  
+ATOM   1421  OE1 GLU A 194       3.652  -2.257  38.568  1.00 32.29           O  
+ATOM   1422  OE2 GLU A 194       3.023  -3.377  36.775  1.00 33.30           O  
+ATOM   1423  N   ASN A 195       5.435  -0.997  31.953  1.00 17.99           N  
+ATOM   1424  CA  ASN A 195       5.316  -1.347  30.539  1.00 19.22           C  
+ATOM   1425  C   ASN A 195       6.140  -0.507  29.579  1.00 19.53           C  
+ATOM   1426  O   ASN A 195       6.324  -0.886  28.421  1.00 21.03           O  
+ATOM   1427  CB  ASN A 195       3.852  -1.287  30.117  1.00 20.10           C  
+ATOM   1428  CG  ASN A 195       3.016  -2.327  30.812  1.00 21.02           C  
+ATOM   1429  OD1 ASN A 195       3.207  -3.523  30.603  1.00 22.55           O  
+ATOM   1430  ND2 ASN A 195       2.091  -1.881  31.656  1.00 22.15           N  
+ATOM   1431  N   ALA A 196       6.625   0.633  30.053  1.00 18.07           N  
+ATOM   1432  CA  ALA A 196       7.420   1.522  29.219  1.00 18.59           C  
+ATOM   1433  C   ALA A 196       8.828   1.690  29.782  1.00 18.58           C  
+ATOM   1434  O   ALA A 196       9.108   1.280  30.910  1.00 17.94           O  
+ATOM   1435  CB  ALA A 196       6.731   2.875  29.112  1.00 16.98           C  
+ATOM   1436  N   ALA A 197       9.707   2.289  28.985  1.00 17.77           N  
+ATOM   1437  CA  ALA A 197      11.088   2.533  29.389  1.00 17.66           C  
+ATOM   1438  C   ALA A 197      11.308   4.043  29.462  1.00 18.91           C  
+ATOM   1439  O   ALA A 197      10.563   4.814  28.861  1.00 17.57           O  
+ATOM   1440  CB  ALA A 197      12.055   1.901  28.385  1.00 17.79           C  
+ATOM   1441  N   LEU A 198      12.332   4.463  30.196  1.00 18.77           N  
+ATOM   1442  CA  LEU A 198      12.615   5.884  30.355  1.00 17.83           C  
+ATOM   1443  C   LEU A 198      14.065   6.146  29.972  1.00 17.15           C  
+ATOM   1444  O   LEU A 198      14.954   5.462  30.457  1.00 17.85           O  
+ATOM   1445  CB  LEU A 198      12.399   6.285  31.819  1.00 17.88           C  
+ATOM   1446  CG  LEU A 198      11.871   7.664  32.232  1.00 21.69           C  
+ATOM   1447  CD1 LEU A 198      12.507   8.034  33.579  1.00 17.43           C  
+ATOM   1448  CD2 LEU A 198      12.177   8.718  31.195  1.00 19.31           C  
+ATOM   1449  N   PHE A 199      14.295   7.135  29.110  1.00 16.95           N  
+ATOM   1450  CA  PHE A 199      15.650   7.502  28.676  1.00 16.43           C  
+ATOM   1451  C   PHE A 199      16.052   8.858  29.268  1.00 16.91           C  
+ATOM   1452  O   PHE A 199      15.267   9.809  29.256  1.00 18.79           O  
+ATOM   1453  CB  PHE A 199      15.716   7.601  27.140  1.00 14.29           C  
+ATOM   1454  CG  PHE A 199      15.945   6.284  26.437  1.00 13.80           C  
+ATOM   1455  CD1 PHE A 199      15.509   5.086  26.989  1.00 12.32           C  
+ATOM   1456  CD2 PHE A 199      16.581   6.254  25.199  1.00 14.90           C  
+ATOM   1457  CE1 PHE A 199      15.702   3.874  26.317  1.00 14.67           C  
+ATOM   1458  CE2 PHE A 199      16.778   5.047  24.520  1.00 14.45           C  
+ATOM   1459  CZ  PHE A 199      16.336   3.857  25.084  1.00 11.40           C  
+ATOM   1460  N   GLY A 200      17.272   8.944  29.790  1.00 18.94           N  
+ATOM   1461  CA  GLY A 200      17.754  10.199  30.338  1.00 16.28           C  
+ATOM   1462  C   GLY A 200      18.520  10.868  29.215  1.00 18.77           C  
+ATOM   1463  O   GLY A 200      18.974  10.180  28.300  1.00 17.90           O  
+ATOM   1464  N   ILE A 201      18.672  12.189  29.259  1.00 18.93           N  
+ATOM   1465  CA  ILE A 201      19.397  12.884  28.198  1.00 19.02           C  
+ATOM   1466  C   ILE A 201      20.594  13.670  28.712  1.00 21.30           C  
+ATOM   1467  O   ILE A 201      20.457  14.541  29.570  1.00 21.14           O  
+ATOM   1468  CB  ILE A 201      18.502  13.881  27.448  1.00 19.97           C  
+ATOM   1469  CG1 ILE A 201      17.202  13.204  27.007  1.00 20.67           C  
+ATOM   1470  CG2 ILE A 201      19.259  14.430  26.238  1.00 18.74           C  
+ATOM   1471  CD1 ILE A 201      16.171  14.176  26.436  1.00 21.14           C  
+ATOM   1472  N   GLN A 202      21.766  13.368  28.167  1.00 21.52           N  
+ATOM   1473  CA  GLN A 202      22.991  14.052  28.552  1.00 22.71           C  
+ATOM   1474  C   GLN A 202      23.088  15.417  27.878  1.00 24.18           C  
+ATOM   1475  O   GLN A 202      22.808  15.560  26.684  1.00 22.24           O  
+ATOM   1476  CB  GLN A 202      24.213  13.215  28.156  1.00 21.84           C  
+ATOM   1477  CG  GLN A 202      25.553  13.793  28.610  1.00 21.36           C  
+ATOM   1478  CD  GLN A 202      26.728  13.213  27.835  1.00 23.78           C  
+ATOM   1479  OE1 GLN A 202      27.828  13.057  28.372  1.00 23.89           O  
+ATOM   1480  NE2 GLN A 202      26.504  12.911  26.559  1.00 19.89           N  
+ATOM   1481  N   GLN A 203      23.479  16.422  28.657  1.00 25.69           N  
+ATOM   1482  CA  GLN A 203      23.661  17.774  28.139  1.00 25.55           C  
+ATOM   1483  C   GLN A 203      25.094  18.187  28.458  1.00 25.93           C  
+ATOM   1484  O   GLN A 203      25.929  17.340  28.772  1.00 26.15           O  
+ATOM   1485  CB  GLN A 203      22.670  18.747  28.787  1.00 24.37           C  
+ATOM   1486  CG  GLN A 203      21.219  18.556  28.356  1.00 24.23           C  
+ATOM   1487  CD  GLN A 203      21.030  18.675  26.854  1.00 26.31           C  
+ATOM   1488  OE1 GLN A 203      21.644  19.520  26.207  1.00 27.38           O  
+ATOM   1489  NE2 GLN A 203      20.164  17.835  26.295  1.00 25.72           N  
+ATOM   1490  N   GLY A 204      25.380  19.482  28.377  1.00 27.17           N  
+ATOM   1491  CA  GLY A 204      26.721  19.953  28.669  1.00 25.99           C  
+ATOM   1492  C   GLY A 204      27.378  20.611  27.473  1.00 27.52           C  
+ATOM   1493  O   GLY A 204      28.577  20.886  27.492  1.00 28.25           O  
+ATOM   1494  N   SER A 205      26.593  20.862  26.430  1.00 27.09           N  
+ATOM   1495  CA  SER A 205      27.099  21.489  25.215  1.00 28.58           C  
+ATOM   1496  C   SER A 205      28.316  20.739  24.649  1.00 29.18           C  
+ATOM   1497  O   SER A 205      28.297  19.513  24.528  1.00 29.27           O  
+ATOM   1498  CB  SER A 205      27.461  22.952  25.496  1.00 29.44           C  
+ATOM   1499  OG  SER A 205      27.731  23.653  24.294  1.00 29.11           O  
+ATOM   1500  N   VAL A 206      29.372  21.474  24.315  1.00 29.23           N  
+ATOM   1501  CA  VAL A 206      30.578  20.877  23.749  1.00 28.64           C  
+ATOM   1502  C   VAL A 206      31.687  20.725  24.782  1.00 29.91           C  
+ATOM   1503  O   VAL A 206      32.828  20.416  24.436  1.00 30.05           O  
+ATOM   1504  CB  VAL A 206      31.126  21.740  22.596  1.00 28.61           C  
+ATOM   1505  CG1 VAL A 206      30.026  22.013  21.585  1.00 28.94           C  
+ATOM   1506  CG2 VAL A 206      31.681  23.052  23.141  1.00 28.93           C  
+ATOM   1507  N   PHE A 207      31.351  20.926  26.050  1.00 28.75           N  
+ATOM   1508  CA  PHE A 207      32.336  20.846  27.119  1.00 28.02           C  
+ATOM   1509  C   PHE A 207      32.420  19.476  27.768  1.00 29.53           C  
+ATOM   1510  O   PHE A 207      31.429  18.943  28.267  1.00 26.47           O  
+ATOM   1511  CB  PHE A 207      32.020  21.925  28.150  1.00 29.42           C  
+ATOM   1512  CG  PHE A 207      31.802  23.270  27.534  1.00 29.00           C  
+ATOM   1513  CD1 PHE A 207      32.863  23.957  26.948  1.00 30.37           C  
+ATOM   1514  CD2 PHE A 207      30.528  23.816  27.461  1.00 28.70           C  
+ATOM   1515  CE1 PHE A 207      32.655  25.168  26.293  1.00 30.08           C  
+ATOM   1516  CE2 PHE A 207      30.310  25.027  26.809  1.00 28.69           C  
+ATOM   1517  CZ  PHE A 207      31.375  25.702  26.223  1.00 30.28           C  
+ATOM   1518  N   GLU A 208      33.625  18.920  27.759  1.00 28.69           N  
+ATOM   1519  CA  GLU A 208      33.879  17.602  28.310  1.00 30.50           C  
+ATOM   1520  C   GLU A 208      33.514  17.451  29.787  1.00 31.37           C  
+ATOM   1521  O   GLU A 208      32.800  16.519  30.161  1.00 31.86           O  
+ATOM   1522  CB  GLU A 208      35.353  17.233  28.100  1.00 29.34           C  
+ATOM   1523  CG  GLU A 208      35.663  15.764  28.335  1.00 31.34           C  
+ATOM   1524  CD  GLU A 208      37.082  15.395  27.948  1.00 32.40           C  
+ATOM   1525  OE1 GLU A 208      37.724  16.174  27.216  1.00 32.41           O  
+ATOM   1526  OE2 GLU A 208      37.551  14.317  28.365  1.00 32.84           O  
+ATOM   1527  N   ASN A 209      33.998  18.360  30.628  1.00 31.46           N  
+ATOM   1528  CA  ASN A 209      33.715  18.270  32.056  1.00 31.20           C  
+ATOM   1529  C   ASN A 209      32.220  18.360  32.351  1.00 30.30           C  
+ATOM   1530  O   ASN A 209      31.720  17.707  33.268  1.00 30.68           O  
+ATOM   1531  CB  ASN A 209      34.488  19.352  32.824  1.00 31.84           C  
+ATOM   1532  CG  ASN A 209      34.010  20.751  32.510  1.00 31.54           C  
+ATOM   1533  OD1 ASN A 209      33.810  21.108  31.350  1.00 34.31           O  
+ATOM   1534  ND2 ASN A 209      33.837  21.560  33.547  1.00 35.62           N  
+ATOM   1535  N   LEU A 210      31.503  19.163  31.576  1.00 28.79           N  
+ATOM   1536  CA  LEU A 210      30.065  19.295  31.767  1.00 29.57           C  
+ATOM   1537  C   LEU A 210      29.373  18.003  31.342  1.00 30.88           C  
+ATOM   1538  O   LEU A 210      28.450  17.533  32.011  1.00 31.05           O  
+ATOM   1539  CB  LEU A 210      29.531  20.472  30.953  1.00 29.36           C  
+ATOM   1540  CG  LEU A 210      29.173  21.739  31.735  1.00 29.45           C  
+ATOM   1541  CD1 LEU A 210      30.136  21.951  32.899  1.00 30.88           C  
+ATOM   1542  CD2 LEU A 210      29.196  22.918  30.791  1.00 28.21           C  
+ATOM   1543  N   ARG A 211      29.837  17.429  30.233  1.00 30.23           N  
+ATOM   1544  CA  ARG A 211      29.281  16.185  29.714  1.00 27.55           C  
+ATOM   1545  C   ARG A 211      29.499  15.056  30.706  1.00 27.60           C  
+ATOM   1546  O   ARG A 211      28.640  14.187  30.871  1.00 26.43           O  
+ATOM   1547  CB  ARG A 211      29.937  15.828  28.377  1.00 25.34           C  
+ATOM   1548  CG  ARG A 211      29.465  16.669  27.195  1.00 23.60           C  
+ATOM   1549  CD  ARG A 211      28.108  16.193  26.670  1.00 22.18           C  
+ATOM   1550  NE  ARG A 211      27.560  17.110  25.670  1.00 21.97           N  
+ATOM   1551  CZ  ARG A 211      26.351  17.001  25.128  1.00 21.49           C  
+ATOM   1552  NH1 ARG A 211      25.550  16.005  25.481  1.00 25.63           N  
+ATOM   1553  NH2 ARG A 211      25.935  17.899  24.246  1.00 20.69           N  
+ATOM   1554  N   GLN A 212      30.654  15.073  31.368  1.00 27.30           N  
+ATOM   1555  CA  GLN A 212      30.988  14.040  32.340  1.00 27.73           C  
+ATOM   1556  C   GLN A 212      30.106  14.156  33.575  1.00 28.28           C  
+ATOM   1557  O   GLN A 212      29.663  13.151  34.136  1.00 27.51           O  
+ATOM   1558  CB  GLN A 212      32.460  14.145  32.748  1.00 27.77           C  
+ATOM   1559  CG  GLN A 212      32.888  13.092  33.755  1.00 27.78           C  
+ATOM   1560  CD  GLN A 212      32.807  11.680  33.205  1.00 27.86           C  
+ATOM   1561  OE1 GLN A 212      33.575  11.298  32.326  1.00 28.39           O  
+ATOM   1562  NE2 GLN A 212      31.869  10.898  33.723  1.00 31.09           N  
+ATOM   1563  N   GLN A 213      29.866  15.388  34.009  1.00 28.84           N  
+ATOM   1564  CA  GLN A 213      29.025  15.611  35.173  1.00 30.25           C  
+ATOM   1565  C   GLN A 213      27.616  15.121  34.853  1.00 28.75           C  
+ATOM   1566  O   GLN A 213      27.007  14.390  35.638  1.00 28.77           O  
+ATOM   1567  CB  GLN A 213      29.000  17.093  35.524  1.00 32.87           C  
+ATOM   1568  CG  GLN A 213      30.308  17.606  36.102  1.00 38.21           C  
+ATOM   1569  CD  GLN A 213      30.334  19.114  36.206  1.00 40.53           C  
+ATOM   1570  OE1 GLN A 213      29.403  19.727  36.727  1.00 43.26           O  
+ATOM   1571  NE2 GLN A 213      31.405  19.722  35.710  1.00 43.92           N  
+ATOM   1572  N   SER A 214      27.113  15.520  33.689  1.00 27.14           N  
+ATOM   1573  CA  SER A 214      25.780  15.128  33.248  1.00 27.90           C  
+ATOM   1574  C   SER A 214      25.658  13.607  33.202  1.00 27.13           C  
+ATOM   1575  O   SER A 214      24.672  13.036  33.676  1.00 26.55           O  
+ATOM   1576  CB  SER A 214      25.488  15.711  31.864  1.00 26.48           C  
+ATOM   1577  OG  SER A 214      24.170  15.389  31.449  1.00 28.94           O  
+ATOM   1578  N   ALA A 215      26.669  12.957  32.637  1.00 25.69           N  
+ATOM   1579  CA  ALA A 215      26.681  11.505  32.530  1.00 26.23           C  
+ATOM   1580  C   ALA A 215      26.649  10.834  33.904  1.00 27.46           C  
+ATOM   1581  O   ALA A 215      25.904   9.875  34.116  1.00 27.39           O  
+ATOM   1582  CB  ALA A 215      27.917  11.047  31.753  1.00 24.02           C  
+ATOM   1583  N   ASP A 216      27.459  11.332  34.835  1.00 27.52           N  
+ATOM   1584  CA  ASP A 216      27.499  10.751  36.173  1.00 28.50           C  
+ATOM   1585  C   ASP A 216      26.146  10.901  36.861  1.00 27.50           C  
+ATOM   1586  O   ASP A 216      25.655   9.964  37.493  1.00 28.06           O  
+ATOM   1587  CB  ASP A 216      28.579  11.419  37.037  1.00 30.58           C  
+ATOM   1588  CG  ASP A 216      29.978  11.249  36.472  1.00 34.55           C  
+ATOM   1589  OD1 ASP A 216      30.313  10.142  35.994  1.00 35.15           O  
+ATOM   1590  OD2 ASP A 216      30.754  12.225  36.523  1.00 36.80           O  
+ATOM   1591  N   ALA A 217      25.555  12.085  36.737  1.00 26.15           N  
+ATOM   1592  CA  ALA A 217      24.259  12.366  37.351  1.00 26.92           C  
+ATOM   1593  C   ALA A 217      23.180  11.471  36.761  1.00 26.54           C  
+ATOM   1594  O   ALA A 217      22.339  10.934  37.486  1.00 26.45           O  
+ATOM   1595  CB  ALA A 217      23.891  13.832  37.148  1.00 24.29           C  
+ATOM   1596  N   LEU A 218      23.211  11.313  35.441  1.00 26.90           N  
+ATOM   1597  CA  LEU A 218      22.241  10.476  34.744  1.00 25.94           C  
+ATOM   1598  C   LEU A 218      22.408   9.018  35.148  1.00 25.76           C  
+ATOM   1599  O   LEU A 218      21.424   8.324  35.406  1.00 25.54           O  
+ATOM   1600  CB  LEU A 218      22.408  10.632  33.230  1.00 24.27           C  
+ATOM   1601  CG  LEU A 218      21.351  11.441  32.474  1.00 24.73           C  
+ATOM   1602  CD1 LEU A 218      20.693  12.464  33.375  1.00 22.72           C  
+ATOM   1603  CD2 LEU A 218      21.997  12.095  31.270  1.00 23.94           C  
+ATOM   1604  N   ALA A 219      23.655   8.554  35.201  1.00 24.99           N  
+ATOM   1605  CA  ALA A 219      23.937   7.177  35.598  1.00 24.35           C  
+ATOM   1606  C   ALA A 219      23.559   7.024  37.064  1.00 25.01           C  
+ATOM   1607  O   ALA A 219      23.128   5.958  37.507  1.00 23.63           O  
+ATOM   1608  CB  ALA A 219      25.419   6.865  35.406  1.00 25.54           C  
+ATOM   1609  N   GLU A 220      23.729   8.107  37.814  1.00 26.18           N  
+ATOM   1610  CA  GLU A 220      23.398   8.115  39.230  1.00 29.25           C  
+ATOM   1611  C   GLU A 220      21.900   7.883  39.383  1.00 26.70           C  
+ATOM   1612  O   GLU A 220      21.466   7.101  40.226  1.00 26.49           O  
+ATOM   1613  CB  GLU A 220      23.800   9.457  39.852  1.00 31.97           C  
+ATOM   1614  CG  GLU A 220      23.502   9.578  41.336  1.00 38.32           C  
+ATOM   1615  CD  GLU A 220      23.820   8.310  42.098  1.00 41.09           C  
+ATOM   1616  OE1 GLU A 220      24.934   7.764  41.921  1.00 42.74           O  
+ATOM   1617  OE2 GLU A 220      22.951   7.859  42.876  1.00 44.07           O  
+ATOM   1618  N   ILE A 221      21.112   8.569  38.562  1.00 26.22           N  
+ATOM   1619  CA  ILE A 221      19.662   8.407  38.602  1.00 24.65           C  
+ATOM   1620  C   ILE A 221      19.341   6.996  38.124  1.00 23.95           C  
+ATOM   1621  O   ILE A 221      18.573   6.270  38.754  1.00 24.36           O  
+ATOM   1622  CB  ILE A 221      18.944   9.391  37.656  1.00 25.18           C  
+ATOM   1623  CG1 ILE A 221      19.334  10.837  37.993  1.00 23.89           C  
+ATOM   1624  CG2 ILE A 221      17.431   9.172  37.738  1.00 22.93           C  
+ATOM   1625  CD1 ILE A 221      18.875  11.304  39.331  1.00 28.40           C  
+ATOM   1626  N   GLY A 222      19.944   6.611  37.002  1.00 21.46           N  
+ATOM   1627  CA  GLY A 222      19.700   5.291  36.454  1.00 21.01           C  
+ATOM   1628  C   GLY A 222      18.562   5.351  35.455  1.00 20.39           C  
+ATOM   1629  O   GLY A 222      17.443   5.726  35.803  1.00 20.03           O  
+ATOM   1630  N   PHE A 223      18.855   4.983  34.212  1.00 20.80           N  
+ATOM   1631  CA  PHE A 223      17.872   4.993  33.135  1.00 20.38           C  
+ATOM   1632  C   PHE A 223      17.985   3.746  32.269  1.00 19.86           C  
+ATOM   1633  O   PHE A 223      18.975   3.021  32.336  1.00 20.95           O  
+ATOM   1634  CB  PHE A 223      18.073   6.235  32.261  1.00 18.13           C  
+ATOM   1635  CG  PHE A 223      17.641   7.506  32.915  1.00 16.32           C  
+ATOM   1636  CD1 PHE A 223      16.302   7.891  32.895  1.00 16.58           C  
+ATOM   1637  CD2 PHE A 223      18.566   8.313  33.570  1.00 15.56           C  
+ATOM   1638  CE1 PHE A 223      15.889   9.065  33.519  1.00 15.90           C  
+ATOM   1639  CE2 PHE A 223      18.167   9.484  34.195  1.00 16.34           C  
+ATOM   1640  CZ  PHE A 223      16.823   9.863  34.170  1.00 16.36           C  
+ATOM   1641  N   ASP A 224      16.963   3.509  31.453  1.00 17.33           N  
+ATOM   1642  CA  ASP A 224      16.936   2.357  30.562  1.00 18.04           C  
+ATOM   1643  C   ASP A 224      17.804   2.597  29.327  1.00 16.06           C  
+ATOM   1644  O   ASP A 224      18.239   1.655  28.668  1.00 17.26           O  
+ATOM   1645  CB  ASP A 224      15.497   2.075  30.132  1.00 17.76           C  
+ATOM   1646  CG  ASP A 224      14.618   1.672  31.294  1.00 18.21           C  
+ATOM   1647  OD1 ASP A 224      15.015   0.759  32.044  1.00 19.80           O  
+ATOM   1648  OD2 ASP A 224      13.531   2.256  31.457  1.00 18.99           O  
+ATOM   1649  N   GLY A 225      18.031   3.870  29.022  1.00 16.30           N  
+ATOM   1650  CA  GLY A 225      18.838   4.252  27.877  1.00 15.76           C  
+ATOM   1651  C   GLY A 225      19.318   5.674  28.090  1.00 14.90           C  
+ATOM   1652  O   GLY A 225      18.756   6.395  28.912  1.00 12.93           O  
+ATOM   1653  N   TYR A 226      20.353   6.080  27.364  1.00 15.34           N  
+ATOM   1654  CA  TYR A 226      20.892   7.426  27.501  1.00 15.72           C  
+ATOM   1655  C   TYR A 226      21.046   8.100  26.154  1.00 15.63           C  
+ATOM   1656  O   TYR A 226      21.630   7.547  25.218  1.00 16.76           O  
+ATOM   1657  CB  TYR A 226      22.250   7.393  28.218  1.00 17.60           C  
+ATOM   1658  CG  TYR A 226      22.186   6.733  29.578  1.00 18.16           C  
+ATOM   1659  CD1 TYR A 226      22.122   5.346  29.695  1.00 16.40           C  
+ATOM   1660  CD2 TYR A 226      22.110   7.498  30.746  1.00 18.28           C  
+ATOM   1661  CE1 TYR A 226      21.974   4.727  30.945  1.00 18.70           C  
+ATOM   1662  CE2 TYR A 226      21.960   6.891  32.001  1.00 18.23           C  
+ATOM   1663  CZ  TYR A 226      21.888   5.506  32.088  1.00 18.48           C  
+ATOM   1664  OH  TYR A 226      21.692   4.901  33.310  1.00 20.29           O  
+ATOM   1665  N   ALA A 227      20.511   9.304  26.052  1.00 15.43           N  
+ATOM   1666  CA  ALA A 227      20.609  10.046  24.816  1.00 15.49           C  
