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comparison test-data/2brc.pdb @ 0:2063e965531c draft

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/fpocket/ commit 3fd527d39458527d9ab82562db2d3d6af29f7f51"
author bgruening
date Mon, 12 Aug 2019 13:27:10 -0400
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children 4cc9d85c3bae
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-1:000000000000 0:2063e965531c
1 HEADER CHAPERONE 04-MAY-05 2BRC
2 TITLE STRUCTURE OF A HSP90 INHIBITOR BOUND TO THE N-TERMINUS OF YEAST HSP90.
3 COMPND MOL_ID: 1;
4 COMPND 2 MOLECULE: ATP-DEPENDENT MOLECULAR CHAPERONE HSP82;
5 COMPND 3 CHAIN: A;
6 COMPND 4 FRAGMENT: N-TERMINUS, RESIDUES 1-214;
7 COMPND 5 SYNONYM: HSP90,HEAT SHOCK PROTEIN HSP90,82 KDA HEAT SHOCK PROTEIN;
8 COMPND 6 ENGINEERED: YES
9 SOURCE MOL_ID: 1;
10 SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;
11 SOURCE 3 ORGANISM_COMMON: BAKER'S YEAST;
12 SOURCE 4 ORGANISM_TAXID: 4932;
13 SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
14 SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562
15 KEYWDS ATP-BINDING, CHAPERONE, HEAT SHOCK, INHIBITOR, MULTIGENE FAMILY,
16 KEYWDS 2 CHAPERONE-COMPLEX
17 EXPDTA X-RAY DIFFRACTION
18 AUTHOR S.M.ROE,L.H.PEARL,C.PRODROMOU
19 REVDAT 3 28-FEB-18 2BRC 1 JRNL
20 REVDAT 2 24-FEB-09 2BRC 1 VERSN
21 REVDAT 1 29-SEP-05 2BRC 0
22 JRNL AUTH K.M.CHEUNG,T.P.MATTHEWS,K.JAMES,M.G.ROWLANDS,K.J.BOXALL,
23 JRNL AUTH 2 S.Y.SHARP,A.MALONEY,S.M.ROE,C.PRODROMOU,L.H.PEARL,
24 JRNL AUTH 3 G.W.AHERNE,E.MCDONALD,P.WORKMAN
25 JRNL TITL THE IDENTIFICATION, SYNTHESIS, PROTEIN CRYSTAL STRUCTURE AND
26 JRNL TITL 2 IN VITRO BIOCHEMICAL EVALUATION OF A NEW 3,4-DIARYLPYRAZOLE
27 JRNL TITL 3 CLASS OF HSP90 INHIBITORS.
28 JRNL REF BIOORG. MED. CHEM. LETT. V. 15 3338 2005
29 JRNL REFN ISSN 0960-894X
30 JRNL PMID 15955698
31 JRNL DOI 10.1016/J.BMCL.2005.05.046
32 REMARK 2
33 REMARK 2 RESOLUTION. 1.60 ANGSTROMS.
34 REMARK 3
35 REMARK 3 REFINEMENT.
36 REMARK 3 PROGRAM : REFMAC 5.0
37 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON
38 REMARK 3
39 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD
40 REMARK 3
41 REMARK 3 DATA USED IN REFINEMENT.
42 REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.60
43 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 74.54
44 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL
45 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9
46 REMARK 3 NUMBER OF REFLECTIONS : 39187
47 REMARK 3
48 REMARK 3 FIT TO DATA USED IN REFINEMENT.
49 REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT
50 REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
51 REMARK 3 R VALUE (WORKING + TEST SET) : 0.188
52 REMARK 3 R VALUE (WORKING SET) : 0.187
53 REMARK 3 FREE R VALUE : 0.214
54 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000
55 REMARK 3 FREE R VALUE TEST SET COUNT : 2067
56 REMARK 3
57 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
58 REMARK 3 TOTAL NUMBER OF BINS USED : 20
59 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.60
60 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.64
61 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2844
62 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL
63 REMARK 3 BIN R VALUE (WORKING SET) : 0.2260
64 REMARK 3 BIN FREE R VALUE SET COUNT : 159
65 REMARK 3 BIN FREE R VALUE : 0.2770
66 REMARK 3
67 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
68 REMARK 3 PROTEIN ATOMS : 1664
69 REMARK 3 NUCLEIC ACID ATOMS : 0
70 REMARK 3 HETEROGEN ATOMS : 26
71 REMARK 3 SOLVENT ATOMS : 258
72 REMARK 3
73 REMARK 3 B VALUES.
74 REMARK 3 FROM WILSON PLOT (A**2) : NULL
75 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 21.14
76 REMARK 3 OVERALL ANISOTROPIC B VALUE.
77 REMARK 3 B11 (A**2) : -0.40000
78 REMARK 3 B22 (A**2) : -0.40000
79 REMARK 3 B33 (A**2) : 0.79000
80 REMARK 3 B12 (A**2) : 0.00000
81 REMARK 3 B13 (A**2) : 0.00000
82 REMARK 3 B23 (A**2) : 0.00000
83 REMARK 3
84 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR.