+ATOM   1667  C   ALA A 227      21.664  11.122  24.935  1.00 18.33           C  
+ATOM   1668  O   ALA A 227      21.938  11.637  26.022  1.00 16.35           O  
+ATOM   1669  CB  ALA A 227      19.272  10.678  24.480  1.00 15.72           C  
+ATOM   1670  N   VAL A 228      22.275  11.445  23.806  1.00 19.53           N  
+ATOM   1671  CA  VAL A 228      23.255  12.504  23.771  1.00 20.97           C  
+ATOM   1672  C   VAL A 228      22.446  13.659  23.195  1.00 22.48           C  
+ATOM   1673  O   VAL A 228      22.101  13.666  22.009  1.00 20.92           O  
+ATOM   1674  CB  VAL A 228      24.433  12.165  22.842  1.00 21.61           C  
+ATOM   1675  CG1 VAL A 228      25.418  13.319  22.813  1.00 20.31           C  
+ATOM   1676  CG2 VAL A 228      25.127  10.895  23.325  1.00 22.95           C  
+ATOM   1677  N   GLY A 229      22.104  14.616  24.047  1.00 20.71           N  
+ATOM   1678  CA  GLY A 229      21.329  15.744  23.578  1.00 21.05           C  
+ATOM   1679  C   GLY A 229      22.195  16.945  23.269  1.00 21.43           C  
+ATOM   1680  O   GLY A 229      23.409  16.930  23.493  1.00 20.95           O  
+ATOM   1681  N   GLY A 230      21.559  17.976  22.727  1.00 22.55           N  
+ATOM   1682  CA  GLY A 230      22.248  19.211  22.405  1.00 25.54           C  
+ATOM   1683  C   GLY A 230      23.241  19.201  21.259  1.00 26.91           C  
+ATOM   1684  O   GLY A 230      24.011  20.151  21.125  1.00 25.91           O  
+ATOM   1685  N   LEU A 231      23.238  18.160  20.429  1.00 27.99           N  
+ATOM   1686  CA  LEU A 231      24.180  18.116  19.314  1.00 29.41           C  
+ATOM   1687  C   LEU A 231      23.545  18.339  17.951  1.00 30.13           C  
+ATOM   1688  O   LEU A 231      24.234  18.355  16.937  1.00 31.02           O  
+ATOM   1689  CB  LEU A 231      24.965  16.803  19.320  1.00 27.66           C  
+ATOM   1690  CG  LEU A 231      25.973  16.687  20.468  1.00 29.07           C  
+ATOM   1691  CD1 LEU A 231      26.834  15.448  20.273  1.00 26.71           C  
+ATOM   1692  CD2 LEU A 231      26.846  17.930  20.515  1.00 27.36           C  
+ATOM   1693  N   ALA A 232      22.231  18.500  17.917  1.00 31.18           N  
+ATOM   1694  CA  ALA A 232      21.561  18.765  16.652  1.00 34.39           C  
+ATOM   1695  C   ALA A 232      21.284  20.261  16.678  1.00 36.88           C  
+ATOM   1696  O   ALA A 232      20.131  20.694  16.609  1.00 38.71           O  
+ATOM   1697  CB  ALA A 232      20.262  17.982  16.564  1.00 35.16           C  
+ATOM   1698  N   VAL A 233      22.353  21.047  16.782  1.00 37.93           N  
+ATOM   1699  CA  VAL A 233      22.234  22.500  16.868  1.00 38.70           C  
+ATOM   1700  C   VAL A 233      23.031  23.310  15.845  1.00 39.68           C  
+ATOM   1701  O   VAL A 233      23.089  24.532  15.944  1.00 40.32           O  
+ATOM   1702  CB  VAL A 233      22.637  22.985  18.274  1.00 37.44           C  
+ATOM   1703  CG1 VAL A 233      21.642  22.483  19.305  1.00 37.13           C  
+ATOM   1704  CG2 VAL A 233      24.031  22.482  18.610  1.00 37.93           C  
+ATOM   1705  N   GLY A 234      23.643  22.638  14.876  1.00 40.65           N  
+ATOM   1706  CA  GLY A 234      24.408  23.342  13.861  1.00 41.69           C  
+ATOM   1707  C   GLY A 234      25.828  23.684  14.276  1.00 42.42           C  
+ATOM   1708  O   GLY A 234      26.290  24.812  14.086  1.00 43.81           O  
+ATOM   1709  N   GLU A 235      26.529  22.709  14.840  1.00 41.71           N  
+ATOM   1710  CA  GLU A 235      27.901  22.918  15.276  1.00 40.97           C  
+ATOM   1711  C   GLU A 235      28.869  22.396  14.221  1.00 41.16           C  
+ATOM   1712  O   GLU A 235      30.071  22.673  14.274  1.00 42.20           O  
+ATOM   1713  CB  GLU A 235      28.158  22.184  16.593  1.00 40.59           C  
+ATOM   1714  CG  GLU A 235      28.084  20.670  16.468  1.00 39.12           C  
+ATOM   1715  CD  GLU A 235      26.680  20.122  16.656  1.00 38.41           C  
+ATOM   1716  OE1 GLU A 235      25.702  20.815  16.301  1.00 37.32           O  
+ATOM   1717  OE2 GLU A 235      26.561  18.983  17.150  1.00 36.06           O  
+ATOM   1718  N   GLY A 236      28.335  21.641  13.264  1.00 39.35           N  
+ATOM   1719  CA  GLY A 236      29.166  21.069  12.220  1.00 36.31           C  
+ATOM   1720  C   GLY A 236      29.503  19.633  12.576  1.00 33.66           C  
+ATOM   1721  O   GLY A 236      29.664  19.304  13.752  1.00 33.23           O  
+ATOM   1722  N   GLN A 237      29.615  18.774  11.569  1.00 32.31           N  
+ATOM   1723  CA  GLN A 237      29.925  17.371  11.814  1.00 30.85           C  
+ATOM   1724  C   GLN A 237      31.227  17.167  12.566  1.00 30.60           C  
+ATOM   1725  O   GLN A 237      31.305  16.327  13.463  1.00 29.93           O  
+ATOM   1726  CB  GLN A 237      29.977  16.591  10.501  1.00 30.53           C  
+ATOM   1727  CG  GLN A 237      30.479  15.172  10.689  1.00 30.41           C  
+ATOM   1728  CD  GLN A 237      30.571  14.405   9.392  1.00 29.00           C  
+ATOM   1729  OE1 GLN A 237      29.556  14.037   8.802  1.00 29.40           O  
+ATOM   1730  NE2 GLN A 237      31.792  14.166   8.935  1.00 27.66           N  
+ATOM   1731  N   ASP A 238      32.253  17.929  12.202  1.00 31.01           N  
+ATOM   1732  CA  ASP A 238      33.544  17.801  12.861  1.00 31.82           C  
+ATOM   1733  C   ASP A 238      33.410  18.034  14.358  1.00 30.92           C  
+ATOM   1734  O   ASP A 238      33.903  17.247  15.167  1.00 29.36           O  
+ATOM   1735  CB  ASP A 238      34.552  18.791  12.270  1.00 34.94           C  
+ATOM   1736  CG  ASP A 238      34.811  18.547  10.797  1.00 39.42           C  
+ATOM   1737  OD1 ASP A 238      34.942  17.368  10.401  1.00 39.66           O  
+ATOM   1738  OD2 ASP A 238      34.896  19.533  10.036  1.00 42.93           O  
+ATOM   1739  N   GLU A 239      32.737  19.121  14.720  1.00 31.67           N  
+ATOM   1740  CA  GLU A 239      32.534  19.466  16.123  1.00 31.29           C  
+ATOM   1741  C   GLU A 239      31.679  18.402  16.811  1.00 29.09           C  
+ATOM   1742  O   GLU A 239      31.993  17.949  17.915  1.00 27.73           O  
+ATOM   1743  CB  GLU A 239      31.855  20.836  16.224  1.00 34.49           C  
+ATOM   1744  CG  GLU A 239      31.680  21.364  17.642  1.00 37.34           C  
+ATOM   1745  CD  GLU A 239      32.998  21.630  18.337  1.00 40.95           C  
+ATOM   1746  OE1 GLU A 239      32.966  22.111  19.491  1.00 43.48           O  
+ATOM   1747  OE2 GLU A 239      34.064  21.363  17.739  1.00 40.94           O  
+ATOM   1748  N   MET A 240      30.596  18.004  16.152  1.00 26.82           N  
+ATOM   1749  CA  MET A 240      29.708  16.988  16.711  1.00 26.65           C  
+ATOM   1750  C   MET A 240      30.497  15.713  16.986  1.00 25.95           C  
+ATOM   1751  O   MET A 240      30.423  15.146  18.079  1.00 25.37           O  
+ATOM   1752  CB  MET A 240      28.559  16.684  15.743  1.00 26.36           C  
+ATOM   1753  CG  MET A 240      27.587  15.629  16.262  1.00 27.82           C  
+ATOM   1754  SD  MET A 240      26.316  15.195  15.067  1.00 30.72           S  
+ATOM   1755  CE  MET A 240      27.171  13.988  14.082  1.00 24.83           C  
+ATOM   1756  N   PHE A 241      31.258  15.268  15.990  1.00 25.49           N  
+ATOM   1757  CA  PHE A 241      32.066  14.066  16.134  1.00 25.12           C  
+ATOM   1758  C   PHE A 241      33.033  14.219  17.295  1.00 24.99           C  
+ATOM   1759  O   PHE A 241      33.212  13.295  18.089  1.00 25.44           O  
+ATOM   1760  CB  PHE A 241      32.838  13.787  14.840  1.00 23.82           C  
+ATOM   1761  CG  PHE A 241      32.013  13.130  13.763  1.00 22.90           C  
+ATOM   1762  CD1 PHE A 241      30.658  12.883  13.953  1.00 22.46           C  
+ATOM   1763  CD2 PHE A 241      32.599  12.751  12.559  1.00 20.57           C  
+ATOM   1764  CE1 PHE A 241      29.901  12.267  12.963  1.00 23.55           C  
+ATOM   1765  CE2 PHE A 241      31.852  12.138  11.563  1.00 22.80           C  
+ATOM   1766  CZ  PHE A 241      30.498  11.893  11.765  1.00 21.49           C  
+ATOM   1767  N   ARG A 242      33.652  15.392  17.397  1.00 25.97           N  
+ATOM   1768  CA  ARG A 242      34.601  15.662  18.477  1.00 26.64           C  
+ATOM   1769  C   ARG A 242      33.925  15.441  19.829  1.00 25.19           C  
+ATOM   1770  O   ARG A 242      34.458  14.742  20.686  1.00 25.70           O  
+ATOM   1771  CB  ARG A 242      35.120  17.104  18.389  1.00 29.30           C  
+ATOM   1772  CG  ARG A 242      36.261  17.421  19.354  1.00 32.86           C  
+ATOM   1773  CD  ARG A 242      36.782  18.849  19.168  1.00 36.58           C  
+ATOM   1774  NE  ARG A 242      35.843  19.869  19.640  1.00 39.40           N  
+ATOM   1775  CZ  ARG A 242      35.621  20.148  20.923  1.00 38.94           C  
+ATOM   1776  NH1 ARG A 242      36.271  19.484  21.868  1.00 40.69           N  
+ATOM   1777  NH2 ARG A 242      34.753  21.094  21.264  1.00 39.91           N  
+ATOM   1778  N   VAL A 243      32.741  16.023  20.010  1.00 24.31           N  
+ATOM   1779  CA  VAL A 243      32.010  15.876  21.267  1.00 24.02           C  
+ATOM   1780  C   VAL A 243      31.611  14.423  21.515  1.00 23.63           C  
+ATOM   1781  O   VAL A 243      31.716  13.924  22.639  1.00 23.98           O  
+ATOM   1782  CB  VAL A 243      30.749  16.770  21.282  1.00 24.25           C  
+ATOM   1783  CG1 VAL A 243      29.993  16.596  22.597  1.00 24.54           C  
+ATOM   1784  CG2 VAL A 243      31.158  18.225  21.099  1.00 24.07           C  
+ATOM   1785  N   LEU A 244      31.157  13.740  20.468  1.00 23.74           N  
+ATOM   1786  CA  LEU A 244      30.766  12.341  20.602  1.00 22.57           C  
+ATOM   1787  C   LEU A 244      31.959  11.490  21.028  1.00 21.92           C  
+ATOM   1788  O   LEU A 244      31.815  10.563  21.819  1.00 23.17           O  
+ATOM   1789  CB  LEU A 244      30.203  11.807  19.280  1.00 21.10           C  
+ATOM   1790  CG  LEU A 244      28.787  12.227  18.865  1.00 20.79           C  
+ATOM   1791  CD1 LEU A 244      28.438  11.554  17.540  1.00 19.97           C  
+ATOM   1792  CD2 LEU A 244      27.781  11.817  19.939  1.00 19.03           C  
+ATOM   1793  N   ASP A 245      33.141  11.812  20.508  1.00 22.99           N  
+ATOM   1794  CA  ASP A 245      34.338  11.052  20.847  1.00 23.23           C  
+ATOM   1795  C   ASP A 245      34.518  10.874  22.350  1.00 23.44           C  
+ATOM   1796  O   ASP A 245      34.751   9.761  22.812  1.00 20.88           O  
+ATOM   1797  CB  ASP A 245      35.589  11.704  20.249  1.00 23.73           C  
+ATOM   1798  CG  ASP A 245      35.644  11.576  18.741  1.00 24.99           C  
+ATOM   1799  OD1 ASP A 245      35.274  10.497  18.228  1.00 24.90           O  
+ATOM   1800  OD2 ASP A 245      36.063  12.543  18.070  1.00 25.39           O  
+ATOM   1801  N   PHE A 246      34.399  11.960  23.114  1.00 24.26           N  
+ATOM   1802  CA  PHE A 246      34.568  11.866  24.561  1.00 24.21           C  
+ATOM   1803  C   PHE A 246      33.265  11.751  25.346  1.00 23.80           C  
+ATOM   1804  O   PHE A 246      33.276  11.375  26.514  1.00 26.23           O  
+ATOM   1805  CB  PHE A 246      35.389  13.058  25.090  1.00 23.82           C  
+ATOM   1806  CG  PHE A 246      34.741  14.405  24.876  1.00 23.32           C  
+ATOM   1807  CD1 PHE A 246      33.532  14.723  25.486  1.00 23.56           C  
+ATOM   1808  CD2 PHE A 246      35.355  15.363  24.079  1.00 22.41           C  
+ATOM   1809  CE1 PHE A 246      32.949  15.970  25.305  1.00 23.03           C  
+ATOM   1810  CE2 PHE A 246      34.780  16.617  23.890  1.00 21.89           C  
+ATOM   1811  CZ  PHE A 246      33.576  16.921  24.504  1.00 22.61           C  
+ATOM   1812  N   SER A 247      32.140  12.058  24.713  1.00 24.44           N  
+ATOM   1813  CA  SER A 247      30.858  11.993  25.412  1.00 23.34           C  
+ATOM   1814  C   SER A 247      30.235  10.607  25.521  1.00 22.56           C  
+ATOM   1815  O   SER A 247      29.802  10.206  26.601  1.00 21.17           O  
+ATOM   1816  CB  SER A 247      29.853  12.942  24.760  1.00 22.62           C  
+ATOM   1817  OG  SER A 247      30.241  14.290  24.942  1.00 25.49           O  
+ATOM   1818  N   VAL A 248      30.193   9.870  24.414  1.00 21.82           N  
+ATOM   1819  CA  VAL A 248      29.575   8.548  24.429  1.00 19.75           C  
+ATOM   1820  C   VAL A 248      30.215   7.575  25.415  1.00 21.13           C  
+ATOM   1821  O   VAL A 248      29.515   6.797  26.075  1.00 21.48           O  
+ATOM   1822  CB  VAL A 248      29.561   7.923  23.012  1.00 20.76           C  
+ATOM   1823  CG1 VAL A 248      28.774   6.623  23.032  1.00 19.48           C  
+ATOM   1824  CG2 VAL A 248      28.933   8.905  22.017  1.00 17.87           C  
+ATOM   1825  N   PRO A 249      31.554   7.588  25.527  1.00 20.66           N  
+ATOM   1826  CA  PRO A 249      32.205   6.673  26.467  1.00 21.07           C  
+ATOM   1827  C   PRO A 249      31.790   6.936  27.920  1.00 20.09           C  
+ATOM   1828  O   PRO A 249      31.908   6.064  28.775  1.00 19.05           O  
+ATOM   1829  CB  PRO A 249      33.691   6.944  26.237  1.00 21.69           C  
+ATOM   1830  CG  PRO A 249      33.740   7.322  24.789  1.00 22.63           C  
+ATOM   1831  CD  PRO A 249      32.551   8.246  24.663  1.00 20.44           C  
+ATOM   1832  N   MET A 250      31.298   8.137  28.193  1.00 21.94           N  
+ATOM   1833  CA  MET A 250      30.878   8.493  29.547  1.00 23.15           C  
+ATOM   1834  C   MET A 250      29.591   7.781  29.963  1.00 24.11           C  
+ATOM   1835  O   MET A 250      29.367   7.519  31.147  1.00 22.72           O  
+ATOM   1836  CB  MET A 250      30.662  10.001  29.644  1.00 24.74           C  
+ATOM   1837  CG  MET A 250      31.874  10.830  29.290  1.00 26.09           C  
+ATOM   1838  SD  MET A 250      31.509  12.591  29.363  1.00 30.53           S  
+ATOM   1839  CE  MET A 250      33.139  13.283  29.021  1.00 27.59           C  
+ATOM   1840  N   LEU A 251      28.750   7.469  28.981  1.00 22.87           N  
+ATOM   1841  CA  LEU A 251      27.477   6.811  29.242  1.00 22.41           C  
+ATOM   1842  C   LEU A 251      27.654   5.333  29.544  1.00 20.63           C  
+ATOM   1843  O   LEU A 251      28.612   4.709  29.098  1.00 21.88           O  
+ATOM   1844  CB  LEU A 251      26.555   6.968  28.030  1.00 22.62           C  
+ATOM   1845  CG  LEU A 251      26.399   8.382  27.474  1.00 22.67           C  
+ATOM   1846  CD1 LEU A 251      25.655   8.329  26.145  1.00 25.49           C  
+ATOM   1847  CD2 LEU A 251      25.663   9.245  28.474  1.00 24.14           C  
+ATOM   1848  N   PRO A 252      26.727   4.751  30.316  1.00 21.37           N  
+ATOM   1849  CA  PRO A 252      26.820   3.328  30.648  1.00 21.15           C  
+ATOM   1850  C   PRO A 252      26.874   2.502  29.365  1.00 22.85           C  
+ATOM   1851  O   PRO A 252      26.070   2.699  28.458  1.00 20.81           O  
+ATOM   1852  CB  PRO A 252      25.554   3.088  31.451  1.00 20.88           C  
+ATOM   1853  CG  PRO A 252      25.408   4.390  32.194  1.00 21.65           C  
+ATOM   1854  CD  PRO A 252      25.679   5.413  31.114  1.00 19.71           C  
+ATOM   1855  N   ASP A 253      27.826   1.580  29.299  1.00 22.22           N  
+ATOM   1856  CA  ASP A 253      28.009   0.749  28.116  1.00 23.84           C  
+ATOM   1857  C   ASP A 253      26.908  -0.284  27.841  1.00 24.33           C  
+ATOM   1858  O   ASP A 253      26.622  -0.586  26.680  1.00 24.77           O  
+ATOM   1859  CB  ASP A 253      29.375   0.059  28.195  1.00 21.86           C  
+ATOM   1860  CG  ASP A 253      29.717  -0.705  26.934  1.00 23.85           C  
+ATOM   1861  OD1 ASP A 253      29.415  -1.912  26.872  1.00 24.98           O  
+ATOM   1862  OD2 ASP A 253      30.278  -0.096  25.998  1.00 25.39           O  
+ATOM   1863  N   ASP A 254      26.285  -0.812  28.895  1.00 23.28           N  
+ATOM   1864  CA  ASP A 254      25.242  -1.826  28.734  1.00 23.21           C  
+ATOM   1865  C   ASP A 254      23.834  -1.289  28.434  1.00 22.09           C  
+ATOM   1866  O   ASP A 254      22.852  -2.026  28.544  1.00 20.50           O  
+ATOM   1867  CB  ASP A 254      25.171  -2.722  29.980  1.00 23.34           C  
+ATOM   1868  CG  ASP A 254      24.747  -1.960  31.225  1.00 24.24           C  
+ATOM   1869  OD1 ASP A 254      24.434  -2.607  32.249  1.00 24.50           O  
+ATOM   1870  OD2 ASP A 254      24.734  -0.713  31.181  1.00 20.91           O  
+ATOM   1871  N   LYS A 255      23.733  -0.015  28.068  1.00 19.92           N  
+ATOM   1872  CA  LYS A 255      22.438   0.582  27.746  1.00 19.29           C  
+ATOM   1873  C   LYS A 255      22.521   1.304  26.403  1.00 18.05           C  
+ATOM   1874  O   LYS A 255      23.599   1.742  25.985  1.00 18.95           O  
+ATOM   1875  CB  LYS A 255      22.019   1.587  28.826  1.00 21.41           C  
+ATOM   1876  CG  LYS A 255      22.023   1.053  30.260  1.00 22.74           C  
+ATOM   1877  CD  LYS A 255      20.990  -0.036  30.466  1.00 22.81           C  
+ATOM   1878  CE  LYS A 255      20.945  -0.483  31.923  1.00 24.01           C  
+ATOM   1879  NZ  LYS A 255      19.971  -1.592  32.119  1.00 27.38           N  
+ATOM   1880  N   PRO A 256      21.382   1.441  25.707  1.00 16.07           N  
+ATOM   1881  CA  PRO A 256      21.364   2.122  24.411  1.00 15.53           C  
+ATOM   1882  C   PRO A 256      21.861   3.567  24.495  1.00 16.56           C  
+ATOM   1883  O   PRO A 256      21.688   4.238  25.518  1.00 16.20           O  
+ATOM   1884  CB  PRO A 256      19.888   2.053  24.011  1.00 14.30           C  
+ATOM   1885  CG  PRO A 256      19.421   0.788  24.655  1.00 13.87           C  
+ATOM   1886  CD  PRO A 256      20.056   0.877  26.017  1.00 13.25           C  
+ATOM   1887  N   HIS A 257      22.476   4.026  23.407  1.00 16.12           N  
+ATOM   1888  CA  HIS A 257      22.982   5.390  23.283  1.00 15.55           C  
+ATOM   1889  C   HIS A 257      22.224   5.988  22.108  1.00 15.25           C  
+ATOM   1890  O   HIS A 257      22.371   5.548  20.966  1.00 14.77           O  
+ATOM   1891  CB  HIS A 257      24.481   5.398  22.982  1.00 16.11           C  
+ATOM   1892  CG  HIS A 257      25.295   4.611  23.960  1.00 18.18           C  
+ATOM   1893  ND1 HIS A 257      24.921   4.447  25.277  1.00 20.29           N  
+ATOM   1894  CD2 HIS A 257      26.476   3.966  23.822  1.00 17.00           C  
+ATOM   1895  CE1 HIS A 257      25.838   3.735  25.906  1.00 18.54           C  
+ATOM   1896  NE2 HIS A 257      26.792   3.431  25.046  1.00 18.87           N  
+ATOM   1897  N   TYR A 258      21.420   6.998  22.395  1.00 14.69           N  
+ATOM   1898  CA  TYR A 258      20.584   7.629  21.388  1.00 14.83           C  
+ATOM   1899  C   TYR A 258      20.989   9.061  21.037  1.00 14.40           C  
+ATOM   1900  O   TYR A 258      20.922   9.963  21.874  1.00 13.73           O  
+ATOM   1901  CB  TYR A 258      19.128   7.539  21.892  1.00 15.23           C  
+ATOM   1902  CG  TYR A 258      18.075   8.400  21.216  1.00 15.08           C  
+ATOM   1903  CD1 TYR A 258      18.170   8.752  19.872  1.00 14.18           C  
+ATOM   1904  CD2 TYR A 258      16.952   8.829  21.933  1.00 14.05           C  
+ATOM   1905  CE1 TYR A 258      17.169   9.517  19.253  1.00 15.88           C  
+ATOM   1906  CE2 TYR A 258      15.949   9.587  21.331  1.00 14.87           C  
+ATOM   1907  CZ  TYR A 258      16.064   9.927  19.994  1.00 14.76           C  
+ATOM   1908  OH  TYR A 258      15.085  10.686  19.406  1.00 14.06           O  
+ATOM   1909  N   LEU A 259      21.426   9.261  19.794  1.00 14.60           N  
+ATOM   1910  CA  LEU A 259      21.816  10.595  19.331  1.00 15.08           C  
+ATOM   1911  C   LEU A 259      20.584  11.274  18.733  1.00 17.67           C  
+ATOM   1912  O   LEU A 259      20.144  10.944  17.627  1.00 17.85           O  