85 REMARK 3 ESU BASED ON R VALUE (A): 0.076
86 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.078
87 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.053
88 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 1.480
89 REMARK 3
90 REMARK 3 CORRELATION COEFFICIENTS.
91 REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.958
92 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.953
93 REMARK 3
94 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT
95 REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1717 ; 0.016 ; 0.022
96 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL
97 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2325 ; 1.820 ; 1.985
98 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL
99 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 213 ; 5.073 ; 3.000
100 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL
101 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 308 ;14.190 ;15.000
102 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL
103 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 270 ; 0.131 ; 0.200
104 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1276 ; 0.008 ; 0.020
105 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL
106 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 865 ; 0.236 ; 0.300
107 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL
108 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL
109 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL
110 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 256 ; 0.191 ; 0.500
111 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL
112 REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL
113 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL
114 REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 39 ; 0.318 ; 0.300
115 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL
116 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 24 ; 0.589 ; 0.500
117 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL
118 REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL
119 REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL
120 REMARK 3
121 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT
122 REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1062 ; 1.031 ; 1.500
123 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL
124 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1716 ; 1.864 ; 2.000
125 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL
126 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 655 ; 3.090 ; 3.000
127 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL
128 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 609 ; 4.994 ; 4.500
129 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL
130 REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL
131 REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL
132 REMARK 3
133 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT
134 REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL
135 REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL
136 REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL
137 REMARK 3
138 REMARK 3 NCS RESTRAINTS STATISTICS
139 REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL
140 REMARK 3
141 REMARK 3 TLS DETAILS
142 REMARK 3 NUMBER OF TLS GROUPS : NULL
143 REMARK 3
144 REMARK 3 BULK SOLVENT MODELLING.
145 REMARK 3 METHOD USED : BABINET MODEL WITH MASK
146 REMARK 3 PARAMETERS FOR MASK CALCULATION
147 REMARK 3 VDW PROBE RADIUS : 1.40
148 REMARK 3 ION PROBE RADIUS : 0.80
149 REMARK 3 SHRINKAGE RADIUS : 0.80
150 REMARK 3
151 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING
152 REMARK 3 POSITIONS.
153 REMARK 4
154 REMARK 4 2BRC COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
155 REMARK 100
156 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 04-MAY-05.