+ATOM   1913  CB  LEU A 259      22.924  10.502  18.286  1.00 15.53           C  
+ATOM   1914  CG  LEU A 259      23.421  11.852  17.758  1.00 15.63           C  
+ATOM   1915  CD1 LEU A 259      23.829  12.746  18.929  1.00 14.48           C  
+ATOM   1916  CD2 LEU A 259      24.589  11.631  16.796  1.00 15.58           C  
+ATOM   1917  N   MET A 260      20.030  12.223  19.477  1.00 17.81           N  
+ATOM   1918  CA  MET A 260      18.821  12.918  19.060  1.00 20.33           C  
+ATOM   1919  C   MET A 260      18.976  13.909  17.906  1.00 20.09           C  
+ATOM   1920  O   MET A 260      19.919  14.697  17.866  1.00 20.48           O  
+ATOM   1921  CB  MET A 260      18.197  13.633  20.271  1.00 22.09           C  
+ATOM   1922  CG  MET A 260      17.815  12.703  21.429  1.00 24.68           C  
+ATOM   1923  SD  MET A 260      17.047  13.539  22.857  1.00 24.54           S  
+ATOM   1924  CE  MET A 260      15.337  13.337  22.490  1.00 21.65           C  
+ATOM   1925  N   GLY A 261      18.037  13.843  16.967  1.00 19.26           N  
+ATOM   1926  CA  GLY A 261      18.027  14.760  15.840  1.00 22.93           C  
+ATOM   1927  C   GLY A 261      19.146  14.671  14.822  1.00 24.09           C  
+ATOM   1928  O   GLY A 261      19.352  15.607  14.055  1.00 25.37           O  
+ATOM   1929  N   VAL A 262      19.874  13.562  14.804  1.00 23.94           N  
+ATOM   1930  CA  VAL A 262      20.949  13.404  13.840  1.00 23.88           C  
+ATOM   1931  C   VAL A 262      20.532  12.369  12.815  1.00 24.97           C  
+ATOM   1932  O   VAL A 262      20.238  11.220  13.159  1.00 23.71           O  
+ATOM   1933  CB  VAL A 262      22.237  12.968  14.513  1.00 24.12           C  
+ATOM   1934  CG1 VAL A 262      23.291  12.691  13.460  1.00 23.55           C  
+ATOM   1935  CG2 VAL A 262      22.697  14.057  15.461  1.00 23.67           C  
+ATOM   1936  N   GLY A 263      20.511  12.781  11.551  1.00 25.41           N  
+ATOM   1937  CA  GLY A 263      20.073  11.874  10.516  1.00 25.64           C  
+ATOM   1938  C   GLY A 263      20.803  11.804   9.195  1.00 24.43           C  
+ATOM   1939  O   GLY A 263      20.529  10.881   8.443  1.00 26.99           O  
+ATOM   1940  N   LYS A 264      21.699  12.735   8.873  1.00 23.03           N  
+ATOM   1941  CA  LYS A 264      22.400  12.622   7.590  1.00 22.90           C  
+ATOM   1942  C   LYS A 264      23.124  11.272   7.586  1.00 21.81           C  
+ATOM   1943  O   LYS A 264      23.704  10.879   8.595  1.00 19.27           O  
+ATOM   1944  CB  LYS A 264      23.409  13.759   7.403  1.00 27.95           C  
+ATOM   1945  CG  LYS A 264      22.798  15.092   6.953  1.00 30.23           C  
+ATOM   1946  CD  LYS A 264      23.889  16.124   6.643  1.00 35.03           C  
+ATOM   1947  CE  LYS A 264      24.686  16.492   7.893  1.00 37.54           C  
+ATOM   1948  NZ  LYS A 264      25.956  17.216   7.588  1.00 39.07           N  
+ATOM   1949  N   PRO A 265      23.097  10.545   6.453  1.00 21.08           N  
+ATOM   1950  CA  PRO A 265      23.761   9.240   6.374  1.00 20.97           C  
+ATOM   1951  C   PRO A 265      25.191   9.205   6.899  1.00 21.38           C  
+ATOM   1952  O   PRO A 265      25.530   8.338   7.710  1.00 19.43           O  
+ATOM   1953  CB  PRO A 265      23.665   8.894   4.890  1.00 21.08           C  
+ATOM   1954  CG  PRO A 265      22.343   9.483   4.515  1.00 20.84           C  
+ATOM   1955  CD  PRO A 265      22.418  10.857   5.182  1.00 21.37           C  
+ATOM   1956  N   ASP A 266      26.026  10.143   6.455  1.00 22.22           N  
+ATOM   1957  CA  ASP A 266      27.414  10.174   6.909  1.00 22.44           C  
+ATOM   1958  C   ASP A 266      27.495  10.439   8.403  1.00 20.90           C  
+ATOM   1959  O   ASP A 266      28.424   9.987   9.062  1.00 20.20           O  
+ATOM   1960  CB  ASP A 266      28.229  11.247   6.180  1.00 27.25           C  
+ATOM   1961  CG  ASP A 266      29.693  11.259   6.616  1.00 32.02           C  
+ATOM   1962  OD1 ASP A 266      30.355  12.315   6.485  1.00 34.12           O  
+ATOM   1963  OD2 ASP A 266      30.188  10.205   7.085  1.00 34.82           O  
+ATOM   1964  N   ASP A 267      26.536  11.192   8.935  1.00 20.62           N  
+ATOM   1965  CA  ASP A 267      26.529  11.478  10.366  1.00 20.89           C  
+ATOM   1966  C   ASP A 267      26.234  10.182  11.125  1.00 19.07           C  
+ATOM   1967  O   ASP A 267      26.890   9.865  12.123  1.00 16.04           O  
+ATOM   1968  CB  ASP A 267      25.462  12.528  10.700  1.00 23.58           C  
+ATOM   1969  CG  ASP A 267      25.869  13.934  10.285  1.00 27.68           C  
+ATOM   1970  OD1 ASP A 267      25.005  14.831  10.326  1.00 31.48           O  
+ATOM   1971  OD2 ASP A 267      27.048  14.149   9.928  1.00 27.44           O  
+ATOM   1972  N   ILE A 268      25.244   9.440  10.636  1.00 17.78           N  
+ATOM   1973  CA  ILE A 268      24.846   8.177  11.250  1.00 16.13           C  
+ATOM   1974  C   ILE A 268      26.024   7.211  11.288  1.00 15.28           C  
+ATOM   1975  O   ILE A 268      26.330   6.645  12.331  1.00 15.53           O  
+ATOM   1976  CB  ILE A 268      23.662   7.517  10.480  1.00 15.94           C  
+ATOM   1977  CG1 ILE A 268      22.331   8.164  10.886  1.00 19.59           C  
+ATOM   1978  CG2 ILE A 268      23.559   6.038  10.832  1.00 11.01           C  
+ATOM   1979  CD1 ILE A 268      22.353   9.655  10.945  1.00 23.68           C  
+ATOM   1980  N   VAL A 269      26.689   7.022  10.153  1.00 14.99           N  
+ATOM   1981  CA  VAL A 269      27.828   6.112  10.115  1.00 14.77           C  
+ATOM   1982  C   VAL A 269      28.903   6.534  11.114  1.00 15.83           C  
+ATOM   1983  O   VAL A 269      29.401   5.714  11.885  1.00 15.20           O  
+ATOM   1984  CB  VAL A 269      28.450   6.047   8.708  1.00 14.59           C  
+ATOM   1985  CG1 VAL A 269      29.722   5.209   8.746  1.00 13.72           C  
+ATOM   1986  CG2 VAL A 269      27.442   5.449   7.723  1.00 13.91           C  
+ATOM   1987  N   GLY A 270      29.258   7.816  11.095  1.00 15.60           N  
+ATOM   1988  CA  GLY A 270      30.274   8.308  12.010  1.00 16.53           C  
+ATOM   1989  C   GLY A 270      29.845   8.208  13.464  1.00 16.64           C  
+ATOM   1990  O   GLY A 270      30.671   7.997  14.357  1.00 16.08           O  
+ATOM   1991  N   ALA A 271      28.546   8.358  13.706  1.00 16.64           N  
+ATOM   1992  CA  ALA A 271      28.008   8.281  15.058  1.00 15.54           C  
+ATOM   1993  C   ALA A 271      28.052   6.843  15.573  1.00 16.54           C  
+ATOM   1994  O   ALA A 271      28.351   6.608  16.748  1.00 17.11           O  
+ATOM   1995  CB  ALA A 271      26.580   8.811  15.080  1.00 13.96           C  
+ATOM   1996  N   VAL A 272      27.748   5.881  14.703  1.00 14.39           N  
+ATOM   1997  CA  VAL A 272      27.787   4.475  15.099  1.00 13.61           C  
+ATOM   1998  C   VAL A 272      29.246   4.102  15.404  1.00 13.93           C  
+ATOM   1999  O   VAL A 272      29.526   3.330  16.319  1.00 13.09           O  
+ATOM   2000  CB  VAL A 272      27.237   3.557  13.972  1.00 13.19           C  
+ATOM   2001  CG1 VAL A 272      27.510   2.098  14.297  1.00 10.01           C  
+ATOM   2002  CG2 VAL A 272      25.729   3.782  13.804  1.00 10.23           C  
+ATOM   2003  N   GLU A 273      30.172   4.661  14.633  1.00 14.25           N  
+ATOM   2004  CA  GLU A 273      31.592   4.397  14.843  1.00 17.35           C  
+ATOM   2005  C   GLU A 273      31.999   4.894  16.226  1.00 17.76           C  
+ATOM   2006  O   GLU A 273      33.001   4.451  16.792  1.00 18.40           O  
+ATOM   2007  CB  GLU A 273      32.440   5.124  13.793  1.00 19.07           C  
+ATOM   2008  CG  GLU A 273      32.323   4.582  12.386  1.00 21.12           C  
+ATOM   2009  CD  GLU A 273      33.125   5.410  11.399  1.00 25.66           C  
+ATOM   2010  OE1 GLU A 273      32.816   6.608  11.242  1.00 27.61           O  
+ATOM   2011  OE2 GLU A 273      34.067   4.871  10.787  1.00 28.15           O  
+ATOM   2012  N   ARG A 274      31.210   5.816  16.766  1.00 17.43           N  
+ATOM   2013  CA  ARG A 274      31.496   6.388  18.067  1.00 15.82           C  
+ATOM   2014  C   ARG A 274      30.613   5.855  19.196  1.00 17.50           C  
+ATOM   2015  O   ARG A 274      30.617   6.401  20.302  1.00 18.27           O  
+ATOM   2016  CB  ARG A 274      31.418   7.915  17.966  1.00 17.24           C  
+ATOM   2017  CG  ARG A 274      32.490   8.481  17.028  1.00 16.76           C  
+ATOM   2018  CD  ARG A 274      32.298   9.955  16.699  1.00 18.99           C  
+ATOM   2019  NE  ARG A 274      33.443  10.486  15.954  1.00 20.23           N  
+ATOM   2020  CZ  ARG A 274      33.774  10.132  14.714  1.00 21.67           C  
+ATOM   2021  NH1 ARG A 274      33.046   9.241  14.049  1.00 20.93           N  
+ATOM   2022  NH2 ARG A 274      34.846  10.658  14.139  1.00 22.04           N  
+ATOM   2023  N   GLY A 275      29.862   4.787  18.923  1.00 15.47           N  
+ATOM   2024  CA  GLY A 275      29.030   4.188  19.959  1.00 14.83           C  
+ATOM   2025  C   GLY A 275      27.530   4.464  20.028  1.00 15.42           C  
+ATOM   2026  O   GLY A 275      26.877   4.018  20.965  1.00 15.11           O  
+ATOM   2027  N   ILE A 276      26.971   5.181  19.060  1.00 14.92           N  
+ATOM   2028  CA  ILE A 276      25.541   5.469  19.078  1.00 14.63           C  
+ATOM   2029  C   ILE A 276      24.732   4.288  18.537  1.00 15.78           C  
+ATOM   2030  O   ILE A 276      25.120   3.660  17.549  1.00 14.54           O  
+ATOM   2031  CB  ILE A 276      25.215   6.732  18.250  1.00 14.60           C  
+ATOM   2032  CG1 ILE A 276      25.814   7.974  18.922  1.00 14.75           C  
+ATOM   2033  CG2 ILE A 276      23.702   6.914  18.152  1.00 10.97           C  
+ATOM   2034  CD1 ILE A 276      27.311   7.984  19.013  1.00 23.22           C  
+ATOM   2035  N   ASP A 277      23.603   4.002  19.183  1.00 13.75           N  
+ATOM   2036  CA  ASP A 277      22.742   2.888  18.798  1.00 15.58           C  
+ATOM   2037  C   ASP A 277      21.402   3.303  18.188  1.00 16.89           C  
+ATOM   2038  O   ASP A 277      20.754   2.507  17.509  1.00 16.79           O  
+ATOM   2039  CB  ASP A 277      22.449   2.012  20.024  1.00 15.58           C  
+ATOM   2040  CG  ASP A 277      23.703   1.648  20.799  1.00 17.78           C  
+ATOM   2041  OD1 ASP A 277      24.573   0.955  20.233  1.00 14.88           O  
+ATOM   2042  OD2 ASP A 277      23.813   2.058  21.977  1.00 14.16           O  
+ATOM   2043  N   MET A 278      20.976   4.538  18.435  1.00 15.83           N  
+ATOM   2044  CA  MET A 278      19.687   4.990  17.927  1.00 15.20           C  
+ATOM   2045  C   MET A 278      19.713   6.365  17.281  1.00 16.49           C  
+ATOM   2046  O   MET A 278      20.411   7.268  17.743  1.00 16.28           O  
+ATOM   2047  CB  MET A 278      18.670   4.975  19.063  1.00 13.31           C  
+ATOM   2048  CG  MET A 278      18.433   3.591  19.638  1.00 14.62           C  
+ATOM   2049  SD  MET A 278      17.536   3.631  21.196  1.00 16.01           S  
+ATOM   2050  CE  MET A 278      15.917   4.193  20.671  1.00 17.63           C  
+ATOM   2051  N   PHE A 279      18.933   6.509  16.211  1.00 16.18           N  
+ATOM   2052  CA  PHE A 279      18.844   7.759  15.470  1.00 17.60           C  
+ATOM   2053  C   PHE A 279      17.417   8.112  15.080  1.00 20.44           C  
+ATOM   2054  O   PHE A 279      16.535   7.253  15.040  1.00 18.19           O  
+ATOM   2055  CB  PHE A 279      19.664   7.679  14.185  1.00 16.19           C  
+ATOM   2056  CG  PHE A 279      21.106   7.374  14.406  1.00 15.25           C  
+ATOM   2057  CD1 PHE A 279      21.531   6.061  14.607  1.00 14.68           C  
+ATOM   2058  CD2 PHE A 279      22.048   8.400  14.421  1.00 12.89           C  
+ATOM   2059  CE1 PHE A 279      22.879   5.778  14.821  1.00 14.87           C  
+ATOM   2060  CE2 PHE A 279      23.394   8.128  14.633  1.00 14.48           C  
+ATOM   2061  CZ  PHE A 279      23.813   6.812  14.833  1.00 14.93           C  
+ATOM   2062  N   ASP A 280      17.204   9.388  14.784  1.00 23.97           N  
+ATOM   2063  CA  ASP A 280      15.901   9.872  14.356  1.00 29.55           C  
+ATOM   2064  C   ASP A 280      16.133  11.152  13.571  1.00 34.24           C  
+ATOM   2065  O   ASP A 280      17.086  11.883  13.843  1.00 35.45           O  
+ATOM   2066  CB  ASP A 280      15.003  10.188  15.555  1.00 27.74           C  
+ATOM   2067  CG  ASP A 280      15.334  11.528  16.194  1.00 27.05           C  
+ATOM   2068  OD1 ASP A 280      16.183  11.578  17.101  1.00 25.66           O  
+ATOM   2069  OD2 ASP A 280      14.752  12.543  15.771  1.00 29.21           O  
+ATOM   2070  N   CYS A 281      15.275  11.424  12.595  1.00 39.65           N  
+ATOM   2071  CA  CYS A 281      15.401  12.654  11.824  1.00 44.44           C  
+ATOM   2072  C   CYS A 281      14.274  12.806  10.824  1.00 46.24           C  
+ATOM   2073  O   CYS A 281      13.747  11.818  10.307  1.00 47.21           O  
+ATOM   2074  CB  CYS A 281      16.748  12.713  11.095  1.00 46.12           C  
+ATOM   2075  SG  CYS A 281      17.299  14.409  10.725  1.00 50.68           S  
+ATOM   2076  N   VAL A 282      13.902  14.055  10.567  1.00 49.63           N  
+ATOM   2077  CA  VAL A 282      12.835  14.367   9.623  1.00 53.50           C  
+ATOM   2078  C   VAL A 282      13.417  14.564   8.230  1.00 55.34           C  
+ATOM   2079  O   VAL A 282      12.682  14.670   7.249  1.00 56.02           O  
+ATOM   2080  CB  VAL A 282      12.083  15.646  10.037  1.00 53.32           C  
+ATOM   2081  CG1 VAL A 282      11.252  15.382  11.281  1.00 53.52           C  
+ATOM   2082  CG2 VAL A 282      13.079  16.759  10.305  1.00 54.43           C  
+ATOM   2083  N   LEU A 283      14.744  14.608   8.157  1.00 57.98           N  
+ATOM   2084  CA  LEU A 283      15.453  14.783   6.893  1.00 60.83           C  
+ATOM   2085  C   LEU A 283      14.850  13.874   5.809  1.00 62.59           C  
+ATOM   2086  O   LEU A 283      14.540  14.332   4.710  1.00 62.18           O  
+ATOM   2087  CB  LEU A 283      16.945  14.466   7.087  1.00 60.97           C  
+ATOM   2088  CG  LEU A 283      17.992  15.089   6.156  1.00 61.31           C  
+ATOM   2089  CD1 LEU A 283      19.360  14.516   6.492  1.00 60.09           C  
+ATOM   2090  CD2 LEU A 283      17.650  14.812   4.707  1.00 61.47           C  
+ATOM   2091  N   PRO A 284      14.671  12.574   6.112  1.00 64.33           N  
+ATOM   2092  CA  PRO A 284      14.101  11.627   5.146  1.00 65.61           C  
+ATOM   2093  C   PRO A 284      12.722  12.038   4.634  1.00 67.12           C  
+ATOM   2094  O   PRO A 284      12.458  11.994   3.430  1.00 67.15           O  
+ATOM   2095  CB  PRO A 284      14.044  10.323   5.937  1.00 65.81           C  
+ATOM   2096  CG  PRO A 284      15.197  10.447   6.871  1.00 65.66           C  
+ATOM   2097  CD  PRO A 284      15.075  11.872   7.344  1.00 64.92           C  
+ATOM   2098  N   THR A 285      11.846  12.427   5.558  1.00 68.99           N  
+ATOM   2099  CA  THR A 285      10.485  12.840   5.219  1.00 70.62           C  
+ATOM   2100  C   THR A 285      10.446  14.187   4.504  1.00 71.42           C  
+ATOM   2101  O   THR A 285       9.808  14.324   3.458  1.00 71.64           O  
+ATOM   2102  CB  THR A 285       9.593  12.932   6.479  1.00 70.68           C  
+ATOM   2103  OG1 THR A 285      10.170  13.857   7.409  1.00 71.03           O  
+ATOM   2104  CG2 THR A 285       9.453  11.566   7.137  1.00 70.00           C  
+ATOM   2105  N   ARG A 286      11.122  15.182   5.074  1.00 72.10           N  
+ATOM   2106  CA  ARG A 286      11.161  16.508   4.472  1.00 73.15           C  
+ATOM   2107  C   ARG A 286      11.804  16.441   3.088  1.00 73.01           C  
+ATOM   2108  O   ARG A 286      11.436  17.199   2.190  1.00 72.77           O  
+ATOM   2109  CB  ARG A 286      11.937  17.481   5.364  1.00 73.90           C  
+ATOM   2110  CG  ARG A 286      13.350  17.043   5.699  1.00 74.92           C  
+ATOM   2111  CD  ARG A 286      14.058  18.080   6.563  1.00 76.72           C  
+ATOM   2112  NE  ARG A 286      13.255  18.475   7.718  1.00 77.52           N  
+ATOM   2113  CZ  ARG A 286      13.652  19.339   8.647  1.00 77.95           C  
+ATOM   2114  NH1 ARG A 286      14.850  19.902   8.563  1.00 78.62           N  
+ATOM   2115  NH2 ARG A 286      12.849  19.646   9.657  1.00 78.03           N  
+ATOM   2116  N   SER A 287      12.759  15.528   2.923  1.00 72.71           N  
+ATOM   2117  CA  SER A 287      13.441  15.350   1.644  1.00 71.87           C  
+ATOM   2118  C   SER A 287      12.487  14.769   0.612  1.00 71.38           C  
+ATOM   2119  O   SER A 287      12.809  14.697  -0.574  1.00 71.04           O  
+ATOM   2120  CB  SER A 287      14.648  14.426   1.803  1.00 71.74           C  
+ATOM   2121  OG  SER A 287      15.642  15.033   2.605  1.00 71.87           O  
+ATOM   2122  N   GLY A 288      11.311  14.353   1.075  1.00 71.21           N  
+ATOM   2123  CA  GLY A 288      10.315  13.791   0.183  1.00 69.93           C  
+ATOM   2124  C   GLY A 288       9.610  14.868  -0.622  1.00 69.01           C  
+ATOM   2125  O   GLY A 288       9.244  14.651  -1.778  1.00 69.04           O  
+ATOM   2126  N   ARG A 289       9.416  16.033  -0.012  1.00 67.83           N  
+ATOM   2127  CA  ARG A 289       8.755  17.144  -0.690  1.00 66.45           C  
+ATOM   2128  C   ARG A 289       9.731  18.095  -1.373  1.00 63.19           C  
+ATOM   2129  O   ARG A 289       9.437  18.625  -2.446  1.00 63.35           O  
+ATOM   2130  CB  ARG A 289       7.894  17.942   0.292  1.00 69.13           C  
+ATOM   2131  CG  ARG A 289       6.461  17.460   0.417  1.00 71.17           C  
+ATOM   2132  CD  ARG A 289       5.559  18.632   0.759  1.00 73.55           C  
+ATOM   2133  NE  ARG A 289       5.670  19.683  -0.251  1.00 75.03           N  
+ATOM   2134  CZ  ARG A 289       5.082  20.872  -0.171  1.00 75.80           C  
+ATOM   2135  NH1 ARG A 289       4.331  21.179   0.879  1.00 76.12           N  
+ATOM   2136  NH2 ARG A 289       5.248  21.759  -1.143  1.00 76.09           N  
+ATOM   2137  N   ASN A 290      10.884  18.322  -0.750  1.00 59.31           N  
+ATOM   2138  CA  ASN A 290      11.880  19.222  -1.321  1.00 55.04           C  
+ATOM   2139  C   ASN A 290      12.518  18.636  -2.575  1.00 50.06           C  
+ATOM   2140  O   ASN A 290      13.149  19.357  -3.355  1.00 49.96           O  
+ATOM   2141  CB  ASN A 290      12.964  19.550  -0.292  1.00 58.01           C  
+ATOM   2142  CG  ASN A 290      13.621  18.312   0.278  1.00 60.86           C  
+ATOM   2143  OD1 ASN A 290      14.069  17.436  -0.461  1.00 62.07           O  
+ATOM   2144  ND2 ASN A 290      13.690  18.238   1.605  1.00 63.18           N  
+ATOM   2145  N   GLY A 291      12.360  17.328  -2.764  1.00 42.71           N  
+ATOM   2146  CA  GLY A 291      12.915  16.687  -3.944  1.00 35.81           C  
+ATOM   2147  C   GLY A 291      14.243  15.974  -3.762  1.00 29.46           C  
+ATOM   2148  O   GLY A 291      14.810  15.469  -4.730  1.00 28.42           O  
+ATOM   2149  N   GLN A 292      14.743  15.926  -2.532  1.00 24.58           N  
+ATOM   2150  CA  GLN A 292      16.010  15.256  -2.260  1.00 22.18           C  
+ATOM   2151  C   GLN A 292      15.826  13.757  -2.045  1.00 18.32           C  
+ATOM   2152  O   GLN A 292      15.095  13.340  -1.150  1.00 17.07           O  
+ATOM   2153  CB  GLN A 292      16.679  15.866  -1.027  1.00 26.14           C  
+ATOM   2154  CG  GLN A 292      17.874  15.072  -0.529  1.00 30.24           C  
+ATOM   2155  CD  GLN A 292      18.496  15.670   0.715  1.00 34.11           C  
+ATOM   2156  OE1 GLN A 292      17.806  15.947   1.698  1.00 36.29           O  
+ATOM   2157  NE2 GLN A 292      19.808  15.866   0.682  1.00 35.38           N  
+ATOM   2158  N   ALA A 293      16.503  12.959  -2.865  1.00 15.48           N  
+ATOM   2159  CA  ALA A 293      16.439  11.503  -2.780  1.00 15.94           C  
+ATOM   2160  C   ALA A 293      17.831  10.942  -2.475  1.00 16.80           C  
+ATOM   2161  O   ALA A 293      18.811  11.290  -3.133  1.00 17.61           O  
+ATOM   2162  CB  ALA A 293      15.924  10.926  -4.091  1.00 14.71           C  
+ATOM   2163  N   PHE A 294      17.919  10.076  -1.474  1.00 16.61           N  
+ATOM   2164  CA  PHE A 294      19.204   9.494  -1.111  1.00 17.54           C  
+ATOM   2165  C   PHE A 294      19.570   8.312  -1.996  1.00 18.50           C  
+ATOM   2166  O   PHE A 294      18.719   7.487  -2.333  1.00 17.35           O  
+ATOM   2167  CB  PHE A 294      19.176   9.064   0.352  1.00 19.44           C  
+ATOM   2168  CG  PHE A 294      19.081  10.210   1.304  1.00 22.87           C  
+ATOM   2169  CD1 PHE A 294      20.203  10.983   1.587  1.00 23.59           C  
+ATOM   2170  CD2 PHE A 294      17.863  10.548   1.889  1.00 24.97           C  
+ATOM   2171  CE1 PHE A 294      20.119  12.083   2.442  1.00 25.66           C  
+ATOM   2172  CE2 PHE A 294      17.764  11.646   2.745  1.00 26.08           C  
+ATOM   2173  CZ  PHE A 294      18.898  12.414   3.021  1.00 26.97           C  
+ATOM   2174  N   THR A 295      20.837   8.259  -2.393  1.00 18.61           N  
+ATOM   2175  CA  THR A 295      21.346   7.173  -3.217  1.00 18.67           C  
+ATOM   2176  C   THR A 295      22.712   6.823  -2.645  1.00 19.09           C  
+ATOM   2177  O   THR A 295      23.281   7.594  -1.870  1.00 17.94           O  
+ATOM   2178  CB  THR A 295      21.529   7.588  -4.694  1.00 19.19           C  
+ATOM   2179  OG1 THR A 295      22.782   8.264  -4.849  1.00 17.74           O  
+ATOM   2180  CG2 THR A 295      20.404   8.508  -5.139  1.00 20.56           C  
+ATOM   2181  N   TRP A 296      23.241   5.668  -3.023  1.00 18.21           N  
+ATOM   2182  CA  TRP A 296      24.544   5.263  -2.516  1.00 19.99           C  
+ATOM   2183  C   TRP A 296      25.660   6.108  -3.108  1.00 20.96           C  
+ATOM   2184  O   TRP A 296      26.785   6.103  -2.606  1.00 23.04           O  
+ATOM   2185  CB  TRP A 296      24.772   3.775  -2.783  1.00 17.88           C  
+ATOM   2186  CG  TRP A 296      23.800   2.943  -2.013  1.00 17.04           C  
+ATOM   2187  CD1 TRP A 296      22.715   2.279  -2.505  1.00 17.83           C  
+ATOM   2188  CD2 TRP A 296      23.763   2.777  -0.592  1.00 19.21           C  
+ATOM   2189  NE1 TRP A 296      22.000   1.710  -1.477  1.00 20.64           N  
+ATOM   2190  CE2 TRP A 296      22.622   2.002  -0.291  1.00 20.36           C  
+ATOM   2191  CE3 TRP A 296      24.583   3.213   0.460  1.00 19.64           C  
+ATOM   2192  CZ2 TRP A 296      22.275   1.653   1.021  1.00 21.62           C  
+ATOM   2193  CZ3 TRP A 296      24.239   2.866   1.763  1.00 20.33           C  
+ATOM   2194  CH2 TRP A 296      23.092   2.093   2.030  1.00 20.28           C  
+ATOM   2195  N   ASP A 297      25.338   6.853  -4.162  1.00 20.67           N  
+ATOM   2196  CA  ASP A 297      26.312   7.729  -4.813  1.00 23.28           C  
+ATOM   2197  C   ASP A 297      26.119   9.163  -4.353  1.00 22.29           C  
+ATOM   2198  O   ASP A 297      26.606  10.099  -4.979  1.00 24.38           O  
+ATOM   2199  CB  ASP A 297      26.159   7.649  -6.331  1.00 25.71           C  
+ATOM   2200  CG  ASP A 297      26.508   6.282  -6.870  1.00 26.97           C  
+ATOM   2201  OD1 ASP A 297      27.694   5.903  -6.775  1.00 29.80           O  
+ATOM   2202  OD2 ASP A 297      25.606   5.582  -7.375  1.00 25.43           O  
+ATOM   2203  N   GLY A 298      25.404   9.323  -3.247  1.00 21.74           N  
+ATOM   2204  CA  GLY A 298      25.143  10.646  -2.715  1.00 20.55           C  
+ATOM   2205  C   GLY A 298      23.714  11.061  -3.003  1.00 19.02           C  
+ATOM   2206  O   GLY A 298      23.045  10.458  -3.837  1.00 19.66           O  
+ATOM   2207  N   PRO A 299      23.213  12.096  -2.331  1.00 19.63           N  
+ATOM   2208  CA  PRO A 299      21.837  12.521  -2.586  1.00 19.10           C  
+ATOM   2209  C   PRO A 299      21.697  13.249  -3.920  1.00 18.88           C  
+ATOM   2210  O   PRO A 299      22.659  13.805  -4.435  1.00 17.80           O  
+ATOM   2211  CB  PRO A 299      21.540  13.427  -1.398  1.00 19.35           C  
+ATOM   2212  CG  PRO A 299      22.872  14.069  -1.145  1.00 22.29           C  
+ATOM   2213  CD  PRO A 299      23.841  12.916  -1.278  1.00 19.97           C  
+ATOM   2214  N   ILE A 300      20.500  13.214  -4.488  1.00 17.28           N  
+ATOM   2215  CA  ILE A 300      20.240  13.911  -5.742  1.00 18.98           C  
+ATOM   2216  C   ILE A 300      18.956  14.699  -5.554  1.00 18.37           C  
+ATOM   2217  O   ILE A 300      18.132  14.342  -4.713  1.00 18.00           O  
+ATOM   2218  CB  ILE A 300      20.029  12.930  -6.917  1.00 16.97           C  
+ATOM   2219  CG1 ILE A 300      18.837  12.009  -6.622  1.00 17.97           C  
+ATOM   2220  CG2 ILE A 300      21.305  12.142  -7.171  1.00 17.43           C  
+ATOM   2221  CD1 ILE A 300      18.488  11.041  -7.754  1.00 18.88           C  
+ATOM   2222  N   ASN A 301      18.795  15.787  -6.298  1.00 19.29           N  
+ATOM   2223  CA  ASN A 301      17.554  16.539  -6.201  1.00 20.70           C  
+ATOM   2224  C   ASN A 301      16.775  16.159  -7.449  1.00 19.74           C  
+ATOM   2225  O   ASN A 301      17.077  16.619  -8.556  1.00 18.22           O  
+ATOM   2226  CB  ASN A 301      17.777  18.048  -6.178  1.00 24.89           C  
+ATOM   2227  CG  ASN A 301      16.518  18.802  -5.764  1.00 28.02           C  
+ATOM   2228  OD1 ASN A 301      15.440  18.599  -6.332  1.00 25.38           O  
+ATOM   2229  ND2 ASN A 301      16.645  19.665  -4.760  1.00 33.38           N  
+ATOM   2230  N   ILE A 302      15.776  15.310  -7.255  1.00 17.84           N  
+ATOM   2231  CA  ILE A 302      14.959  14.811  -8.347  1.00 17.44           C  
+ATOM   2232  C   ILE A 302      14.302  15.888  -9.228  1.00 17.19           C  
+ATOM   2233  O   ILE A 302      13.891  15.600 -10.355  1.00 18.42           O  
+ATOM   2234  CB  ILE A 302      13.881  13.842  -7.799  1.00 14.80           C  
+ATOM   2235  CG1 ILE A 302      13.364  12.955  -8.932  1.00 17.03           C  
+ATOM   2236  CG2 ILE A 302      12.746  14.625  -7.151  1.00 16.77           C  
+ATOM   2237  CD1 ILE A 302      14.444  12.096  -9.573  1.00 12.88           C  
+ATOM   2238  N   ARG A 303      14.206  17.116  -8.729  1.00 14.85           N  
+ATOM   2239  CA  ARG A 303      13.600  18.195  -9.505  1.00 16.45           C  
+ATOM   2240  C   ARG A 303      14.503  18.670 -10.635  1.00 17.20           C  
+ATOM   2241  O   ARG A 303      14.045  19.329 -11.575  1.00 14.58           O  
+ATOM   2242  CB  ARG A 303      13.282  19.394  -8.617  1.00 18.30           C  
+ATOM   2243  CG  ARG A 303      12.225  19.158  -7.563  1.00 21.88           C  
+ATOM   2244  CD  ARG A 303      11.999  20.447  -6.803  1.00 22.66           C  
+ATOM   2245  NE  ARG A 303      11.612  21.504  -7.729  1.00 26.38           N  
+ATOM   2246  CZ  ARG A 303      10.357  21.884  -7.957  1.00 27.39           C  
+ATOM   2247  NH1 ARG A 303       9.358  21.300  -7.310  1.00 24.61           N  
+ATOM   2248  NH2 ARG A 303      10.101  22.826  -8.857  1.00 25.62           N  
+ATOM   2249  N   ASN A 304      15.789  18.341 -10.545  1.00 17.30           N  
+ATOM   2250  CA  ASN A 304      16.732  18.771 -11.567  1.00 19.47           C  
+ATOM   2251  C   ASN A 304      16.317  18.281 -12.941  1.00 20.24           C  
+ATOM   2252  O   ASN A 304      15.929  17.125 -13.108  1.00 20.04           O  
+ATOM   2253  CB  ASN A 304      18.148  18.285 -11.251  1.00 19.85           C  
+ATOM   2254  CG  ASN A 304      19.181  18.917 -12.160  1.00 19.53           C  
+ATOM   2255  OD1 ASN A 304      19.193  18.676 -13.366  1.00 19.19           O  
+ATOM   2256  ND2 ASN A 304      20.042  19.746 -11.590  1.00 20.48           N  
+ATOM   2257  N   ALA A 305      16.417  19.170 -13.925  1.00 21.18           N  
+ATOM   2258  CA  ALA A 305      16.029  18.863 -15.296  1.00 20.41           C  
+ATOM   2259  C   ALA A 305      16.708  17.634 -15.884  1.00 20.46           C  
+ATOM   2260  O   ALA A 305      16.145  16.974 -16.752  1.00 18.97           O  
+ATOM   2261  CB  ALA A 305      16.284  20.071 -16.188  1.00 22.90           C  
+ATOM   2262  N   ARG A 306      17.911  17.316 -15.425  1.00 20.37           N  
+ATOM   2263  CA  ARG A 306      18.589  16.149 -15.970  1.00 22.90           C  
+ATOM   2264  C   ARG A 306      17.852  14.839 -15.693  1.00 19.88           C  
+ATOM   2265  O   ARG A 306      18.203  13.807 -16.255  1.00 21.31           O  
+ATOM   2266  CB  ARG A 306      20.027  16.049 -15.443  1.00 25.56           C  
+ATOM   2267  CG  ARG A 306      20.161  15.885 -13.937  1.00 30.22           C  
+ATOM   2268  CD  ARG A 306      21.584  15.463 -13.579  1.00 33.57           C  
+ATOM   2269  NE  ARG A 306      21.863  15.627 -12.159  1.00 38.28           N  
+ATOM   2270  CZ  ARG A 306      22.106  16.798 -11.576  1.00 41.74           C  
+ATOM   2271  NH1 ARG A 306      22.110  17.914 -12.296  1.00 43.34           N  
+ATOM   2272  NH2 ARG A 306      22.332  16.858 -10.270  1.00 43.39           N  
+ATOM   2273  N   PHE A 307      16.830  14.871 -14.842  1.00 18.74           N  
+ATOM   2274  CA  PHE A 307      16.090  13.645 -14.526  1.00 18.14           C  
+ATOM   2275  C   PHE A 307      14.754  13.526 -15.257  1.00 18.27           C  
+ATOM   2276  O   PHE A 307      14.049  12.528 -15.106  1.00 17.57           O  
+ATOM   2277  CB  PHE A 307      15.847  13.548 -13.014  1.00 17.08           C  
+ATOM   2278  CG  PHE A 307      17.110  13.479 -12.201  1.00 17.06           C  
+ATOM   2279  CD1 PHE A 307      17.999  12.421 -12.365  1.00 15.11           C  
+ATOM   2280  CD2 PHE A 307      17.421  14.484 -11.288  1.00 14.74           C  
+ATOM   2281  CE1 PHE A 307      19.180  12.364 -11.635  1.00 15.92           C  
+ATOM   2282  CE2 PHE A 307      18.605  14.438 -10.549  1.00 15.52           C  
+ATOM   2283  CZ  PHE A 307      19.484  13.379 -10.723  1.00 17.62           C  
+ATOM   2284  N   SER A 308      14.413  14.534 -16.055  1.00 17.69           N  
+ATOM   2285  CA  SER A 308      13.143  14.540 -16.781  1.00 17.94           C  
+ATOM   2286  C   SER A 308      12.884  13.298 -17.636  1.00 18.49           C  
+ATOM   2287  O   SER A 308      11.740  12.871 -17.780  1.00 19.27           O  
+ATOM   2288  CB  SER A 308      13.044  15.792 -17.661  1.00 19.12           C  
+ATOM   2289  OG  SER A 308      14.019  15.780 -18.693  1.00 20.31           O  
+ATOM   2290  N   GLU A 309      13.936  12.710 -18.198  1.00 18.24           N  
+ATOM   2291  CA  GLU A 309      13.763  11.528 -19.034  1.00 18.33           C  
+ATOM   2292  C   GLU A 309      14.608  10.353 -18.561  1.00 18.55           C  
+ATOM   2293  O   GLU A 309      14.883   9.424 -19.325  1.00 16.77           O  
+ATOM   2294  CB  GLU A 309      14.102  11.868 -20.491  1.00 21.48           C  
+ATOM   2295  CG  GLU A 309      13.447  13.169 -20.947  1.00 23.94           C  
+ATOM   2296  CD  GLU A 309      13.496  13.382 -22.449  1.00 24.62           C  
+ATOM   2297  OE1 GLU A 309      14.518  13.041 -23.082  1.00 27.21           O  
+ATOM   2298  OE2 GLU A 309      12.509  13.915 -22.989  1.00 26.27           O  
+ATOM   2299  N   ASP A 310      15.017  10.395 -17.297  1.00 16.72           N  
+ATOM   2300  CA  ASP A 310      15.821   9.321 -16.725  1.00 17.35           C  
+ATOM   2301  C   ASP A 310      14.893   8.161 -16.330  1.00 17.46           C  
+ATOM   2302  O   ASP A 310      14.102   8.280 -15.395  1.00 16.68           O  
+ATOM   2303  CB  ASP A 310      16.571   9.828 -15.494  1.00 17.90           C  
+ATOM   2304  CG  ASP A 310      17.710   8.915 -15.087  1.00 19.03           C  
+ATOM   2305  OD1 ASP A 310      17.665   7.707 -15.410  1.00 19.31           O  
+ATOM   2306  OD2 ASP A 310      18.647   9.408 -14.433  1.00 20.38           O  
+ATOM   2307  N   LEU A 311      14.991   7.048 -17.054  1.00 17.15           N  
+ATOM   2308  CA  LEU A 311      14.166   5.875 -16.790  1.00 17.11           C  
+ATOM   2309  C   LEU A 311      14.629   5.028 -15.606  1.00 17.05           C  
+ATOM   2310  O   LEU A 311      13.886   4.175 -15.124  1.00 13.82           O  
+ATOM   2311  CB  LEU A 311      14.088   4.987 -18.037  1.00 20.29           C  
+ATOM   2312  CG  LEU A 311      13.131   5.421 -19.154  1.00 23.54           C  
+ATOM   2313  CD1 LEU A 311      11.762   5.725 -18.555  1.00 25.43           C  
+ATOM   2314  CD2 LEU A 311      13.670   6.640 -19.864  1.00 27.38           C  
+ATOM   2315  N   LYS A 312      15.855   5.254 -15.142  1.00 18.04           N  
+ATOM   2316  CA  LYS A 312      16.390   4.499 -14.010  1.00 17.25           C  
+ATOM   2317  C   LYS A 312      15.668   4.812 -12.704  1.00 17.42           C  
+ATOM   2318  O   LYS A 312      15.050   5.868 -12.551  1.00 15.88           O  
+ATOM   2319  CB  LYS A 312      17.885   4.789 -13.831  1.00 17.29           C  
+ATOM   2320  CG  LYS A 312      18.747   4.399 -15.027  1.00 19.78           C  
+ATOM   2321  CD  LYS A 312      20.228   4.607 -14.745  1.00 21.43           C  
+ATOM   2322  CE  LYS A 312      20.555   6.067 -14.468  1.00 21.98           C  
+ATOM   2323  NZ  LYS A 312      20.280   6.939 -15.649  1.00 23.05           N  
+ATOM   2324  N   PRO A 313      15.713   3.873 -11.746  1.00 17.51           N  
+ATOM   2325  CA  PRO A 313      15.053   4.107 -10.461  1.00 15.01           C  
+ATOM   2326  C   PRO A 313      15.870   5.127  -9.674  1.00 14.14           C  
+ATOM   2327  O   PRO A 313      17.011   5.416 -10.031  1.00 12.70           O  
+ATOM   2328  CB  PRO A 313      15.068   2.726  -9.811  1.00 16.15           C  
+ATOM   2329  CG  PRO A 313      16.335   2.104 -10.372  1.00 18.78           C  
+ATOM   2330  CD  PRO A 313      16.243   2.498 -11.829  1.00 16.98           C  
+ATOM   2331  N   LEU A 314      15.287   5.672  -8.613  1.00 13.53           N  
+ATOM   2332  CA  LEU A 314      15.982   6.653  -7.783  1.00 15.83           C  
+ATOM   2333  C   LEU A 314      17.407   6.176  -7.501  1.00 17.00           C  
+ATOM   2334  O   LEU A 314      18.371   6.930  -7.666  1.00 16.89           O  
+ATOM   2335  CB  LEU A 314      15.217   6.854  -6.471  1.00 15.73           C  
+ATOM   2336  CG  LEU A 314      14.285   8.062  -6.306  1.00 20.43           C  
+ATOM   2337  CD1 LEU A 314      13.987   8.720  -7.637  1.00 20.27           C  
+ATOM   2338  CD2 LEU A 314      13.010   7.612  -5.599  1.00 14.66           C  
+ATOM   2339  N   ASP A 315      17.533   4.921  -7.079  1.00 18.25           N  
+ATOM   2340  CA  ASP A 315      18.844   4.334  -6.801  1.00 20.60           C  
+ATOM   2341  C   ASP A 315      18.952   2.956  -7.449  1.00 21.57           C  
+ATOM   2342  O   ASP A 315      18.046   2.134  -7.335  1.00 20.50           O  
+ATOM   2343  CB  ASP A 315      19.088   4.232  -5.290  1.00 19.47           C  
+ATOM   2344  CG  ASP A 315      20.401   3.543  -4.960  1.00 20.41           C  
+ATOM   2345  OD1 ASP A 315      20.416   2.297  -4.873  1.00 21.47           O  
+ATOM   2346  OD2 ASP A 315      21.422   4.246  -4.803  1.00 18.89           O  
+ATOM   2347  N   SER A 316      20.077   2.717  -8.119  1.00 23.65           N  
+ATOM   2348  CA  SER A 316      20.332   1.462  -8.826  1.00 23.75           C  
+ATOM   2349  C   SER A 316      20.301   0.186  -7.986  1.00 23.14           C  
+ATOM   2350  O   SER A 316      20.052  -0.894  -8.515  1.00 22.10           O  
+ATOM   2351  CB  SER A 316      21.684   1.539  -9.544  1.00 26.01           C  
+ATOM   2352  OG  SER A 316      22.750   1.641  -8.613  1.00 27.27           O  
+ATOM   2353  N   GLU A 317      20.549   0.300  -6.686  1.00 22.38           N  
+ATOM   2354  CA  GLU A 317      20.564  -0.878  -5.820  1.00 22.51           C  
+ATOM   2355  C   GLU A 317      19.390  -0.991  -4.855  1.00 21.82           C  
+ATOM   2356  O   GLU A 317      18.997  -2.093  -4.479  1.00 22.25           O  
+ATOM   2357  CB  GLU A 317      21.865  -0.906  -5.016  1.00 24.23           C  
+ATOM   2358  CG  GLU A 317      23.097  -1.226  -5.838  1.00 25.21           C  
+ATOM   2359  CD  GLU A 317      24.378  -0.973  -5.076  1.00 25.35           C  
+ATOM   2360  OE1 GLU A 317      24.410  -1.218  -3.853  1.00 27.96           O  
+ATOM   2361  OE2 GLU A 317      25.357  -0.538  -5.706  1.00 27.02           O  
+ATOM   2362  N   CYS A 318      18.841   0.145  -4.442  1.00 21.30           N  
+ATOM   2363  CA  CYS A 318      17.732   0.147  -3.499  1.00 20.88           C  
+ATOM   2364  C   CYS A 318      16.683  -0.893  -3.868  1.00 21.88           C  
+ATOM   2365  O   CYS A 318      16.318  -1.033  -5.035  1.00 21.40           O  
+ATOM   2366  CB  CYS A 318      17.086   1.533  -3.440  1.00 18.85           C  
+ATOM   2367  SG  CYS A 318      15.692   1.617  -2.305  1.00 19.07           S  
+ATOM   2368  N   HIS A 319      16.196  -1.621  -2.872  1.00 21.90           N  
+ATOM   2369  CA  HIS A 319      15.192  -2.641  -3.131  1.00 24.04           C  
+ATOM   2370  C   HIS A 319      13.781  -2.244  -2.687  1.00 21.43           C  
+ATOM   2371  O   HIS A 319      12.895  -3.093  -2.592  1.00 20.86           O  
+ATOM   2372  CB  HIS A 319      15.615  -3.963  -2.476  1.00 30.28           C  
+ATOM   2373  CG  HIS A 319      15.799  -3.884  -0.991  1.00 36.99           C  
+ATOM   2374  ND1 HIS A 319      16.608  -4.761  -0.299  1.00 41.25           N  
+ATOM   2375  CD2 HIS A 319      15.252  -3.065  -0.061  1.00 40.62           C  
+ATOM   2376  CE1 HIS A 319      16.552  -4.485   0.993  1.00 41.97           C  
+ATOM   2377  NE2 HIS A 319      15.735  -3.460   1.164  1.00 42.81           N  
+ATOM   2378  N   CYS A 320      13.565  -0.955  -2.435  1.00 16.83           N  
+ATOM   2379  CA  CYS A 320      12.248  -0.494  -2.003  1.00 16.11           C  
+ATOM   2380  C   CYS A 320      11.231  -0.591  -3.143  1.00 15.36           C  
+ATOM   2381  O   CYS A 320      11.595  -0.606  -4.320  1.00 15.75           O  
+ATOM   2382  CB  CYS A 320      12.321   0.950  -1.496  1.00 15.13           C  
+ATOM   2383  SG  CYS A 320      12.223   2.204  -2.793  1.00 13.68           S  
+ATOM   2384  N   ALA A 321       9.955  -0.653  -2.786  1.00 14.63           N  
+ATOM   2385  CA  ALA A 321       8.884  -0.759  -3.770  1.00 15.35           C  
+ATOM   2386  C   ALA A 321       8.909   0.363  -4.811  1.00 16.50           C  
+ATOM   2387  O   ALA A 321       8.517   0.163  -5.963  1.00 15.07           O  
+ATOM   2388  CB  ALA A 321       7.526  -0.786  -3.057  1.00 14.97           C  
+ATOM   2389  N   VAL A 322       9.366   1.544  -4.414  1.00 15.23           N  
+ATOM   2390  CA  VAL A 322       9.417   2.669  -5.347  1.00 16.08           C  
+ATOM   2391  C   VAL A 322      10.443   2.442  -6.459  1.00 16.42           C  
+ATOM   2392  O   VAL A 322      10.171   2.700  -7.632  1.00 20.18           O  
+ATOM   2393  CB  VAL A 322       9.756   3.985  -4.611  1.00 14.87           C  
+ATOM   2394  CG1 VAL A 322       9.787   5.156  -5.595  1.00 14.91           C  
+ATOM   2395  CG2 VAL A 322       8.737   4.230  -3.511  1.00 15.94           C  
+ATOM   2396  N   CYS A 323      11.621   1.955  -6.090  1.00 17.27           N  
+ATOM   2397  CA  CYS A 323      12.676   1.715  -7.064  1.00 16.73           C  
+ATOM   2398  C   CYS A 323      12.407   0.514  -7.954  1.00 17.56           C  
+ATOM   2399  O   CYS A 323      13.058   0.343  -8.983  1.00 15.14           O  
+ATOM   2400  CB  CYS A 323      14.010   1.554  -6.353  1.00 15.63           C  
+ATOM   2401  SG  CYS A 323      14.587   3.094  -5.628  1.00 16.25           S  
+ATOM   2402  N   GLN A 324      11.451  -0.322  -7.556  1.00 18.34           N  
+ATOM   2403  CA  GLN A 324      11.099  -1.483  -8.362  1.00 20.96           C  
+ATOM   2404  C   GLN A 324      10.063  -1.068  -9.399  1.00 20.13           C  