157 REMARK 100 THE DEPOSITION ID IS D_1290023902.
158 REMARK 200
159 REMARK 200 EXPERIMENTAL DETAILS
160 REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
161 REMARK 200 DATE OF DATA COLLECTION : 14-NOV-01
162 REMARK 200 TEMPERATURE (KELVIN) : 100.0
163 REMARK 200 PH : 7.00
164 REMARK 200 NUMBER OF CRYSTALS USED : 1
165 REMARK 200
166 REMARK 200 SYNCHROTRON (Y/N) : Y
167 REMARK 200 RADIATION SOURCE : ESRF
168 REMARK 200 BEAMLINE : ID14-1
169 REMARK 200 X-RAY GENERATOR MODEL : NULL
170 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M
171 REMARK 200 WAVELENGTH OR RANGE (A) : 0.934
172 REMARK 200 MONOCHROMATOR : NULL
173 REMARK 200 OPTICS : NULL
174 REMARK 200
175 REMARK 200 DETECTOR TYPE : CCD
176 REMARK 200 DETECTOR MANUFACTURER : ADSC CCD
177 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM
178 REMARK 200 DATA SCALING SOFTWARE : SCALA
179 REMARK 200
180 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 41319
181 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.600
182 REMARK 200 RESOLUTION RANGE LOW (A) : 38.000
183 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
184 REMARK 200
185 REMARK 200 OVERALL.
186 REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0
187 REMARK 200 DATA REDUNDANCY : 5.200
188 REMARK 200 R MERGE (I) : 0.08000
189 REMARK 200 R SYM (I) : NULL
190 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 15.1000
191 REMARK 200
192 REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
193 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.60
194 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.69
195 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0
196 REMARK 200 DATA REDUNDANCY IN SHELL : 4.70
197 REMARK 200 R MERGE FOR SHELL (I) : 0.32000
198 REMARK 200 R SYM FOR SHELL (I) : NULL
199 REMARK 200 <I/SIGMA(I)> FOR SHELL : 3.600
200 REMARK 200
201 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH
202 REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT
203 REMARK 200 SOFTWARE USED: NULL
204 REMARK 200 STARTING MODEL: PDB ENTRY 1BGQ
205 REMARK 200
206 REMARK 200 REMARK: NULL
207 REMARK 280
208 REMARK 280 CRYSTAL
209 REMARK 280 SOLVENT CONTENT, VS (%): 55.42
210 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.78
211 REMARK 280
212 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 7.00
213 REMARK 290
214 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
215 REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 2 2
216 REMARK 290
217 REMARK 290 SYMOP SYMMETRY
218 REMARK 290 NNNMMM OPERATOR
219 REMARK 290 1555 X,Y,Z
220 REMARK 290 2555 -X,-Y,Z+1/2
221 REMARK 290 3555 -Y,X,Z+3/4
222 REMARK 290 4555 Y,-X,Z+1/4
223 REMARK 290 5555 -X,Y,-Z
224 REMARK 290 6555 X,-Y,-Z+1/2
225 REMARK 290 7555 Y,X,-Z+1/4
226 REMARK 290 8555 -Y,-X,-Z+3/4
227 REMARK 290
228 REMARK 290 WHERE NNN -> OPERATOR NUMBER
229 REMARK 290 MMM -> TRANSLATION VECTOR
230 REMARK 290
231 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
232 REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
233 REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
234 REMARK 290 RELATED MOLECULES.
235 REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
236 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
237 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
238 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000
239 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000
240 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 55.39600
241 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000
242 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000
243 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 83.09400
244 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000
245 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000
246 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 27.69800
247 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 0.00000
248 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000
249 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 0.00000
250 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000
251 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 0.00000
252 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 55.39600
253 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000
254 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000
255 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 27.69800
256 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000
257 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000
258 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 83.09400
259 REMARK 290
260 REMARK 290 REMARK: NULL
261 REMARK 300
262 REMARK 300 BIOMOLECULE: 1
263 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
264 REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
265 REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
266 REMARK 300 BURIED SURFACE AREA.
267 REMARK 350
268 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
269 REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
270 REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
271 REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
272 REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
273 REMARK 350
274 REMARK 350 BIOMOLECULE: 1
275 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
276 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC
277 REMARK 350 SOFTWARE USED: PQS
278 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
279 REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
280 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
281 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
282 REMARK 470
283 REMARK 470 MISSING ATOM
284 REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;
285 REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;
286 REMARK 470 I=INSERTION CODE):
287 REMARK 470 M RES CSSEQI ATOMS
288 REMARK 470 MET A 1 CG SD CE
289 REMARK 470 ARG A 32 CD NE CZ NH1 NH2
290 REMARK 470 LYS A 54 CD CE NZ
291 REMARK 470 GLU A 71 CG CD OE1 OE2
292 REMARK 470 LYS A 98 CG CD CE NZ
293 REMARK 470 LYS A 102 CD CE NZ
294 REMARK 470 LYS A 188 CD CE NZ
295 REMARK 470 LYS A 195 CE NZ
296 REMARK 470 ARG A 196 CG CD NE CZ NH1 NH2
297 REMARK 470 GLU A 214 CG CD OE1 OE2
298 REMARK 500
299 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
300 REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT
301 REMARK 500
302 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.