+ATOM   2405  O   GLN A 324      10.032  -1.600 -10.502  1.00 17.73           O  
+ATOM   2406  CB  GLN A 324      10.438  -2.587  -7.527  1.00 25.46           C  
+ATOM   2407  CG  GLN A 324      11.131  -2.985  -6.255  1.00 34.58           C  
+ATOM   2408  CD  GLN A 324      10.391  -4.103  -5.547  1.00 39.77           C  
+ATOM   2409  OE1 GLN A 324       9.179  -4.019  -5.325  1.00 42.48           O  
+ATOM   2410  NE2 GLN A 324      11.116  -5.159  -5.189  1.00 42.24           N  
+ATOM   2411  N   LYS A 325       9.219  -0.109  -9.034  1.00 19.65           N  
+ATOM   2412  CA  LYS A 325       8.119   0.285  -9.904  1.00 20.94           C  
+ATOM   2413  C   LYS A 325       8.136   1.592 -10.676  1.00 20.15           C  
+ATOM   2414  O   LYS A 325       7.547   1.662 -11.749  1.00 20.49           O  
+ATOM   2415  CB  LYS A 325       6.821   0.226  -9.099  1.00 21.61           C  
+ATOM   2416  CG  LYS A 325       6.607  -1.099  -8.381  1.00 25.08           C  
+ATOM   2417  CD  LYS A 325       5.336  -1.083  -7.543  1.00 28.89           C  
+ATOM   2418  CE  LYS A 325       5.186  -2.379  -6.766  1.00 31.31           C  
+ATOM   2419  NZ  LYS A 325       3.901  -2.432  -6.029  1.00 35.17           N  
+ATOM   2420  N   TRP A 326       8.776   2.629 -10.148  1.00 18.98           N  
+ATOM   2421  CA  TRP A 326       8.772   3.907 -10.849  1.00 17.09           C  
+ATOM   2422  C   TRP A 326      10.141   4.481 -11.165  1.00 17.41           C  
+ATOM   2423  O   TRP A 326      11.129   4.215 -10.472  1.00 17.85           O  
+ATOM   2424  CB  TRP A 326       7.943   4.918 -10.051  1.00 16.10           C  
+ATOM   2425  CG  TRP A 326       6.514   4.484  -9.910  1.00 14.60           C  
+ATOM   2426  CD1 TRP A 326       5.527   4.599 -10.846  1.00 13.21           C  
+ATOM   2427  CD2 TRP A 326       5.930   3.808  -8.791  1.00 14.62           C  
+ATOM   2428  NE1 TRP A 326       4.364   4.036 -10.380  1.00 17.18           N  
+ATOM   2429  CE2 TRP A 326       4.581   3.541  -9.121  1.00 15.98           C  
+ATOM   2430  CE3 TRP A 326       6.415   3.399  -7.539  1.00 15.74           C  
+ATOM   2431  CZ2 TRP A 326       3.707   2.884  -8.244  1.00 15.83           C  
+ATOM   2432  CZ3 TRP A 326       5.546   2.744  -6.664  1.00 17.06           C  
+ATOM   2433  CH2 TRP A 326       4.204   2.494  -7.025  1.00 18.17           C  
+ATOM   2434  N   SER A 327      10.182   5.287 -12.219  1.00 14.98           N  
+ATOM   2435  CA  SER A 327      11.417   5.904 -12.669  1.00 14.58           C  
+ATOM   2436  C   SER A 327      11.642   7.280 -12.068  1.00 14.93           C  
+ATOM   2437  O   SER A 327      10.735   7.885 -11.494  1.00 14.41           O  
+ATOM   2438  CB  SER A 327      11.391   6.059 -14.186  1.00 16.76           C  
+ATOM   2439  OG  SER A 327      10.420   7.032 -14.544  1.00 13.32           O  
+ATOM   2440  N   ARG A 328      12.869   7.767 -12.219  1.00 14.93           N  
+ATOM   2441  CA  ARG A 328      13.235   9.092 -11.753  1.00 14.26           C  
+ATOM   2442  C   ARG A 328      12.395  10.088 -12.546  1.00 14.32           C  
+ATOM   2443  O   ARG A 328      11.902  11.066 -11.998  1.00 14.06           O  
+ATOM   2444  CB  ARG A 328      14.716   9.355 -12.024  1.00 12.90           C  
+ATOM   2445  CG  ARG A 328      15.648   8.532 -11.181  1.00 14.90           C  
+ATOM   2446  CD  ARG A 328      17.079   8.723 -11.610  1.00 16.01           C  
+ATOM   2447  NE  ARG A 328      18.004   8.182 -10.623  1.00 17.48           N  
+ATOM   2448  CZ  ARG A 328      19.326   8.217 -10.752  1.00 20.44           C  
+ATOM   2449  NH1 ARG A 328      19.868   8.767 -11.833  1.00 17.64           N  
+ATOM   2450  NH2 ARG A 328      20.101   7.711  -9.799  1.00 17.73           N  
+ATOM   2451  N   ALA A 329      12.243   9.822 -13.842  1.00 12.92           N  
+ATOM   2452  CA  ALA A 329      11.469  10.683 -14.738  1.00 14.59           C  
+ATOM   2453  C   ALA A 329      10.058  10.921 -14.225  1.00 13.95           C  
+ATOM   2454  O   ALA A 329       9.564  12.053 -14.222  1.00 14.86           O  
+ATOM   2455  CB  ALA A 329      11.413  10.071 -16.141  1.00 13.85           C  
+ATOM   2456  N   TYR A 330       9.401   9.852 -13.795  1.00 14.95           N  
+ATOM   2457  CA  TYR A 330       8.047   9.969 -13.279  1.00 15.65           C  
+ATOM   2458  C   TYR A 330       8.018  10.758 -11.966  1.00 15.75           C  
+ATOM   2459  O   TYR A 330       7.189  11.647 -11.788  1.00 14.10           O  
+ATOM   2460  CB  TYR A 330       7.437   8.580 -13.058  1.00 14.71           C  
+ATOM   2461  CG  TYR A 330       6.004   8.609 -12.541  1.00 15.27           C  
+ATOM   2462  CD1 TYR A 330       5.007   9.303 -13.230  1.00 13.89           C  
+ATOM   2463  CD2 TYR A 330       5.648   7.943 -11.366  1.00 14.59           C  
+ATOM   2464  CE1 TYR A 330       3.685   9.337 -12.759  1.00 14.81           C  
+ATOM   2465  CE2 TYR A 330       4.327   7.964 -10.890  1.00 13.89           C  
+ATOM   2466  CZ  TYR A 330       3.352   8.664 -11.590  1.00 16.19           C  
+ATOM   2467  OH  TYR A 330       2.046   8.697 -11.127  1.00 14.63           O  
+ATOM   2468  N   ILE A 331       8.930  10.434 -11.056  1.00 15.77           N  
+ATOM   2469  CA  ILE A 331       8.971  11.103  -9.759  1.00 16.55           C  
+ATOM   2470  C   ILE A 331       9.350  12.567  -9.931  1.00 16.81           C  
+ATOM   2471  O   ILE A 331       8.870  13.431  -9.195  1.00 19.06           O  
+ATOM   2472  CB  ILE A 331       9.949  10.375  -8.797  1.00 14.77           C  
+ATOM   2473  CG1 ILE A 331       9.447   8.945  -8.571  1.00 16.30           C  
+ATOM   2474  CG2 ILE A 331      10.011  11.092  -7.443  1.00 14.65           C  
+ATOM   2475  CD1 ILE A 331      10.342   8.092  -7.681  1.00 15.61           C  
+ATOM   2476  N   HIS A 332      10.215  12.833 -10.907  1.00 16.18           N  
+ATOM   2477  CA  HIS A 332      10.643  14.192 -11.237  1.00 15.72           C  
+ATOM   2478  C   HIS A 332       9.368  14.957 -11.599  1.00 14.29           C  
+ATOM   2479  O   HIS A 332       9.097  16.039 -11.077  1.00 12.49           O  
+ATOM   2480  CB  HIS A 332      11.593  14.142 -12.440  1.00 16.51           C  
+ATOM   2481  CG  HIS A 332      11.850  15.471 -13.087  1.00 16.56           C  
+ATOM   2482  ND1 HIS A 332      12.833  16.336 -12.656  1.00 18.97           N  
+ATOM   2483  CD2 HIS A 332      11.280  16.060 -14.166  1.00 16.77           C  
+ATOM   2484  CE1 HIS A 332      12.862  17.397 -13.445  1.00 17.80           C  
+ATOM   2485  NE2 HIS A 332      11.930  17.254 -14.369  1.00 15.64           N  
+ATOM   2486  N   HIS A 333       8.582  14.375 -12.496  1.00 13.32           N  
+ATOM   2487  CA  HIS A 333       7.327  14.993 -12.917  1.00 15.75           C  
+ATOM   2488  C   HIS A 333       6.393  15.276 -11.735  1.00 14.26           C  
+ATOM   2489  O   HIS A 333       5.873  16.377 -11.590  1.00 13.18           O  
+ATOM   2490  CB  HIS A 333       6.605  14.088 -13.916  1.00 14.78           C  
+ATOM   2491  CG  HIS A 333       5.139  14.363 -14.021  1.00 17.90           C  
+ATOM   2492  ND1 HIS A 333       4.637  15.548 -14.513  1.00 19.52           N  
+ATOM   2493  CD2 HIS A 333       4.065  13.623 -13.652  1.00 19.24           C  
+ATOM   2494  CE1 HIS A 333       3.317  15.528 -14.442  1.00 20.42           C  
+ATOM   2495  NE2 HIS A 333       2.945  14.372 -13.921  1.00 18.95           N  
+ATOM   2496  N   LEU A 334       6.180  14.260 -10.906  1.00 15.42           N  
+ATOM   2497  CA  LEU A 334       5.310  14.352  -9.734  1.00 14.68           C  
+ATOM   2498  C   LEU A 334       5.691  15.488  -8.783  1.00 13.91           C  
+ATOM   2499  O   LEU A 334       4.838  16.274  -8.359  1.00 13.59           O  
+ATOM   2500  CB  LEU A 334       5.339  13.015  -8.979  1.00 13.45           C  
+ATOM   2501  CG  LEU A 334       4.187  12.000  -9.086  1.00 18.32           C  
+ATOM   2502  CD1 LEU A 334       3.376  12.168 -10.354  1.00 15.76           C  
+ATOM   2503  CD2 LEU A 334       4.773  10.600  -8.994  1.00 13.54           C  
+ATOM   2504  N   ILE A 335       6.973  15.572  -8.443  1.00 14.12           N  
+ATOM   2505  CA  ILE A 335       7.437  16.610  -7.532  1.00 14.08           C  
+ATOM   2506  C   ILE A 335       7.258  18.009  -8.127  1.00 15.39           C  
+ATOM   2507  O   ILE A 335       6.702  18.903  -7.483  1.00 14.20           O  
+ATOM   2508  CB  ILE A 335       8.922  16.379  -7.143  1.00 13.00           C  
+ATOM   2509  CG1 ILE A 335       9.044  15.073  -6.353  1.00 12.26           C  
+ATOM   2510  CG2 ILE A 335       9.435  17.532  -6.295  1.00 12.40           C  
+ATOM   2511  CD1 ILE A 335       8.223  15.057  -5.081  1.00 13.34           C  
+ATOM   2512  N   ARG A 336       7.698  18.198  -9.364  1.00 15.27           N  
+ATOM   2513  CA  ARG A 336       7.563  19.513  -9.979  1.00 18.23           C  
+ATOM   2514  C   ARG A 336       6.103  19.896 -10.182  1.00 18.51           C  
+ATOM   2515  O   ARG A 336       5.760  21.076 -10.167  1.00 20.31           O  
+ATOM   2516  CB  ARG A 336       8.361  19.557 -11.287  1.00 20.71           C  
+ATOM   2517  CG  ARG A 336       9.869  19.474 -11.001  1.00 23.73           C  
+ATOM   2518  CD  ARG A 336      10.752  19.555 -12.233  1.00 25.74           C  
+ATOM   2519  NE  ARG A 336      10.509  20.762 -13.009  1.00 26.13           N  
+ATOM   2520  CZ  ARG A 336      11.452  21.462 -13.632  1.00 23.64           C  
+ATOM   2521  NH1 ARG A 336      12.724  21.087 -13.572  1.00 22.01           N  
+ATOM   2522  NH2 ARG A 336      11.114  22.538 -14.322  1.00 20.07           N  
+ATOM   2523  N   ALA A 337       5.239  18.898 -10.337  1.00 18.52           N  
+ATOM   2524  CA  ALA A 337       3.812  19.152 -10.520  1.00 19.13           C  
+ATOM   2525  C   ALA A 337       3.115  19.332  -9.170  1.00 20.78           C  
+ATOM   2526  O   ALA A 337       1.922  19.629  -9.114  1.00 22.69           O  
+ATOM   2527  CB  ALA A 337       3.169  18.001 -11.287  1.00 18.99           C  
+ATOM   2528  N   GLY A 338       3.865  19.139  -8.088  1.00 20.93           N  
+ATOM   2529  CA  GLY A 338       3.311  19.284  -6.752  1.00 17.69           C  
+ATOM   2530  C   GLY A 338       2.296  18.222  -6.354  1.00 17.98           C  
+ATOM   2531  O   GLY A 338       1.451  18.467  -5.490  1.00 18.07           O  
+ATOM   2532  N   GLU A 339       2.379  17.042  -6.962  1.00 16.00           N  
+ATOM   2533  CA  GLU A 339       1.444  15.958  -6.659  1.00 15.38           C  
+ATOM   2534  C   GLU A 339       1.770  15.208  -5.371  1.00 16.09           C  
+ATOM   2535  O   GLU A 339       2.936  14.944  -5.067  1.00 15.78           O  
+ATOM   2536  CB  GLU A 339       1.399  14.968  -7.828  1.00 15.47           C  
+ATOM   2537  CG  GLU A 339       0.691  15.507  -9.051  1.00 16.24           C  
+ATOM   2538  CD  GLU A 339      -0.818  15.522  -8.883  1.00 20.17           C  
+ATOM   2539  OE1 GLU A 339      -1.491  16.209  -9.677  1.00 20.90           O  
+ATOM   2540  OE2 GLU A 339      -1.335  14.833  -7.970  1.00 18.12           O  
+ATOM   2541  N   ILE A 340       0.730  14.850  -4.625  1.00 16.78           N  
+ATOM   2542  CA  ILE A 340       0.899  14.123  -3.369  1.00 16.26           C  
+ATOM   2543  C   ILE A 340       1.653  12.821  -3.579  1.00 14.63           C  
+ATOM   2544  O   ILE A 340       2.485  12.457  -2.761  1.00 14.84           O  
+ATOM   2545  CB  ILE A 340      -0.463  13.792  -2.708  1.00 17.92           C  
+ATOM   2546  CG1 ILE A 340      -1.141  15.078  -2.225  1.00 19.04           C  
+ATOM   2547  CG2 ILE A 340      -0.264  12.839  -1.535  1.00 19.73           C  
+ATOM   2548  CD1 ILE A 340      -0.315  15.868  -1.222  1.00 26.15           C  
+ATOM   2549  N   LEU A 341       1.371  12.117  -4.675  1.00 13.39           N  
+ATOM   2550  CA  LEU A 341       2.055  10.853  -4.915  1.00 11.74           C  
+ATOM   2551  C   LEU A 341       3.568  11.044  -4.962  1.00 11.42           C  
+ATOM   2552  O   LEU A 341       4.328  10.138  -4.617  1.00 12.11           O  
+ATOM   2553  CB  LEU A 341       1.568  10.200  -6.212  1.00 10.76           C  
+ATOM   2554  CG  LEU A 341       2.189   8.832  -6.527  1.00 10.35           C  
+ATOM   2555  CD1 LEU A 341       1.842   7.825  -5.425  1.00 12.08           C  
+ATOM   2556  CD2 LEU A 341       1.668   8.343  -7.883  1.00 12.56           C  
+ATOM   2557  N   GLY A 342       4.008  12.222  -5.392  1.00 12.08           N  
+ATOM   2558  CA  GLY A 342       5.435  12.481  -5.449  1.00  9.68           C  
+ATOM   2559  C   GLY A 342       6.043  12.406  -4.060  1.00 12.11           C  
+ATOM   2560  O   GLY A 342       7.092  11.787  -3.848  1.00 10.88           O  
+ATOM   2561  N   ALA A 343       5.376  13.044  -3.105  1.00 11.89           N  
+ATOM   2562  CA  ALA A 343       5.844  13.052  -1.724  1.00 13.70           C  
+ATOM   2563  C   ALA A 343       5.775  11.641  -1.135  1.00 13.01           C  
+ATOM   2564  O   ALA A 343       6.642  11.242  -0.365  1.00 13.04           O  
+ATOM   2565  CB  ALA A 343       5.000  14.016  -0.889  1.00 13.76           C  
+ATOM   2566  N   MET A 344       4.743  10.889  -1.499  1.00 13.77           N  
+ATOM   2567  CA  MET A 344       4.590   9.522  -0.999  1.00 12.56           C  
+ATOM   2568  C   MET A 344       5.741   8.638  -1.468  1.00 12.39           C  
+ATOM   2569  O   MET A 344       6.357   7.931  -0.677  1.00 13.46           O  
+ATOM   2570  CB  MET A 344       3.275   8.912  -1.492  1.00 10.71           C  
+ATOM   2571  CG  MET A 344       2.027   9.563  -0.930  1.00 11.24           C  
+ATOM   2572  SD  MET A 344       0.559   9.178  -1.912  1.00 13.00           S  
+ATOM   2573  CE  MET A 344       0.412   7.442  -1.652  1.00 13.01           C  
+ATOM   2574  N   LEU A 345       6.021   8.679  -2.765  1.00 12.91           N  
+ATOM   2575  CA  LEU A 345       7.080   7.860  -3.341  1.00 13.97           C  
+ATOM   2576  C   LEU A 345       8.475   8.268  -2.874  1.00 13.58           C  
+ATOM   2577  O   LEU A 345       9.313   7.413  -2.591  1.00 14.39           O  
+ATOM   2578  CB  LEU A 345       6.987   7.906  -4.873  1.00 15.30           C  
+ATOM   2579  CG  LEU A 345       6.359   6.713  -5.621  1.00 18.80           C  
+ATOM   2580  CD1 LEU A 345       5.298   6.038  -4.791  1.00 17.56           C  
+ATOM   2581  CD2 LEU A 345       5.799   7.189  -6.951  1.00 16.90           C  
+ATOM   2582  N   MET A 346       8.728   9.570  -2.800  1.00 12.77           N  
+ATOM   2583  CA  MET A 346      10.034  10.062  -2.357  1.00 14.46           C  
+ATOM   2584  C   MET A 346      10.305   9.687  -0.899  1.00 14.39           C  
+ATOM   2585  O   MET A 346      11.424   9.317  -0.541  1.00 14.18           O  
+ATOM   2586  CB  MET A 346      10.107  11.582  -2.506  1.00 14.24           C  
+ATOM   2587  CG  MET A 346      10.319  12.072  -3.923  1.00 17.25           C  
+ATOM   2588  SD  MET A 346      12.005  11.795  -4.505  1.00 20.65           S  
+ATOM   2589  CE  MET A 346      12.855  13.040  -3.522  1.00 22.19           C  
+ATOM   2590  N   THR A 347       9.272   9.777  -0.066  1.00 15.03           N  
+ATOM   2591  CA  THR A 347       9.398   9.470   1.355  1.00 16.56           C  
+ATOM   2592  C   THR A 347       9.560   7.976   1.613  1.00 16.00           C  
+ATOM   2593  O   THR A 347      10.311   7.579   2.492  1.00 17.01           O  
+ATOM   2594  CB  THR A 347       8.172   9.978   2.145  1.00 18.03           C  
+ATOM   2595  OG1 THR A 347       8.029  11.387   1.943  1.00 18.07           O  
+ATOM   2596  CG2 THR A 347       8.347   9.711   3.635  1.00 20.77           C  
+ATOM   2597  N   GLU A 348       8.854   7.145   0.854  1.00 14.00           N  
+ATOM   2598  CA  GLU A 348       8.979   5.714   1.054  1.00 13.31           C  
+ATOM   2599  C   GLU A 348      10.400   5.306   0.697  1.00 13.92           C  
+ATOM   2600  O   GLU A 348      11.050   4.559   1.438  1.00 12.21           O  
+ATOM   2601  CB  GLU A 348       7.993   4.935   0.180  1.00 13.05           C  
+ATOM   2602  CG  GLU A 348       8.080   3.432   0.426  1.00 13.22           C  
+ATOM   2603  CD  GLU A 348       7.047   2.629  -0.331  1.00 12.68           C  
+ATOM   2604  OE1 GLU A 348       6.102   3.222  -0.895  1.00 13.83           O  
+ATOM   2605  OE2 GLU A 348       7.177   1.394  -0.346  1.00 15.92           O  
+ATOM   2606  N   HIS A 349      10.886   5.803  -0.437  1.00 11.79           N  
+ATOM   2607  CA  HIS A 349      12.236   5.475  -0.856  1.00 12.16           C  
+ATOM   2608  C   HIS A 349      13.276   5.920   0.173  1.00 12.19           C  
+ATOM   2609  O   HIS A 349      14.115   5.126   0.597  1.00 11.92           O  
+ATOM   2610  CB  HIS A 349      12.580   6.129  -2.196  1.00 12.35           C  
+ATOM   2611  CG  HIS A 349      14.051   6.133  -2.485  1.00 12.64           C  
+ATOM   2612  ND1 HIS A 349      14.739   4.997  -2.854  1.00 11.28           N  
+ATOM   2613  CD2 HIS A 349      14.981   7.111  -2.359  1.00 10.99           C  
+ATOM   2614  CE1 HIS A 349      16.029   5.273  -2.939  1.00 12.45           C  
+ATOM   2615  NE2 HIS A 349      16.203   6.548  -2.644  1.00 11.28           N  
+ATOM   2616  N   ASN A 350      13.227   7.189   0.571  1.00 12.45           N  
+ATOM   2617  CA  ASN A 350      14.210   7.705   1.525  1.00 12.94           C  
+ATOM   2618  C   ASN A 350      14.218   6.965   2.856  1.00 12.60           C  
+ATOM   2619  O   ASN A 350      15.284   6.738   3.429  1.00 14.77           O  
+ATOM   2620  CB  ASN A 350      14.011   9.210   1.762  1.00  9.99           C  
+ATOM   2621  CG  ASN A 350      14.525  10.055   0.608  1.00 14.75           C  
+ATOM   2622  OD1 ASN A 350      15.426   9.637  -0.131  1.00 14.96           O  
+ATOM   2623  ND2 ASN A 350      13.971  11.257   0.456  1.00 12.11           N  
+ATOM   2624  N   ILE A 351      13.045   6.595   3.364  1.00 13.06           N  
+ATOM   2625  CA  ILE A 351      13.004   5.869   4.625  1.00 13.67           C  
+ATOM   2626  C   ILE A 351      13.503   4.445   4.393  1.00 14.37           C  
+ATOM   2627  O   ILE A 351      14.157   3.856   5.256  1.00 14.77           O  
+ATOM   2628  CB  ILE A 351      11.581   5.848   5.227  1.00 15.87           C  
+ATOM   2629  CG1 ILE A 351      11.215   7.257   5.702  1.00 15.66           C  
+ATOM   2630  CG2 ILE A 351      11.514   4.856   6.395  1.00 15.54           C  
+ATOM   2631  CD1 ILE A 351       9.870   7.354   6.382  1.00 17.61           C  
+ATOM   2632  N   ALA A 352      13.202   3.892   3.223  1.00 13.00           N  
+ATOM   2633  CA  ALA A 352      13.664   2.548   2.907  1.00 12.55           C  
+ATOM   2634  C   ALA A 352      15.189   2.592   2.779  1.00 13.34           C  
+ATOM   2635  O   ALA A 352      15.886   1.688   3.243  1.00 13.46           O  
+ATOM   2636  CB  ALA A 352      13.033   2.057   1.602  1.00 12.05           C  
+ATOM   2637  N   PHE A 353      15.704   3.646   2.151  1.00 11.71           N  
+ATOM   2638  CA  PHE A 353      17.143   3.791   1.992  1.00 13.16           C  
+ATOM   2639  C   PHE A 353      17.804   3.823   3.372  1.00 13.98           C  
+ATOM   2640  O   PHE A 353      18.786   3.122   3.615  1.00 15.21           O  
+ATOM   2641  CB  PHE A 353      17.470   5.075   1.235  1.00 13.93           C  
+ATOM   2642  CG  PHE A 353      18.942   5.318   1.067  1.00 16.12           C  
+ATOM   2643  CD1 PHE A 353      19.643   4.730   0.022  1.00 16.40           C  
+ATOM   2644  CD2 PHE A 353      19.630   6.121   1.967  1.00 14.26           C  
+ATOM   2645  CE1 PHE A 353      21.010   4.936  -0.125  1.00 14.68           C  
+ATOM   2646  CE2 PHE A 353      20.997   6.332   1.829  1.00 17.14           C  
+ATOM   2647  CZ  PHE A 353      21.686   5.737   0.781  1.00 16.18           C  
+ATOM   2648  N   TYR A 354      17.261   4.639   4.270  1.00 14.06           N  
+ATOM   2649  CA  TYR A 354      17.796   4.736   5.628  1.00 16.21           C  
+ATOM   2650  C   TYR A 354      17.818   3.387   6.343  1.00 14.37           C  
+ATOM   2651  O   TYR A 354      18.806   3.038   6.985  1.00 16.11           O  
+ATOM   2652  CB  TYR A 354      16.979   5.720   6.462  1.00 17.40           C  
+ATOM   2653  CG  TYR A 354      17.532   7.125   6.446  1.00 22.76           C  
+ATOM   2654  CD1 TYR A 354      17.319   7.973   5.361  1.00 26.73           C  
+ATOM   2655  CD2 TYR A 354      18.277   7.605   7.519  1.00 23.16           C  
+ATOM   2656  CE1 TYR A 354      17.835   9.269   5.350  1.00 28.55           C  
+ATOM   2657  CE2 TYR A 354      18.795   8.893   7.516  1.00 25.60           C  
+ATOM   2658  CZ  TYR A 354      18.570   9.720   6.433  1.00 26.06           C  
+ATOM   2659  OH  TYR A 354      19.068  11.000   6.442  1.00 28.31           O  
+ATOM   2660  N   GLN A 355      16.725   2.637   6.237  1.00 13.28           N  
+ATOM   2661  CA  GLN A 355      16.644   1.330   6.877  1.00 14.07           C  
+ATOM   2662  C   GLN A 355      17.654   0.359   6.252  1.00 15.14           C  
+ATOM   2663  O   GLN A 355      18.207  -0.501   6.947  1.00 13.06           O  
+ATOM   2664  CB  GLN A 355      15.226   0.759   6.772  1.00 12.16           C  
+ATOM   2665  CG  GLN A 355      14.155   1.520   7.570  1.00 12.87           C  
+ATOM   2666  CD  GLN A 355      14.516   1.729   9.043  1.00 16.92           C  
+ATOM   2667  OE1 GLN A 355      15.190   0.901   9.657  1.00 15.72           O  
+ATOM   2668  NE2 GLN A 355      14.043   2.834   9.620  1.00 16.26           N  
+ATOM   2669  N   GLN A 356      17.889   0.489   4.947  1.00 13.89           N  
+ATOM   2670  CA  GLN A 356      18.861  -0.371   4.276  1.00 16.53           C  
+ATOM   2671  C   GLN A 356      20.255  -0.003   4.785  1.00 16.00           C  
+ATOM   2672  O   GLN A 356      21.126  -0.866   4.940  1.00 16.11           O  
+ATOM   2673  CB  GLN A 356      18.764  -0.206   2.752  1.00 17.23           C  
+ATOM   2674  CG  GLN A 356      17.681  -1.088   2.117  1.00 21.55           C  
+ATOM   2675  CD  GLN A 356      17.283  -0.644   0.716  1.00 22.88           C  
+ATOM   2676  OE1 GLN A 356      16.570   0.349   0.545  1.00 25.54           O  
+ATOM   2677  NE2 GLN A 356      17.739  -1.379  -0.292  1.00 20.18           N  
+ATOM   2678  N   LEU A 357      20.457   1.282   5.061  1.00 16.21           N  
+ATOM   2679  CA  LEU A 357      21.732   1.755   5.589  1.00 16.99           C  
+ATOM   2680  C   LEU A 357      21.968   1.117   6.955  1.00 16.27           C  
+ATOM   2681  O   LEU A 357      23.048   0.597   7.225  1.00 15.87           O  
+ATOM   2682  CB  LEU A 357      21.726   3.279   5.745  1.00 13.77           C  
+ATOM   2683  CG  LEU A 357      22.910   3.875   6.515  1.00 14.61           C  
+ATOM   2684  CD1 LEU A 357      24.226   3.549   5.814  1.00 14.54           C  
+ATOM   2685  CD2 LEU A 357      22.733   5.381   6.621  1.00 16.10           C  
+ATOM   2686  N   MET A 358      20.950   1.161   7.811  1.00 14.77           N  
+ATOM   2687  CA  MET A 358      21.071   0.596   9.152  1.00 16.41           C  
+ATOM   2688  C   MET A 358      21.331  -0.906   9.095  1.00 16.79           C  
+ATOM   2689  O   MET A 358      22.079  -1.446   9.915  1.00 15.61           O  
+ATOM   2690  CB  MET A 358      19.805   0.866   9.986  1.00 15.44           C  
+ATOM   2691  CG  MET A 358      19.406   2.348  10.126  1.00 12.99           C  
+ATOM   2692  SD  MET A 358      20.774   3.520  10.362  1.00 13.66           S  
+ATOM   2693  CE  MET A 358      21.304   3.107  12.042  1.00 10.31           C  
+ATOM   2694  N   GLN A 359      20.710  -1.578   8.129  1.00 15.91           N  
+ATOM   2695  CA  GLN A 359      20.887  -3.016   7.978  1.00 17.06           C  
+ATOM   2696  C   GLN A 359      22.332  -3.318   7.576  1.00 17.02           C  
+ATOM   2697  O   GLN A 359      22.951  -4.245   8.102  1.00 18.04           O  
+ATOM   2698  CB  GLN A 359      19.916  -3.567   6.926  1.00 16.89           C  
+ATOM   2699  CG  GLN A 359      19.874  -5.089   6.855  1.00 18.26           C  
+ATOM   2700  CD  GLN A 359      19.461  -5.727   8.176  1.00 20.41           C  
+ATOM   2701  OE1 GLN A 359      20.212  -6.508   8.765  1.00 23.09           O  
+ATOM   2702  NE2 GLN A 359      18.265  -5.397   8.645  1.00 19.95           N  
+ATOM   2703  N   LYS A 360      22.870  -2.532   6.648  1.00 15.69           N  
+ATOM   2704  CA  LYS A 360      24.245  -2.721   6.201  1.00 16.44           C  
+ATOM   2705  C   LYS A 360      25.217  -2.435   7.348  1.00 17.13           C  
+ATOM   2706  O   LYS A 360      26.294  -3.022   7.422  1.00 16.30           O  
+ATOM   2707  CB  LYS A 360      24.548  -1.807   5.015  1.00 18.29           C  
+ATOM   2708  CG  LYS A 360      23.915  -2.256   3.702  1.00 18.21           C  
+ATOM   2709  CD  LYS A 360      24.156  -1.222   2.610  1.00 22.09           C  
+ATOM   2710  CE  LYS A 360      23.614  -1.667   1.259  1.00 23.63           C  
+ATOM   2711  NZ  LYS A 360      24.441  -2.752   0.659  1.00 28.24           N  
+ATOM   2712  N   ILE A 361      24.833  -1.531   8.241  1.00 15.22           N  
+ATOM   2713  CA  ILE A 361      25.671  -1.214   9.385  1.00 14.49           C  
+ATOM   2714  C   ILE A 361      25.619  -2.373  10.382  1.00 15.30           C  
+ATOM   2715  O   ILE A 361      26.656  -2.805  10.889  1.00 14.12           O  
+ATOM   2716  CB  ILE A 361      25.211   0.090  10.077  1.00 13.96           C  
+ATOM   2717  CG1 ILE A 361      25.529   1.286   9.172  1.00 12.74           C  
+ATOM   2718  CG2 ILE A 361      25.907   0.248  11.423  1.00 12.95           C  
+ATOM   2719  CD1 ILE A 361      25.126   2.640   9.745  1.00 15.50           C  
+ATOM   2720  N   ARG A 362      24.418  -2.883  10.648  1.00 11.91           N  
+ATOM   2721  CA  ARG A 362      24.256  -3.998  11.583  1.00 14.48           C  
+ATOM   2722  C   ARG A 362      24.966  -5.252  11.070  1.00 15.17           C  
+ATOM   2723  O   ARG A 362      25.630  -5.953  11.837  1.00 16.51           O  
+ATOM   2724  CB  ARG A 362      22.769  -4.305  11.815  1.00 12.76           C  
+ATOM   2725  CG  ARG A 362      21.993  -3.172  12.496  1.00 11.56           C  
+ATOM   2726  CD  ARG A 362      20.636  -3.652  12.987  1.00 13.14           C  
+ATOM   2727  NE  ARG A 362      19.686  -3.929  11.910  1.00 14.48           N  
+ATOM   2728  CZ  ARG A 362      18.800  -3.053  11.444  1.00 14.88           C  
+ATOM   2729  NH1 ARG A 362      18.735  -1.828  11.957  1.00 13.09           N  
+ATOM   2730  NH2 ARG A 362      17.966  -3.407  10.471  1.00 11.93           N  
+ATOM   2731  N   ASP A 363      24.816  -5.530   9.776  1.00 15.44           N  
+ATOM   2732  CA  ASP A 363      25.453  -6.688   9.160  1.00 15.65           C  
+ATOM   2733  C   ASP A 363      26.972  -6.566   9.178  1.00 16.36           C  
+ATOM   2734  O   ASP A 363      27.660  -7.530   9.494  1.00 15.65           O  
+ATOM   2735  CB  ASP A 363      25.003  -6.866   7.708  1.00 15.69           C  
+ATOM   2736  CG  ASP A 363      23.582  -7.373   7.591  1.00 18.00           C  
+ATOM   2737  OD1 ASP A 363      23.095  -8.023   8.536  1.00 19.47           O  
+ATOM   2738  OD2 ASP A 363      22.960  -7.136   6.538  1.00 20.55           O  
+ATOM   2739  N   SER A 364      27.499  -5.393   8.835  1.00 15.05           N  
+ATOM   2740  CA  SER A 364      28.947  -5.218   8.823  1.00 16.20           C  
+ATOM   2741  C   SER A 364      29.561  -5.268  10.233  1.00 17.56           C  
+ATOM   2742  O   SER A 364      30.723  -5.661  10.397  1.00 18.71           O  
+ATOM   2743  CB  SER A 364      29.329  -3.920   8.094  1.00 15.10           C  
+ATOM   2744  OG  SER A 364      28.837  -2.772   8.753  1.00 19.97           O  
+ATOM   2745  N   ILE A 365      28.789  -4.887  11.248  1.00 16.65           N  
+ATOM   2746  CA  ILE A 365      29.278  -4.944  12.628  1.00 17.46           C  
+ATOM   2747  C   ILE A 365      29.310  -6.409  13.068  1.00 18.53           C  
+ATOM   2748  O   ILE A 365      30.290  -6.876  13.649  1.00 18.36           O  
+ATOM   2749  CB  ILE A 365      28.359  -4.213  13.629  1.00 17.46           C  
+ATOM   2750  CG1 ILE A 365      28.232  -2.733  13.277  1.00 20.99           C  
+ATOM   2751  CG2 ILE A 365      28.937  -4.349  15.040  1.00 18.71           C  
+ATOM   2752  CD1 ILE A 365      29.467  -1.952  13.536  1.00 25.91           C  
+ATOM   2753  N   SER A 366      28.219  -7.121  12.807  1.00 17.46           N  
+ATOM   2754  CA  SER A 366      28.125  -8.529  13.173  1.00 19.95           C  
+ATOM   2755  C   SER A 366      29.213  -9.342  12.481  1.00 18.73           C  
+ATOM   2756  O   SER A 366      29.632 -10.379  12.985  1.00 21.46           O  
+ATOM   2757  CB  SER A 366      26.755  -9.093  12.781  1.00 22.16           C  
+ATOM   2758  OG  SER A 366      25.702  -8.381  13.409  1.00 26.72           O  
+ATOM   2759  N   GLU A 367      29.664  -8.871  11.324  1.00 17.58           N  
+ATOM   2760  CA  GLU A 367      30.690  -9.578  10.566  1.00 17.40           C  
+ATOM   2761  C   GLU A 367      32.086  -8.985  10.737  1.00 16.29           C  
+ATOM   2762  O   GLU A 367      33.036  -9.403  10.075  1.00 14.78           O  
+ATOM   2763  CB  GLU A 367      30.302  -9.617   9.086  1.00 15.79           C  
+ATOM   2764  CG  GLU A 367      29.088 -10.504   8.823  1.00 19.15           C  
+ATOM   2765  CD  GLU A 367      28.572 -10.402   7.401  1.00 20.75           C  
+ATOM   2766  OE1 GLU A 367      29.226  -9.740   6.570  1.00 21.45           O  
+ATOM   2767  OE2 GLU A 367      27.512 -10.995   7.114  1.00 23.18           O  
+ATOM   2768  N   GLY A 368      32.201  -8.010  11.632  1.00 16.45           N  
+ATOM   2769  CA  GLY A 368      33.491  -7.394  11.895  1.00 18.42           C  
+ATOM   2770  C   GLY A 368      34.152  -6.708  10.717  1.00 18.51           C  
+ATOM   2771  O   GLY A 368      35.372  -6.755  10.571  1.00 19.82           O  
+ATOM   2772  N   ARG A 369      33.355  -6.067   9.870  1.00 19.78           N  
+ATOM   2773  CA  ARG A 369      33.896  -5.360   8.714  1.00 18.62           C  
+ATOM   2774  C   ARG A 369      33.231  -3.996   8.577  1.00 17.25           C  
+ATOM   2775  O   ARG A 369      33.120  -3.448   7.479  1.00 17.27           O  
+ATOM   2776  CB  ARG A 369      33.688  -6.189   7.438  1.00 18.97           C  
+ATOM   2777  CG  ARG A 369      32.243  -6.568   7.168  1.00 19.90           C  
+ATOM   2778  CD  ARG A 369      32.098  -7.371   5.877  1.00 22.91           C  
+ATOM   2779  NE  ARG A 369      30.703  -7.749   5.660  1.00 25.80           N  
+ATOM   2780  CZ  ARG A 369      29.756  -6.909   5.250  1.00 28.33           C  
+ATOM   2781  NH1 ARG A 369      30.057  -5.639   4.997  1.00 26.41           N  
+ATOM   2782  NH2 ARG A 369      28.503  -7.329   5.125  1.00 26.69           N  
+ATOM   2783  N   PHE A 370      32.797  -3.443   9.703  1.00 17.90           N  
+ATOM   2784  CA  PHE A 370      32.133  -2.146   9.698  1.00 18.14           C  
+ATOM   2785  C   PHE A 370      33.066  -1.007   9.296  1.00 18.31           C  
+ATOM   2786  O   PHE A 370      32.692  -0.130   8.514  1.00 18.50           O  
+ATOM   2787  CB  PHE A 370      31.541  -1.855  11.071  1.00 18.52           C  
+ATOM   2788  CG  PHE A 370      30.919  -0.496  11.179  1.00 20.16           C  
+ATOM   2789  CD1 PHE A 370      29.882  -0.123  10.333  1.00 19.42           C  
+ATOM   2790  CD2 PHE A 370      31.362   0.410  12.134  1.00 21.29           C  
+ATOM   2791  CE1 PHE A 370      29.299   1.130  10.436  1.00 19.42           C  
+ATOM   2792  CE2 PHE A 370      30.782   1.666  12.242  1.00 20.63           C  
+ATOM   2793  CZ  PHE A 370      29.751   2.024  11.392  1.00 18.71           C  
+ATOM   2794  N   SER A 371      34.278  -1.014   9.835  1.00 19.67           N  
+ATOM   2795  CA  SER A 371      35.235   0.029   9.507  1.00 20.64           C  
+ATOM   2796  C   SER A 371      35.410   0.077   7.999  1.00 21.24           C  
+ATOM   2797  O   SER A 371      35.421   1.152   7.404  1.00 20.61           O  
+ATOM   2798  CB  SER A 371      36.580  -0.239  10.181  1.00 23.38           C  
+ATOM   2799  OG  SER A 371      37.541   0.711   9.760  1.00 27.53           O  
+ATOM   2800  N   GLN A 372      35.535  -1.093   7.380  1.00 21.78           N  
+ATOM   2801  CA  GLN A 372      35.697  -1.157   5.937  1.00 22.37           C  
+ATOM   2802  C   GLN A 372      34.422  -0.643   5.268  1.00 20.69           C  
+ATOM   2803  O   GLN A 372      34.485   0.135   4.315  1.00 18.76           O  
+ATOM   2804  CB  GLN A 372      35.979  -2.591   5.482  1.00 22.69           C  
+ATOM   2805  CG  GLN A 372      36.204  -2.708   3.979  1.00 27.50           C  
+ATOM   2806  CD  GLN A 372      37.410  -1.910   3.500  1.00 32.26           C  
+ATOM   2807  OE1 GLN A 372      37.358  -1.241   2.465  1.00 33.21           O  
+ATOM   2808  NE2 GLN A 372      38.509  -1.987   4.249  1.00 31.17           N  
+ATOM   2809  N   PHE A 373      33.268  -1.078   5.766  1.00 20.31           N  
+ATOM   2810  CA  PHE A 373      32.002  -0.622   5.197  1.00 20.77           C  
+ATOM   2811  C   PHE A 373      31.942   0.903   5.205  1.00 19.66           C  
+ATOM   2812  O   PHE A 373      31.566   1.523   4.210  1.00 18.20           O  
+ATOM   2813  CB  PHE A 373      30.800  -1.154   5.985  1.00 20.49           C  
+ATOM   2814  CG  PHE A 373      29.498  -0.497   5.597  1.00 20.24           C  
+ATOM   2815  CD1 PHE A 373      28.898  -0.781   4.374  1.00 19.25           C  
+ATOM   2816  CD2 PHE A 373      28.917   0.466   6.419  1.00 20.33           C  
+ATOM   2817  CE1 PHE A 373      27.741  -0.110   3.974  1.00 21.78           C  
+ATOM   2818  CE2 PHE A 373      27.759   1.142   6.028  1.00 21.13           C  
+ATOM   2819  CZ  PHE A 373      27.170   0.856   4.805  1.00 18.56           C  
+ATOM   2820  N   ALA A 374      32.309   1.499   6.337  1.00 20.83           N  
+ATOM   2821  CA  ALA A 374      32.291   2.951   6.479  1.00 21.42           C  
+ATOM   2822  C   ALA A 374      33.179   3.617   5.436  1.00 23.32           C  
+ATOM   2823  O   ALA A 374      32.792   4.620   4.827  1.00 20.80           O  
+ATOM   2824  CB  ALA A 374      32.738   3.349   7.884  1.00 22.90           C  
+ATOM   2825  N   GLN A 375      34.370   3.057   5.233  1.00 23.17           N  
+ATOM   2826  CA  GLN A 375      35.310   3.593   4.256  1.00 24.54           C  
+ATOM   2827  C   GLN A 375      34.712   3.484   2.861  1.00 23.64           C  
+ATOM   2828  O   GLN A 375      34.742   4.440   2.085  1.00 23.18           O  
+ATOM   2829  CB  GLN A 375      36.631   2.823   4.294  1.00 26.69           C  
+ATOM   2830  CG  GLN A 375      37.617   3.262   3.217  1.00 31.91           C  
+ATOM   2831  CD  GLN A 375      38.810   2.330   3.095  1.00 37.26           C  
+ATOM   2832  OE1 GLN A 375      39.522   2.083   4.072  1.00 38.87           O  
+ATOM   2833  NE2 GLN A 375      39.036   1.806   1.888  1.00 38.79           N  
+ATOM   2834  N   ASP A 376      34.181   2.307   2.544  1.00 22.39           N  
+ATOM   2835  CA  ASP A 376      33.565   2.081   1.244  1.00 23.65           C  
+ATOM   2836  C   ASP A 376      32.377   3.019   1.058  1.00 23.86           C  
+ATOM   2837  O   ASP A 376      32.210   3.633   0.002  1.00 23.44           O  
+ATOM   2838  CB  ASP A 376      33.095   0.628   1.117  1.00 23.31           C  
+ATOM   2839  CG  ASP A 376      34.237  -0.369   1.222  1.00 25.61           C  
+ATOM   2840  OD1 ASP A 376      35.391   0.033   0.979  1.00 20.12           O  
+ATOM   2841  OD2 ASP A 376      33.978  -1.556   1.534  1.00 25.81           O  
+ATOM   2842  N   PHE A 377      31.551   3.131   2.093  1.00 22.82           N  
+ATOM   2843  CA  PHE A 377      30.384   3.999   2.023  1.00 22.45           C  
+ATOM   2844  C   PHE A 377      30.777   5.429   1.674  1.00 22.20           C  
+ATOM   2845  O   PHE A 377      30.237   6.011   0.734  1.00 20.66           O  
+ATOM   2846  CB  PHE A 377      29.624   3.995   3.353  1.00 19.31           C  
+ATOM   2847  CG  PHE A 377      28.566   5.051   3.440  1.00 19.16           C  
+ATOM   2848  CD1 PHE A 377      27.358   4.904   2.765  1.00 19.81           C  
+ATOM   2849  CD2 PHE A 377      28.792   6.216   4.171  1.00 20.20           C  
+ATOM   2850  CE1 PHE A 377      26.385   5.905   2.813  1.00 19.72           C  
+ATOM   2851  CE2 PHE A 377      27.831   7.222   4.226  1.00 20.36           C  
+ATOM   2852  CZ  PHE A 377      26.621   7.065   3.544  1.00 20.16           C  
+ATOM   2853  N   ARG A 378      31.723   5.988   2.425  1.00 22.39           N  
+ATOM   2854  CA  ARG A 378      32.154   7.359   2.192  1.00 24.39           C  
+ATOM   2855  C   ARG A 378      32.780   7.607   0.828  1.00 24.66           C  
+ATOM   2856  O   ARG A 378      32.496   8.625   0.189  1.00 25.52           O  
+ATOM   2857  CB  ARG A 378      33.122   7.810   3.285  1.00 25.85           C  
+ATOM   2858  CG  ARG A 378      32.520   7.747   4.673  1.00 30.09           C  
+ATOM   2859  CD  ARG A 378      33.237   8.676   5.628  1.00 32.50           C  
+ATOM   2860  NE  ARG A 378      32.720   8.545   6.985  1.00 34.77           N  
+ATOM   2861  CZ  ARG A 378      33.056   7.571   7.823  1.00 35.00           C  
+ATOM   2862  NH1 ARG A 378      33.916   6.633   7.452  1.00 36.92           N  
+ATOM   2863  NH2 ARG A 378      32.531   7.537   9.033  1.00 36.39           N  
+ATOM   2864  N   ALA A 379      33.628   6.688   0.381  1.00 23.45           N  
+ATOM   2865  CA  ALA A 379      34.281   6.844  -0.911  1.00 24.81           C  
+ATOM   2866  C   ALA A 379      33.239   7.016  -2.009  1.00 25.56           C  
+ATOM   2867  O   ALA A 379      33.352   7.907  -2.854  1.00 27.07           O  
+ATOM   2868  CB  ALA A 379      35.166   5.630  -1.211  1.00 25.93           C  
+ATOM   2869  N   ARG A 380      32.218   6.168  -1.985  1.00 23.67           N  
+ATOM   2870  CA  ARG A 380      31.175   6.228  -2.992  1.00 24.90           C  
+ATOM   2871  C   ARG A 380      30.171   7.354  -2.759  1.00 24.45           C  
+ATOM   2872  O   ARG A 380      29.819   8.081  -3.687  1.00 25.03           O  
+ATOM   2873  CB  ARG A 380      30.442   4.888  -3.065  1.00 26.61           C  
+ATOM   2874  CG  ARG A 380      30.302   4.377  -4.485  1.00 30.46           C  
+ATOM   2875  CD  ARG A 380      28.855   4.203  -4.910  1.00 30.51           C  
+ATOM   2876  NE  ARG A 380      28.365   2.865  -4.616  1.00 32.39           N  
+ATOM   2877  CZ  ARG A 380      27.243   2.349  -5.107  1.00 30.23           C  
+ATOM   2878  NH1 ARG A 380      26.474   3.055  -5.925  1.00 28.44           N  
+ATOM   2879  NH2 ARG A 380      26.897   1.114  -4.783  1.00 31.03           N  
+ATOM   2880  N   TYR A 381      29.724   7.507  -1.519  1.00 23.68           N  
+ATOM   2881  CA  TYR A 381      28.749   8.537  -1.189  1.00 24.91           C  
+ATOM   2882  C   TYR A 381      29.230   9.957  -1.486  1.00 28.19           C  
+ATOM   2883  O   TYR A 381      28.428  10.819  -1.846  1.00 27.39           O  
+ATOM   2884  CB  TYR A 381      28.365   8.447   0.289  1.00 21.86           C  
+ATOM   2885  CG  TYR A 381      27.085   9.174   0.630  1.00 20.69           C  
+ATOM   2886  CD1 TYR A 381      25.851   8.668   0.230  1.00 21.08           C  
+ATOM   2887  CD2 TYR A 381      27.103  10.353   1.377  1.00 19.44           C  
+ATOM   2888  CE1 TYR A 381      24.662   9.311   0.570  1.00 20.47           C  
+ATOM   2889  CE2 TYR A 381      25.921  11.005   1.721  1.00 18.95           C  
+ATOM   2890  CZ  TYR A 381      24.702  10.475   1.316  1.00 19.30           C  
+ATOM   2891  OH  TYR A 381      23.522  11.087   1.674  1.00 18.51           O  
+ATOM   2892  N   PHE A 382      30.530  10.201  -1.323  1.00 29.43           N  
+ATOM   2893  CA  PHE A 382      31.096  11.529  -1.557  1.00 31.08           C  
+ATOM   2894  C   PHE A 382      32.014  11.601  -2.776  1.00 31.90           C  
+ATOM   2895  O   PHE A 382      31.887  10.815  -3.714  1.00 34.27           O  
+ATOM   2896  CB  PHE A 382      31.869  11.987  -0.321  1.00 31.41           C  
+ATOM   2897  CG  PHE A 382      31.028  12.094   0.916  1.00 33.60           C  
+ATOM   2898  CD1 PHE A 382      30.024  13.055   1.009  1.00 34.24           C  
+ATOM   2899  CD2 PHE A 382      31.241  11.238   1.991  1.00 32.63           C  
+ATOM   2900  CE1 PHE A 382      29.246  13.162   2.153  1.00 33.85           C  
+ATOM   2901  CE2 PHE A 382      30.470  11.337   3.138  1.00 33.97           C  
+ATOM   2902  CZ  PHE A 382      29.468  12.303   3.219  1.00 35.76           C  
+TER    2903      PHE A 382                                                      
+HETATM 2904 ZN    ZN A 400      14.228   2.977  -3.434  1.00 17.69          ZN  
+HETATM 2920  O   HOH A1000       9.321  -0.042  -0.152  1.00 15.55           O  
+HETATM 2921  O   HOH A1001       1.522   4.238   2.267  1.00  8.05           O  
+HETATM 2922  O   HOH A1002       1.233  -1.766  12.941  1.00 17.41           O  
+HETATM 2923  O   HOH A1003       2.483   4.221  29.806  1.00 19.97           O  
+HETATM 2924  O   HOH A1004       4.680   5.532  -0.809  1.00 12.37           O  
+HETATM 2925  O   HOH A1005      13.684   1.263  13.363  1.00 12.19           O  
+HETATM 2926  O   HOH A1006      -0.868  12.472  -6.480  1.00 14.04           O  
+HETATM 2927  O   HOH A1007       7.690  -2.455  26.853  1.00 12.96           O  
+HETATM 2928  O   HOH A1008      15.677  -0.931  13.991  1.00 16.17           O  
+HETATM 2929  O   HOH A1009      -1.733   1.377   0.538  1.00 17.20           O  
+HETATM 2930  O   HOH A1010      36.202  12.965  15.500  1.00 23.09           O  
+HETATM 2931  O   HOH A1011       1.618   7.372   9.285  1.00 17.74           O  
+HETATM 2932  O   HOH A1012      -3.067   2.492  21.534  1.00 16.03           O  
+HETATM 2933  O   HOH A1013       9.475  13.652 -16.531  1.00 13.99           O  
+HETATM 2934  O   HOH A1014      34.661   2.598  16.359  1.00 20.68           O  
+HETATM 2935  O   HOH A1015      -1.285   0.861   7.520  1.00 19.29           O  
+HETATM 2936  O   HOH A1016       0.582   6.541 -10.731  1.00 12.60           O  
+HETATM 2937  O   HOH A1017      27.880   4.764  -0.614  1.00 18.44           O  
+HETATM 2938  O   HOH A1018      23.688  -0.809  18.400  1.00 18.48           O  
+HETATM 2939  O   HOH A1019       7.769   5.325 -14.030  1.00 15.03           O  
+HETATM 2940  O   HOH A1020      28.994  26.034  23.315  1.00 26.29           O  
+HETATM 2941  O   HOH A1021       6.741  -1.967  24.171  1.00 16.67           O  
+HETATM 2942  O   HOH A1022      -0.726   3.774  22.562  1.00 19.91           O  
+HETATM 2943  O   HOH A1023      28.174  25.108  38.091  1.00 21.74           O  
+HETATM 2944  O   HOH A1024      -2.939   5.672  26.233  1.00 23.50           O  
+HETATM 2945  O   HOH A1025      16.832  13.217 -18.404  1.00 24.39           O  
+HETATM 2946  O   HOH A1026       4.987  -0.215  -0.271  1.00 18.88           O  
+HETATM 2947  O   HOH A1027      12.404   4.947  -8.106  1.00 14.15           O  
+HETATM 2948  O   HOH A1028      16.021  16.108  31.993  1.00 20.01           O  
+HETATM 2949  O   HOH A1029      17.024  -0.262  -7.489  1.00 18.79           O  
+HETATM 2950  O   HOH A1030       2.628   6.049   0.663  1.00 14.49           O  
+HETATM 2951  O   HOH A1031      13.585  23.633 -15.424  1.00 23.50           O  
+HETATM 2952  O   HOH A1032      29.537   4.094  26.724  1.00 22.06           O  
+HETATM 2953  O   HOH A1033      16.703   0.634  11.773  1.00 15.94           O  
+HETATM 2954  O   HOH A1034      24.005  13.379   3.170  1.00 26.65           O  
+HETATM 2955  O   HOH A1035      11.793  10.323   8.429  1.00 28.72           O  
+HETATM 2956  O   HOH A1036      13.637  20.977  39.612  1.00 26.08           O  
+HETATM 2957  O   HOH A1037       4.145  -4.112   6.479  1.00 22.03           O  
+HETATM 2958  O   HOH A1038      21.611  15.633  20.043  1.00 23.88           O  
+HETATM 2959  O   HOH A1039      10.487   0.744  35.153  1.00 20.57           O  
+HETATM 2960  O   HOH A1040       4.870  16.740  -4.018  1.00 21.43           O  
+HETATM 2961  O   HOH A1041       2.967   0.030   1.392  1.00 23.90           O  
+HETATM 2962  O   HOH A1042       3.640  12.623  35.563  1.00 20.67           O  
+HETATM 2963  O   HOH A1043      12.631   1.853  34.230  1.00 19.76           O  
+HETATM 2964  O   HOH A1044       9.329  -7.582  16.970  1.00 26.56           O  
+HETATM 2965  O   HOH A1045       4.473  -0.291  26.447  1.00 23.46           O  
+HETATM 2966  O   HOH A1046      17.856  14.309  31.039  1.00 24.27           O  
+HETATM 2967  O   HOH A1047      11.798   2.745 -15.831  1.00 20.36           O  
+HETATM 2968  O   HOH A1048       4.463   5.737  28.769  1.00 19.20           O  
+HETATM 2969  O   HOH A1049       3.592  -3.315  12.652  1.00 30.87           O  
+HETATM 2970  O   HOH A1051      37.492   7.648  23.545  1.00 40.72           O  
+HETATM 2971  O   HOH A1052      20.078  -6.524  15.375  1.00 28.00           O  
+HETATM 2972  O   HOH A1053      31.559  12.093  -5.931  1.00 31.34           O  
+HETATM 2973  O   HOH A1055      32.810   7.825  21.187  1.00 19.84           O  
+HETATM 2974  O   HOH A1056      31.151   1.938  22.594  1.00 22.21           O  
+HETATM 2975  O   HOH A1057      -2.842  17.850  25.433  1.00 25.48           O  
+HETATM 2976  O   HOH A1058      22.332  25.062  38.959  1.00 29.23           O  
+HETATM 2977  O   HOH A1059      17.085   6.537 -18.896  1.00 27.64           O  
+HETATM 2978  O   HOH A1060      10.474  -4.247  34.233  1.00 24.13           O  
+HETATM 2979  O   HOH A1061      23.434   2.676  -6.355  1.00 26.36           O  
+HETATM 2980  O   HOH A1062      36.422  -3.628   9.030  1.00 38.14           O  
+HETATM 2981  O   HOH A1063       8.639  14.418  39.714  1.00 22.56           O  
+HETATM 2982  O   HOH A1064      26.412  17.440  10.957  1.00 34.38           O  
+HETATM 2983  O   HOH A1065      32.079  -2.614   2.494  1.00 24.48           O  
+HETATM 2984  O   HOH A1066      33.872   9.028  11.078  1.00 32.38           O  
+HETATM 2985  O   HOH A1067      27.114   1.713  17.963  1.00 19.01           O  
+HETATM 2986  O   HOH A1068      19.924  -6.705  11.398  1.00 17.33           O  
+HETATM 2987  O   HOH A1069      -2.007   5.312  28.665  1.00 31.20           O  
+HETATM 2988  O   HOH A1070      32.349  20.331  10.471  1.00 31.44           O  
+HETATM 2989  O   HOH A1071      -1.891  15.542  -5.455  1.00 23.21           O  
+HETATM 2990  O   HOH A1072      -4.173  -0.010   3.946  1.00 20.93           O  
+HETATM 2991  O   HOH A1073      -5.626   4.843  26.288  1.00 24.85           O  
+HETATM 2992  O   HOH A1074      22.927  -1.913  -1.880  1.00 35.49           O  
+HETATM 2993  O   HOH A1075      25.789  24.058  22.887  1.00 27.00           O  
+HETATM 2994  O   HOH A1076       6.922  12.708   9.304  1.00 32.27           O  
+HETATM 2995  O   HOH A1077      19.424   4.254 -10.553  1.00 23.21           O  
+HETATM 2996  O   HOH A1078      36.495   6.316   2.403  1.00 26.97           O  
+HETATM 2997  O   HOH A1079      23.245  -4.918  27.988  1.00 28.84           O  
+HETATM 2998  O   HOH A1080       9.399  -3.677  16.364  1.00 18.62           O  
+HETATM 2999  O   HOH A1081      17.508  -7.669  23.708  1.00 20.96           O  
+HETATM 3000  O   HOH A1082      17.449  -8.215  10.596  1.00 32.72           O  
+HETATM 3001  O   HOH A1083      15.275  17.146  41.025  1.00 28.68           O  
+HETATM 3002  O   HOH A1084      12.170  -6.600  12.474  1.00 29.07           O  
+HETATM 3003  O   HOH A1085      20.664  16.617  -8.228  1.00 31.46           O  
+HETATM 3004  O   HOH A1086      24.352  22.105  28.729  1.00 24.83           O  
+HETATM 3005  O   HOH A1088       2.420   5.281  43.188  1.00 47.15           O  
+HETATM 3006  O   HOH A1089       6.367  -7.117  10.066  1.00 30.86           O  
+HETATM 3007  O   HOH A1090      36.070   7.891  18.870  1.00 26.47           O  
+HETATM 3008  O   HOH A1091      22.373   2.600  33.781  1.00 26.41           O  
+HETATM 3009  O   HOH A1092      -0.584   3.141  36.888  1.00 31.30           O  
+HETATM 3010  O   HOH A1093      22.738  -7.615  11.601  1.00 40.31           O  
+HETATM 3011  O   HOH A1094      21.706   4.609  -8.718  1.00 31.61           O  
+HETATM 3012  O   HOH A1095       6.312  18.828  -4.894  1.00 33.07           O  
+HETATM 3013  O   HOH A1099      32.988  23.933  31.026  1.00 31.19           O  
+HETATM 3014  O   HOH A1100      33.941   0.832  14.637  1.00 22.96           O  
+HETATM 3015  O   HOH A1101      -7.147  16.500  24.860  1.00 29.38           O  
+HETATM 3016  O   HOH A1104      19.675   1.918  34.640  1.00 36.88           O  
+HETATM 3017  O   HOH A1105      -0.859  18.548 -10.806  1.00 27.96           O  
+HETATM 3018  O   HOH A1106      24.032  20.632  25.623  1.00 24.09           O  
+HETATM 3019  O   HOH A1107      37.272  14.839  21.425  1.00 26.07           O  
+HETATM 3020  O   HOH A1108     -10.260   2.661  20.762  1.00 32.72           O  
+HETATM 3021  O   HOH A1109      24.911  -9.800  15.419  1.00 29.12           O  
+HETATM 3022  O   HOH A1110      28.961   7.848  35.920  1.00 48.49           O  
+HETATM 3023  O   HOH A1111      31.572  -9.209  18.441  1.00 32.53           O  
+HETATM 3024  O   HOH A1112      35.093  -3.080  21.087  1.00 32.74           O  
+HETATM 3025  O   HOH A1113      29.860   7.656  -6.379  1.00 38.68           O  
+HETATM 3026  O   HOH A1114      -2.197  -0.215  16.541  1.00 22.68           O  
+HETATM 3027  O   HOH A1115      17.138  -1.081  32.165  1.00 38.66           O  
+HETATM 3028  O   HOH A1117      -1.306  -2.087  13.157  1.00 47.74           O  
+HETATM 3029  O   HOH A1118      36.544  12.134  29.133  1.00 28.99           O  
+HETATM 3030  O   HOH A1119      16.018  -3.881   7.326  1.00 25.56           O  
+HETATM 3031  O   HOH A1121      19.882  11.744 -15.300  1.00 28.43           O  
+HETATM 3032  O   HOH A1122       7.851  -4.663  34.091  1.00 30.43           O  
+HETATM 3033  O   HOH A1123      32.453  -4.204   4.921  1.00 36.61           O  
+HETATM 3034  O   HOH A1124       0.000  20.717  29.307  1.00 32.54           O  
+HETATM 3035  O   HOH A1126      29.980   1.493  31.207  1.00 35.02           O  
+HETATM 3036  O   HOH A1127      25.716 -10.104   4.774  1.00 34.92           O  
+HETATM 3037  O   HOH A1129      36.204  11.432  11.805  1.00 37.61           O  
+HETATM 3038  O   HOH A1130       2.647  -3.909  -4.024  1.00 55.03           O  
+HETATM 3039  O   HOH A1131       9.944  -5.077   7.696  1.00 32.07           O  
+HETATM 3040  O   HOH A1134      16.033   2.325  34.444  1.00 34.66           O  
+HETATM 3041  O   HOH A1135      27.466  13.364  -1.503  1.00 37.24           O  
+HETATM 3042  O   HOH A1136       6.987  17.183 -15.654  1.00 37.20           O  
+HETATM 3043  O   HOH A1137      27.397   7.915  38.742  1.00 29.15           O  
+HETATM 3044  O   HOH A1139      19.976  -7.278  28.585  1.00 39.02           O  
+HETATM 3045  O   HOH A1141      31.151  31.163  30.756  1.00 38.52           O  
+HETATM 3046  O   HOH A1144      21.902  18.928  38.760  1.00 36.46           O  
+HETATM 3047  O   HOH A1146       1.050  -6.348  13.049  1.00 43.59           O  
+HETATM 3048  O   HOH A1147      32.381  11.627   7.923  1.00 41.34           O  
+HETATM 3049  O   HOH A1148       4.682  19.862  38.109  1.00 32.55           O  
+HETATM 3050  O   HOH A1150      22.101   8.624 -14.450  1.00 45.12           O  
+HETATM 3051  O   HOH A1151      -2.568  16.296  35.758  1.00 52.32           O  
+HETATM 3052  O   HOH A1155      20.786  -8.972  20.331  1.00 31.38           O  
+HETATM 3053  O   HOH A1159      20.415  -0.849  -1.344  1.00 38.50           O  
+HETATM 3054  O   HOH A1160       3.643  12.546  16.723  1.00 28.27           O  
+HETATM 3055  O   HOH A1161       0.970  -3.159  39.849  1.00 45.85           O  
+HETATM 3056  O   HOH A1162      35.743   8.894  -3.516  1.00 43.60           O  
+HETATM 3057  O   HOH A1168       8.123  35.610  36.827  1.00 50.10           O  
+HETATM 3058  O   HOH A1169      -4.911  14.191  32.288  1.00 33.34           O  
+HETATM 3059  O   HOH A1200       8.777  16.156 -17.097  1.00 17.79           O  
+HETATM 3060  O   HOH A1201      32.547   9.799  -5.698  1.00 34.06           O  
+HETATM 3061  O   HOH A1202       0.907  -0.945  10.591  1.00 31.94           O  
+HETATM 3062  O   HOH A1203      16.310  -2.810   5.004  1.00 26.69           O  
+HETATM 3063  O   HOH A1204       2.448  -2.038  26.230  1.00 35.50           O  
+HETATM 3064  O   HOH A1205      -2.061   3.243  25.115  1.00 23.04           O  
+HETATM 3065  O   HOH A1206      28.541   1.811  -0.489  1.00 29.93           O  
+HETATM 3066  O   HOH A1207      -1.826  -1.270  18.909  1.00 33.68           O  
+HETATM 3067  O   HOH A1208      13.740  15.970  43.073  1.00 33.50           O  
+HETATM 3068  O   HOH A1209       6.177  13.143  40.211  1.00 21.24           O  
+HETATM 3069  O   HOH A1210      28.446  33.589  30.364  1.00 36.10           O  
+HETATM 3070  O   HOH A1211      15.907  -1.682   9.524  1.00 24.77           O  
+HETATM 3071  O   HOH A1213      23.309 -10.882  13.015  1.00 30.45           O  
+HETATM 3072  O   HOH A1214      20.855 -10.102  17.921  1.00 28.89           O  
+HETATM 3073  O   HOH A1215      31.730  -1.721  20.974  1.00 33.31           O  
+HETATM 3074  O   HOH A1216      36.656   7.150   4.832  1.00 32.68           O  
+HETATM 3075  O   HOH A1217      -2.421  -0.298  21.465  1.00 31.59           O  
+HETATM 3076  O   HOH A1218      19.744   1.895 -11.981  1.00 31.69           O  
+HETATM 3077  O   HOH A1219      13.372  19.495  12.345  1.00 40.96           O  
+HETATM 3078  O   HOH A1220      20.812  25.647  36.965  1.00 25.17           O  
+HETATM 3079  O   HOH A1221      36.129  20.314  29.847  1.00 40.42           O  
+HETATM 3080  O   HOH A1222      16.747  -3.511  31.779  1.00 34.18           O  
+HETATM 3081  O   HOH A1223      12.247   1.386 -11.740  1.00 34.21           O  
+HETATM 3082  O   HOH A1224      13.782  -2.040  -5.916  1.00 35.74           O  
+HETATM 3083  O   HOH A1225       8.422  -2.885   0.164  1.00 30.62           O  
+HETATM 3084  O   HOH A1226      10.817   1.956  37.782  1.00 24.26           O  
+HETATM 3085  O   HOH A1227      38.105  16.425  15.576  1.00 45.72           O  
+HETATM 3086  O   HOH A1228      21.911  12.380  40.184  1.00 33.18           O  
+HETATM 3087  O   HOH A1229      34.231  -5.842   3.557  1.00 27.17           O  
+HETATM 3088  O   HOH A1230      36.361  20.087  15.625  1.00 36.42           O  
+HETATM 3089  O   HOH A1231      17.109  -4.182  -6.466  1.00 43.56           O  
+HETATM 3090  O   HOH A1232      25.147  26.722  38.427  1.00 30.69           O  
+HETATM 3091  O   HOH A1233       3.504   9.989  38.558  1.00 27.22           O  
+HETATM 3092  O   HOH A1234      32.433  21.648  13.212  1.00 39.34           O  
+HETATM 3093  O   HOH A1236       9.078  16.652  13.678  1.00 30.66           O  
+HETATM 3094  O   HOH A1237      25.993 -13.191  18.174  1.00 37.42           O  
+HETATM 3095  O   HOH A1238      12.046  14.403  41.675  1.00 38.76           O  
+HETATM 3096  O   HOH A1239      -1.822   5.225  35.087  1.00 39.10           O  
+HETATM 3097  O   HOH A1240      27.344  14.567  38.228  1.00 33.91           O  
+HETATM 3098  O   HOH A1241       9.019   5.161  43.530  1.00 43.13           O  
+HETATM 3099  O   HOH A1242      13.897   4.109  39.107  1.00 37.79           O  
+HETATM 3100  O   HOH A1243      29.125  19.783   8.869  1.00 31.17           O  
+HETATM 3101  O   HOH A1244       2.521  -3.887   8.861  1.00 42.65           O  
+HETATM 3102  O   HOH A1245      16.733   3.968  38.331  1.00 33.45           O  
+HETATM 3103  O   HOH A1246      24.798  -6.568  26.449  1.00 44.98           O  
+HETATM 3104  O   HOH A1248      -1.655  20.912  27.324  1.00 37.73           O  
+HETATM 3105  O   HOH A1249       4.217  22.890  -8.514  1.00 37.66           O  
+HETATM 3106  O   HOH A1250      18.524  -5.017  -2.129  1.00 50.28           O  
+HETATM 3107  O   HOH A1251      25.159  12.316  -6.145  1.00 42.24           O  
+HETATM 3108  O   HOH A1252      10.430  18.444 -16.651  1.00 27.93           O  
+HETATM 3109  O   HOH A1253       6.755  -4.462  -3.930  1.00 41.99           O  
+HETATM 3110  O   HOH A1256      27.708  -0.331  31.661  1.00 33.00           O  
+HETATM 3111  O   HOH A1257       3.625  -6.293  15.729  1.00 37.11           O  
+HETATM 3112  O   HOH A1258      22.910   3.248 -12.527  1.00 36.54           O  
+HETATM 3113  O   HOH A1259      -8.195  10.993  28.848  1.00 44.13           O  
+HETATM 3114  O   HOH A1261      32.524  18.386  38.455  1.00 49.71           O  
+HETATM 3115  O   HOH A1262      22.195  -5.112   2.736  1.00 35.07           O  
+HETATM 3116  O   HOH A1264      25.267 -12.496   8.394  1.00 60.38           O  
+HETATM 3117  O   HOH A1267      -3.502   4.845  33.107  1.00 36.99           O  
+HETATM 3118  O   HOH A1268      26.014  14.950   0.866  1.00 39.82           O  
+HETATM 3119  O   HOH A1269      39.919  -2.105  11.520  1.00 53.95           O  
+HETATM 3120  O   HOH A1273      -1.966  -0.146  10.103  1.00 39.21           O  
+HETATM 3121  O   HOH A1274      33.996   0.305  23.158  1.00 44.70           O  
+HETATM 3122  O   HOH A1275      35.448  21.461  24.416  1.00 39.97           O  
+HETATM 3123  O   HOH A1276      14.950   8.463 -21.801  1.00 38.83           O  
+HETATM 3124  O   HOH A1277      19.828  -1.728  34.889  1.00 40.99           O  
+HETATM 3125  O   HOH A1278      37.609   4.668  18.709  1.00 47.48           O  
+HETATM 3126  O   HOH A1279      13.784  -5.183   1.902  1.00 42.83           O  
+HETATM 3127  O   HOH A1300      25.889  12.455   4.965  1.00 18.45           O  
+HETATM 3128  O   HOH A1301      27.119  -0.328  -0.085  1.00 34.09           O  
+HETATM 3129  O   HOH A1303       7.840  17.439  20.938  1.00 22.48           O  
+HETATM 3130  O   HOH A1305      31.535   4.955  23.230  1.00 36.09           O  
+HETATM 3131  O   HOH A1306      22.497  -6.982  14.417  1.00 31.25           O  
+HETATM 3132  O   HOH A1308       4.543  -2.311  -2.167  1.00 39.44           O  
+HETATM 3133  O   HOH A1309       2.756   2.543  27.593  1.00 42.04           O  
+HETATM 3134  O   HOH A1310      16.555 -10.327  26.509  1.00 50.32           O  
+HETATM 3135  O   HOH A1311      12.982  22.243  -3.598  1.00 38.98           O  
+HETATM 3136  O   HOH A1312       4.772  -4.119   1.512  1.00 29.25           O  
+HETATM 3137  O   HOH A1316      15.210  -1.323  -9.140  1.00 34.57           O  
+HETATM 3138  O   HOH A1317       1.031   9.586  39.074  1.00 35.31           O  
+HETATM 3139  O   HOH A1319      35.058  22.037  13.394  1.00 43.47           O  
+HETATM 3140  O   HOH A1320      29.867 -10.755  20.134  1.00 39.99           O  
+HETATM 3141  O   HOH A1321      18.520  10.054 -18.780  1.00 45.04           O  
+HETATM 3142  O   HOH A1322      11.886   6.969  41.560  1.00 30.48           O  
+HETATM 3143  O   HOH A1323      28.051   6.558  33.132  1.00 41.92           O  
+HETATM 3144  O   HOH A1325      11.102  14.349 -25.385  1.00 29.80           O  
+HETATM 3145  O   HOH A1326      14.649  -0.935   3.411  1.00 31.71           O  
+HETATM 3146  O   HOH A1327      27.667   0.955  33.929  1.00 43.72           O  
+HETATM 3147  O   HOH A1328      22.519 -10.364  21.817  1.00 39.16           O  
+HETATM 3148  O   HOH A1329      18.406  -8.588  15.365  1.00 41.13           O  
+HETATM 3149  O   HOH A1330      27.263  -6.205  27.570  1.00 38.20           O  
+HETATM 3150  O   HOH A1332      12.527  19.887 -17.613  1.00 52.06           O  
+HETATM 3151  O   HOH A1333      13.824  15.097  13.926  1.00 41.50           O  
+HETATM 3152  O   HOH A1334      16.954  15.293 -20.773  1.00 48.59           O  
+HETATM 3153  O   HOH A1336      25.037  30.506  33.921  1.00 41.40           O  
+HETATM 3154  O   HOH A1339      33.351   2.628  -2.182  1.00 34.42           O  
+HETATM 3155  O   HOH A1340      19.814   7.768 -18.260  1.00 44.54           O  
+HETATM 3156  O   HOH A1341       8.340  23.224 -11.395  1.00 35.63           O  
+HETATM 3157  O   HOH A1343       1.763  -4.780  24.681  1.00 43.99           O  
+HETATM 3158  O   HOH A1344       2.703  -2.434   2.680  1.00 51.11           O  
+HETATM 3159  O   HOH A1346      29.723  16.616   0.195  1.00 33.47           O  
+HETATM 3160  O   HOH A1347      36.043  12.749  31.903  1.00 38.47           O  
+HETATM 3161  O   HOH A1348      21.502  15.105   3.137  1.00 53.37           O  
+HETATM 3162  O   HOH A1351      35.334  10.292  27.815  1.00 35.57           O  
+HETATM 3163  O   HOH A1354      35.945  15.503  14.276  1.00 40.90           O  
+HETATM 3164  O   HOH A1358       4.816  14.461  42.604  1.00 50.19           O  
+HETATM 3165  O   HOH A1359      40.481  14.459  29.013  1.00 55.57           O  
+HETATM 3166  O   HOH A1360      33.287  -0.413  25.663  1.00 49.92           O  
+HETATM 3167  O   HOH A1362      33.336  10.221  37.290  1.00 58.02           O  
+HETATM 3168  O   HOH A1364      18.129  -4.383   3.633  1.00 43.78           O  
+HETATM 3169  O   HOH A1365       1.143  18.585  35.910  1.00 32.53           O  
+HETATM 3170  O   HOH A1374       7.032  22.624 -13.579  1.00 56.35           O  
+HETATM 3171  O   HOH A1376      21.220  -5.202  30.249  1.00 59.34           O  
+HETATM 3172  O   HOH A1377      26.496   4.876  38.851  1.00 40.62           O  
+HETATM 3173  O   HOH A1400      19.715  18.802  19.939  1.00 34.18           O  
+HETATM 3174  O   HOH A1401      12.818  15.752  19.171  1.00 41.87           O  
+HETATM 3175  O   HOH A1402      14.839  14.036  18.435  1.00 31.20           O  
+HETATM 3176  O   HOH A1403      12.834  14.653  24.686  1.00 38.35           O  
+HETATM 3177  O   HOH A1404      11.155  17.746  22.938  1.00 24.69           O  
+HETATM 3178  O   HOH A1405      12.127  16.079  16.701  1.00 41.76           O  
+HETATM 3179  O   HOH A1500       9.930  20.957  -4.818  1.00 39.17           O  
+HETATM 3180  O   HOH A1501      -8.281   4.491  18.296  1.00 32.01           O  
+HETATM 3181  O   HOH A1502      20.194  21.390  29.658  1.00 38.20           O  
+HETATM 3182  O   HOH A1503      34.681   8.351  29.478  1.00 38.84           O  
+HETATM 3183  O   HOH A1504      17.854  -9.630   8.443  1.00 46.93           O  
+HETATM 3184  O   HOH A1505      14.372   0.727  35.945  1.00 33.80           O  
+HETATM 3185  O   HOH A1506      30.211  -8.708  22.010  1.00 35.78           O  
+HETATM 3186  O   HOH A1507      -3.191  24.726  28.755  1.00 51.56           O  
+HETATM 3187  O   HOH A1508      23.436 -12.641  20.878  1.00 46.25           O  
+HETATM 3188  O   HOH A1509      23.191   3.590  36.316  1.00 36.10           O  
+HETATM 3189  O   HOH A1511       8.692   8.107  42.504  1.00 33.50           O  
+HETATM 3190  O   HOH A1512       2.017  21.499  34.078  1.00 49.77           O  
+HETATM 3191  O   HOH A1513      27.178  -4.258   5.223  1.00 32.32           O  
+HETATM 3192  O   HOH A1514       6.064  28.184  15.338  1.00 42.88           O  
+HETATM 3193  O   HOH A1516      33.757   3.553  -4.967  1.00 47.63           O  
+HETATM 3194  O   HOH A1517      24.915   4.564  -9.803  1.00 41.80           O  
+HETATM 3195  O   HOH A1518      16.421  -1.663  34.927  1.00 42.84           O  
+HETATM 3196  O   HOH A1519     -12.120   1.460  19.135  1.00 44.79           O  
+HETATM 3197  O   HOH A1520      35.720  -3.354   0.524  1.00 47.21           O  
+HETATM 3198  O   HOH A1521       1.657  -7.407  17.749  1.00 47.33           O  
+HETATM 3199  O   HOH A1522      30.429  14.120  38.314  1.00 42.34           O  
+HETATM 3200  O   HOH A1525      30.246  14.537   5.225  1.00 42.14           O  
+HETATM 3201  O   HOH A1526      14.377  24.575  -2.027  1.00 36.91           O  
+CONECT 2367 2904                                                                
+CONECT 2383 2904                                                                
+CONECT 2401 2904                                                                
+CONECT 2612 2904                                                                
+CONECT 2904 2367 2383 2401 2612                                                 
+CONECT 2905 2906 2918                                                           
+CONECT 2906 2905 2907 2911                                                      
+CONECT 2907 2906 2908                                                           
+CONECT 2908 2907 2909                                                           
+CONECT 2909 2908 2910                                                           
+CONECT 2910 2909                                                                
+CONECT 2911 2906 2912                                                           
+CONECT 2912 2911 2913 2918                                                      
+CONECT 2913 2912 2914 2919                                                      
+CONECT 2914 2913 2915                                                           
+CONECT 2915 2914 2916                                                           
+CONECT 2916 2915 2917 2918                                                      
+CONECT 2917 2916                                                                
+CONECT 2918 2905 2912 2916                                                      
+CONECT 2919 2913                                                                
+MASTER      318    0    2   18   17    0    5    6 3200    1   20   30          
+END                                                                             
Binary file test-data/complex_system.pickle has changed
Binary file test-data/equil.chk has changed
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/ligand.mol	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,37 @@
+ligand.pdb
+ OpenBabel03242012003D
+
+ 15 16  0  0  1  0  0  0  0  0999 V2000
+   15.4350   16.8530   20.4090 N   0  0  0  0  0  0  0  0  0  0  0  0
+   16.5900   17.0760   19.8060 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.7440   17.0260   18.2840 C   0  0  0  0  0  0  0  0  0  0  0  0
+   15.6650   17.7690   17.4320 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.3420   18.3730   16.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
+   15.3430   19.1170   15.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
+   17.4900   17.3220   20.6050 N   0  0  0  0  0  0  0  0  0  0  0  0
+   17.0380   17.3010   21.9580 C   0  0  0  0  0  0  0  0  0  0  0  0
+   17.7020   17.5270   23.2770 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.8750   17.4100   24.4010 N   0  0  0  0  0  0  0  0  0  0  0  0
+   15.4120   17.0790   24.3150 N   0  0  0  0  0  0  0  0  0  0  0  0
+   14.7400   16.8560   23.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
+   13.5080   16.5760   23.0100 O   0  0  0  0  0  0  0  0  0  0  0  0
+   15.6460   16.9830   21.8390 C   0  0  1  0  0  0  0  0  0  0  0  0
+   18.9000   17.7960   23.3310 O   0  0  0  0  0  0  0  0  0  0  0  0
+  2  1  2  0  0  0  0
+  2  7  1  0  0  0  0
+  3  2  1  0  0  0  0
+  4  3  1  0  0  0  0
+  5  4  1  0  0  0  0
+  6  5  1  0  0  0  0
+  7  8  2  0  0  0  0
+  8  9  1  0  0  0  0
+  9 15  2  0  0  0  0
+  9 10  1  0  0  0  0
+ 11 10  2  0  0  0  0
+ 12 11  1  0  0  0  0
+ 13 12  2  0  0  0  0
+ 14  1  1  6  0  0  0
+ 14  8  1  0  0  0  0
+ 14 12  1  0  0  0  0
+M  END
+$$$$
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/ligand.pdb	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,28 @@
+COMPND    ligand.pdb
+HETATM    1  N1  UNL     1      15.435  16.853  20.409  1.00  0.00           N  
+HETATM    2  C1  UNL     1      16.590  17.076  19.806  1.00  0.00           C  
+HETATM    3  C2  UNL     1      16.744  17.026  18.284  1.00  0.00           C  
+HETATM    4  C3  UNL     1      15.665  17.769  17.432  1.00  0.00           C  
+HETATM    5  C4  UNL     1      16.342  18.373  16.158  1.00  0.00           C  
+HETATM    6  C5  UNL     1      15.343  19.117  15.238  1.00  0.00           C  
+HETATM    7  N2  UNL     1      17.490  17.322  20.605  1.00  0.00           N  
+HETATM    8  C6  UNL     1      17.038  17.301  21.958  1.00  0.00           C  
+HETATM    9  C7  UNL     1      17.702  17.527  23.277  1.00  0.00           C  
+HETATM   10  N3  UNL     1      16.875  17.410  24.401  1.00  0.00           N  
+HETATM   11  N4  UNL     1      15.412  17.079  24.315  1.00  0.00           N  
+HETATM   12  C8  UNL     1      14.740  16.856  23.098  1.00  0.00           C  
+HETATM   13  O1  UNL     1      13.508  16.576  23.010  1.00  0.00           O  
+HETATM   14  C9  UNL     1      15.646  16.983  21.839  1.00  0.00           C  
+HETATM   15  O2  UNL     1      18.900  17.796  23.331  1.00  0.00           O  
+CONECT    1    2    2   14
+CONECT    2    3    7
+CONECT    3    4
+CONECT    4    5
+CONECT    5    6
+CONECT    7    8    8
+CONECT    8    9   14
+CONECT    9   10   15   15
+CONECT   10   11   11
+CONECT   11   12
+CONECT   12   13   13   14
+END
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/ligand_wqb.mol	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,39 @@
+ligand.pdb
+ OpenBabel03242012003D
+
+ 15 16  0  0  1  0  0  0  0  0999 V2000
+   15.4350   16.8530   20.4090 N   0  0  0  0  0  0  0  0  0  0  0  0
+   16.5900   17.0760   19.8060 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.7440   17.0260   18.2840 C   0  0  0  0  0  0  0  0  0  0  0  0
+   15.6650   17.7690   17.4320 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.3420   18.3730   16.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
+   15.3430   19.1170   15.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
+   17.4900   17.3220   20.6050 N   0  0  0  0  0  0  0  0  0  0  0  0
+   17.0380   17.3010   21.9580 C   0  0  0  0  0  0  0  0  0  0  0  0
+   17.7020   17.5270   23.2770 C   0  0  0  0  0  0  0  0  0  0  0  0
+   16.8750   17.4100   24.4010 N   0  0  0  0  0  0  0  0  0  0  0  0
+   15.4120   17.0790   24.3150 N   0  0  0  0  0  0  0  0  0  0  0  0
+   14.7400   16.8560   23.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
+   13.5080   16.5760   23.0100 O   0  0  0  0  0  0  0  0  0  0  0  0
+   15.6460   16.9830   21.8390 C   0  0  1  0  0  0  0  0  0  0  0  0
+   18.9000   17.7960   23.3310 O   0  0  0  0  0  0  0  0  0  0  0  0
+  2  1  2  0  0  0  0
+  2  7  1  0  0  0  0
+  3  2  1  0  0  0  0
+  4  3  1  0  0  0  0
+  5  4  1  0  0  0  0
+  6  5  1  0  0  0  0
+  7  8  2  0  0  0  0
+  8  9  1  0  0  0  0
+  9 15  2  0  0  0  0
+  9 10  1  0  0  0  0
+ 11 10  2  0  0  0  0
+ 12 11  1  0  0  0  0
+ 13 12  2  0  0  0  0
+ 14  1  1  6  0  0  0
+ 14  8  1  0  0  0  0
+ 14 12  1  0  0  0  0
+M  END
+> <SCORE.DUCK_WQB>
+-0.015815293149895382
+$$$$
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/protein_out_prot.pdb	Thu Apr 16 08:25:46 2020 -0400
@@ -0,0 +1,142 @@
+ATOM      1 HH31 ACE     1      11.587  15.836  30.944  1.00  0.00
+ATOM      2  CH3 ACE     1      11.982  16.349  30.067  1.00  0.00
+ATOM      3 HH32 ACE     1      11.223  17.020  29.665  1.00  0.00
+ATOM      4 HH33 ACE     1      12.255  15.615  29.309  1.00  0.00
+ATOM      5  C   ACE     1      13.223  17.171  30.422  1.00  0.00
+ATOM      6  O   ACE     1      13.659  17.198  31.578  1.00  0.00
+ATOM      7  N   ASP     2      13.794  17.834  29.424  1.00  0.00
+ATOM      8  H   ASP     2      13.416  17.784  28.489  1.00  0.00
+ATOM      9  CA  ASP     2      15.000  18.614  29.639  1.00  0.00
+ATOM     10  HA  ASP     2      15.137  18.814  30.702  1.00  0.00
+ATOM     11  CB  ASP     2      16.212  17.830  29.129  1.00  0.00
+ATOM     12  HB2 ASP     2      17.106  18.364  29.452  1.00  0.00
+ATOM     13  HB3 ASP     2      16.196  16.840  29.585  1.00  0.00
+ATOM     14  CG  ASP     2      16.225  17.690  27.612  1.00  0.00
+ATOM     15  OD1 ASP     2      15.147  17.775  26.988  1.00  0.00
+ATOM     16  OD2 ASP     2      17.317  17.483  27.041  1.00  0.00
+ATOM     17  C   ASP     2      14.957  19.967  28.957  1.00  0.00
+ATOM     18  O   ASP     2      13.940  20.366  28.393  1.00  0.00
+ATOM     19  N   GLU     3      16.091  20.657  29.008  1.00  0.00
+ATOM     20  H   GLU     3      16.880  20.249  29.489  1.00  0.00
+ATOM     21  CA  GLU     3      16.253  21.976  28.408  1.00  0.00
+ATOM     22  HA  GLU     3      15.350  22.269  27.872  1.00  0.00
+ATOM     23  CB  GLU     3      16.513  22.995  29.523  1.00  0.00
+ATOM     24  HB2 GLU     3      15.593  23.045  30.105  1.00  0.00
+ATOM     25  HB3 GLU     3      17.308  22.572  30.137  1.00  0.00
+ATOM     26  CG  GLU     3      16.905  24.389  29.079  1.00  0.00
+ATOM     27  HG2 GLU     3      17.834  24.333  28.512  1.00  0.00
+ATOM     28  HG3 GLU     3      16.110  24.767  28.436  1.00  0.00
+ATOM     29  CD  GLU     3      17.089  25.326  30.261  1.00  0.00
+ATOM     30  OE1 GLU     3      16.075  25.734  30.868  1.00  0.00
+ATOM     31  OE2 GLU     3      18.252  25.643  30.595  1.00  0.00
+ATOM     32  C   GLU     3      17.442  21.903  27.445  1.00  0.00
+ATOM     33  O   GLU     3      18.591  21.823  27.880  1.00  0.00
+ATOM     34  N   CYS     4      17.163  21.906  26.143  1.00  0.00
+ATOM     35  H   CYS     4      16.202  21.930  25.832  1.00  0.00
+ATOM     36  CA  CYS     4      18.219  21.828  25.130  1.00  0.00
+ATOM     37  HA  CYS     4      18.903  21.014  25.369  1.00  0.00
+ATOM     38  CB  CYS     4      17.611  21.567  23.745  1.00  0.00
+ATOM     39  HB2 CYS     4      16.992  20.670  23.774  1.00  0.00
+ATOM     40  HB3 CYS     4      17.003  22.418  23.440  1.00  0.00
+ATOM     41  SG  CYS     4      18.818  21.304  22.408  1.00  0.00
+ATOM     42  HG  CYS     4      17.920  21.125  21.443  1.00  0.00
+ATOM     43  C   CYS     4      19.046  23.114  25.104  1.00  0.00
+ATOM     44  O   CYS     4      18.541  24.186  24.766  1.00  0.00
+ATOM     45  N   NME     5      20.321  22.991  25.461  1.00  0.00
+ATOM     46  H   NME     5      20.676  22.079  25.708  1.00  0.00
+ATOM     47  CH3 NME     5      21.237  24.128  25.511  1.00  0.00
+ATOM     48 HH31 NME     5      20.708  25.035  25.219  1.00  0.00
+ATOM     49 HH32 NME     5      21.620  24.242  26.525  1.00  0.00
+ATOM     50 HH33 NME     5      22.068  23.956  24.827  1.00  0.00
+TER   
+ATOM     51 HH31 ACE     6      18.315  22.273  36.560  1.00  0.00
+ATOM     52  CH3 ACE     6      18.810  22.050  35.615  1.00  0.00
+ATOM     53 HH32 ACE     6      19.868  21.859  35.795  1.00  0.00
+ATOM     54 HH33 ACE     6      18.705  22.899  34.940  1.00  0.00
+ATOM     55  C   ACE     6      18.198  20.820  34.951  1.00  0.00
+ATOM     56  O   ACE     6      17.267  20.217  35.484  1.00  0.00
+ATOM     57  N   SER     7      18.724  20.448  33.789  1.00  0.00
+ATOM     58  H   SER     7      19.475  20.970  33.360  1.00  0.00
+ATOM     59  CA  SER     7      18.207  19.284  33.090  1.00  0.00
+ATOM     60  HA  SER     7      17.142  19.417  32.898  1.00  0.00
+ATOM     61  CB  SER     7      18.924  19.084  31.753  1.00  0.00
+ATOM     62  HB2 SER     7      19.997  19.197  31.907  1.00  0.00
+ATOM     63  HB3 SER     7      18.714  18.079  31.386  1.00  0.00
+ATOM     64  OG  SER     7      18.480  20.037  30.800  1.00  0.00
+ATOM     65  HG  SER     7      18.940  19.897  29.969  1.00  0.00
+ATOM     66  C   SER     7      18.403  18.074  33.978  1.00  0.00
+ATOM     67  O   SER     7      17.544  17.195  34.039  1.00  0.00
+ATOM     68  N   NME     8      19.532  18.030  34.678  1.00  0.00
+ATOM     69  H   NME     8      20.226  18.761  34.612  1.00  0.00
+ATOM     70  CH3 NME     8      19.793  16.911  35.566  1.00  0.00
+ATOM     71 HH31 NME     8      18.957  16.213  35.527  1.00  0.00
+ATOM     72 HH32 NME     8      20.705  16.403  35.253  1.00  0.00
+ATOM     73 HH33 NME     8      19.913  17.276  36.586  1.00  0.00
+TER   
+ATOM     74 HH31 ACE     9      17.696   9.121  30.186  1.00  0.00
+ATOM     75  CH3 ACE     9      17.754  10.199  30.338  1.00  0.00
+ATOM     76 HH32 ACE     9      18.263  10.407  31.279  1.00  0.00
+ATOM     77 HH33 ACE     9      16.748  10.616  30.370  1.00  0.00
+ATOM     78  C   ACE     9      18.520  10.868  29.215  1.00  0.00
+ATOM     79  O   ACE     9      18.974  10.180  28.300  1.00  0.00
+ATOM     80  N   ILE    10      18.672  12.189  29.259  1.00  0.00
+ATOM     81  H   ILE    10      18.286  12.738  30.014  1.00  0.00
+ATOM     82  CA  ILE    10      19.397  12.884  28.198  1.00  0.00
+ATOM     83  HA  ILE    10      19.802  12.158  27.493  1.00  0.00
+ATOM     84  CB  ILE    10      18.502  13.881  27.448  1.00  0.00
+ATOM     85  HB  ILE    10      18.234  14.703  28.112  1.00  0.00
+ATOM     86  CG2 ILE    10      19.259  14.430  26.238  1.00  0.00
+ATOM     87 HG21 ILE    10      19.527  13.609  25.573  1.00  0.00
+ATOM     88 HG22 ILE    10      18.626  15.138  25.703  1.00  0.00
+ATOM     89 HG23 ILE    10      20.165  14.935  26.574  1.00  0.00
+ATOM     90  CG1 ILE    10      17.202  13.204  27.007  1.00  0.00
+ATOM     91 HG12 ILE    10      17.460  12.463  26.251  1.00  0.00
+ATOM     92 HG13 ILE    10      16.783  12.702  27.879  1.00  0.00
+ATOM     93  CD1 ILE    10      16.171  14.176  26.436  1.00  0.00
+ATOM     94 HD11 ILE    10      16.589  14.678  25.564  1.00  0.00
+ATOM     95 HD12 ILE    10      15.276  13.627  26.144  1.00  0.00
+ATOM     96 HD13 ILE    10      15.912  14.917  27.192  1.00  0.00
+ATOM     97  C   ILE    10      20.594  13.670  28.712  1.00  0.00
+ATOM     98  O   ILE    10      20.457  14.541  29.570  1.00  0.00
+ATOM     99  N   GLN    11      21.766  13.368  28.167  1.00  0.00
+ATOM    100  H   GLN    11      21.824  12.637  27.472  1.00  0.00
+ATOM    101  CA  GLN    11      22.991  14.052  28.552  1.00  0.00
+ATOM    102  HA  GLN    11      23.008  14.204  29.631  1.00  0.00
+ATOM    103  CB  GLN    11      24.213  13.215  28.156  1.00  0.00
+ATOM    104  HB2 GLN    11      24.076  12.227  28.595  1.00  0.00
+ATOM    105  HB3 GLN    11      24.202  13.133  27.069  1.00  0.00
+ATOM    106  CG  GLN    11      25.553  13.793  28.610  1.00  0.00
+ATOM    107  HG2 GLN    11      25.527  14.871  28.448  1.00  0.00
+ATOM    108  HG3 GLN    11      25.700  13.589  29.671  1.00  0.00
+ATOM    109  CD  GLN    11      26.728  13.213  27.835  1.00  0.00
+ATOM    110  OE1 GLN    11      27.828  13.057  28.372  1.00  0.00
+ATOM    111  NE2 GLN    11      26.504  12.911  26.559  1.00  0.00
+ATOM    112 HE21 GLN    11      27.248  12.523  25.997  1.00  0.00
+ATOM    113 HE22 GLN    11      25.591  13.071  26.158  1.00  0.00
+ATOM    114  C   GLN    11      23.088  15.417  27.878  1.00  0.00
+ATOM    115  O   GLN    11      22.808  15.560  26.684  1.00  0.00
+ATOM    116  N   GLN    12      23.479  16.422  28.657  1.00  0.00
+ATOM    117  H   GLN    12      23.652  16.258  29.639  1.00  0.00
+ATOM    118  CA  GLN    12      23.661  17.774  28.139  1.00  0.00
+ATOM    119  HA  GLN    12      23.498  17.777  27.061  1.00  0.00
+ATOM    120  CB  GLN    12      22.670  18.747  28.787  1.00  0.00
+ATOM    121  HB2 GLN    12      22.750  18.609  29.865  1.00  0.00
+ATOM    122  HB3 GLN    12      22.997  19.753  28.525  1.00  0.00
+ATOM    123  CG  GLN    12      21.219  18.556  28.356  1.00  0.00
+ATOM    124  HG2 GLN    12      20.902  17.561  28.669  1.00  0.00
+ATOM    125  HG3 GLN    12      20.598  19.306  28.846  1.00  0.00
+ATOM    126  CD  GLN    12      21.030  18.675  26.854  1.00  0.00
+ATOM    127  OE1 GLN    12      21.644  19.520  26.207  1.00  0.00
+ATOM    128  NE2 GLN    12      20.164  17.835  26.295  1.00  0.00
+ATOM    129 HE21 GLN    12      20.001  17.872  25.299  1.00  0.00
+ATOM    130 HE22 GLN    12      19.674  17.164  26.869  1.00  0.00
+ATOM    131  C   GLN    12      25.094  18.187  28.458  1.00  0.00
+ATOM    132  O   GLN    12      25.929  17.340  28.772  1.00  0.00
+ATOM    133  N   NME    13      25.380  19.482  28.377  1.00  0.00
+ATOM    134  H   NME    13      24.681  20.161  28.114  1.00  0.00
+ATOM    135  CH3 NME    13      26.721  19.953  28.669  1.00  0.00
+ATOM    136 HH31 NME    13      27.354  19.107  28.935  1.00  0.00
+ATOM    137 HH32 NME    13      27.131  20.451  27.790  1.00  0.00
+ATOM    138 HH33 NME    13      26.687  20.656  29.501  1.00  0.00
+TER   
+END