303 REMARK 500
304 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE
305 REMARK 500 O SER A 99 O HOH A 2150 1.91
306 REMARK 500 OD1 ASP A 40 O HOH A 2072 2.08
307 REMARK 500 C SER A 99 O HOH A 2150 2.17
308 REMARK 500 O HOH A 2043 O HOH A 2118 2.17
309 REMARK 500
310 REMARK 500 REMARK: NULL
311 REMARK 500
312 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
313 REMARK 500 SUBTOPIC: CLOSE CONTACTS
314 REMARK 500
315 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC
316 REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15
317 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A
318 REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375
319 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE
320 REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS.
321 REMARK 500
322 REMARK 500 DISTANCE CUTOFF:
323 REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS
324 REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS
325 REMARK 500
326 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE
327 REMARK 500 O HOH A 2150 O HOH A 2150 5555 0.55
328 REMARK 500 O HOH A 2080 O HOH A 2080 8554 1.07
329 REMARK 500
330 REMARK 500 REMARK: NULL
331 REMARK 500
332 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
333 REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
334 REMARK 500
335 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
336 REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
337 REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
338 REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
339 REMARK 500
340 REMARK 500 STANDARD TABLE:
341 REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
342 REMARK 500
343 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
344 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
345 REMARK 500
346 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
347 REMARK 500 ASP A 43 CB - CG - OD2 ANGL. DEV. = 7.7 DEGREES
348 REMARK 500 ASP A 132 CB - CG - OD2 ANGL. DEV. = 6.2 DEGREES
349 REMARK 500 ASP A 142 CB - CG - OD2 ANGL. DEV. = 6.5 DEGREES
350 REMARK 500
351 REMARK 500 REMARK: NULL
352 REMARK 500
353 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
354 REMARK 500 SUBTOPIC: TORSION ANGLES
355 REMARK 500
356 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
357 REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
358 REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
359 REMARK 500
360 REMARK 500 STANDARD TABLE:
361 REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
362 REMARK 500
363 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
364 REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
365 REMARK 500
366 REMARK 500 M RES CSSEQI PSI PHI
367 REMARK 500 TYR A 24 132.19 -39.44
368 REMARK 500 ASP A 52 68.04 -150.55
369 REMARK 500 GLU A 59 87.65 -172.16
370 REMARK 500 THR A 95 -58.55 -128.28
371 REMARK 500 PHE A 200 68.61 -111.48
372 REMARK 500
373 REMARK 500 REMARK: NULL
374 REMARK 525
375 REMARK 525 SOLVENT
376 REMARK 525
377 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT
378 REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST
379 REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT
380 REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE
381 REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER;
382 REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE
383 REMARK 525 NUMBER; I=INSERTION CODE):
384 REMARK 525
385 REMARK 525 M RES CSSEQI
386 REMARK 525 HOH A2003 DISTANCE = 5.89 ANGSTROMS
387 REMARK 525 HOH A2023 DISTANCE = 6.11 ANGSTROMS
388 REMARK 800
389 REMARK 800 SITE
390 REMARK 800 SITE_IDENTIFIER: AC1
391 REMARK 800 EVIDENCE_CODE: SOFTWARE
392 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CT5 A1215
393 REMARK 900
394 REMARK 900 RELATED ENTRIES
395 REMARK 900 RELATED ID: 1A4H RELATED DB: PDB
396 REMARK 900 STRUCTURE OF THE N-TERMINAL DOMAIN OF THE YEAST HSP90 CHAPERONE IN
397 REMARK 900 COMPLEX WITH GELDANAMYCIN
398 REMARK 900 RELATED ID: 1AH6 RELATED DB: PDB
399 REMARK 900 STRUCTURE OF THE TETRAGONAL FORM OF THE N -TERMINAL DOMAIN OF THE
400 REMARK 900 YEAST HSP90 CHAPERONE
401 REMARK 900 RELATED ID: 1AH8 RELATED DB: PDB
402 REMARK 900 STRUCTURE OF THE ORTHORHOMBIC FORM OF THE N-TERMINAL DOMAIN OF THE
403 REMARK 900 YEAST HSP90 CHAPERONE
404 REMARK 900 RELATED ID: 1AM1 RELATED DB: PDB
405 REMARK 900 ATP BINDING SITE IN THE HSP90 MOLECULAR CHAPERONE
406 REMARK 900 RELATED ID: 1AMW RELATED DB: PDB
407 REMARK 900 ADP BINDING SITE IN THE HSP90 MOLECULAR CHAPERONE
408 REMARK 900 RELATED ID: 1BGQ RELATED DB: PDB
409 REMARK 900 RADICICOL BOUND TO THE ATP BINDING SITE OF THE N-TERMINAL DOMAIN OF
410 REMARK 900 THE YEAST HSP90 CHAPERONE
411 REMARK 900 RELATED ID: 1HK7 RELATED DB: PDB
412 REMARK 900 MIDDLE DOMAIN OF HSP90
413 REMARK 900 RELATED ID: 1US7 RELATED DB: PDB
414 REMARK 900 COMPLEX OF HSP90 AND P50
415 REMARK 900 RELATED ID: 1USU RELATED DB: PDB
416 REMARK 900 THE STRUCTURE OF THE COMPLEX BETWEEN AHA1 AND HSP90
417 REMARK 900 RELATED ID: 1USV RELATED DB: PDB
418 REMARK 900 THE STRUCTURE OF THE COMPLEX BETWEEN AHA1 AND HSP90
419 REMARK 900 RELATED ID: 2BRE RELATED DB: PDB
420 REMARK 900 STRUCTURE OF A HSP90 INHIBITOR BOUND TO THE N-TERMINUS OF YEAST
421 REMARK 900 HSP90.
422 DBREF 2BRC A 1 214 UNP P02829 HSP82_YEAST 1 214
423 SEQRES 1 A 214 MET ALA SER GLU THR PHE GLU PHE GLN ALA GLU ILE THR
424 SEQRES 2 A 214 GLN LEU MET SER LEU ILE ILE ASN THR VAL TYR SER ASN
425 SEQRES 3 A 214 LYS GLU ILE PHE LEU ARG GLU LEU ILE SER ASN ALA SER
426 SEQRES 4 A 214 ASP ALA LEU ASP LYS ILE ARG TYR LYS SER LEU SER ASP
427 SEQRES 5 A 214 PRO LYS GLN LEU GLU THR GLU PRO ASP LEU PHE ILE ARG
428 SEQRES 6 A 214 ILE THR PRO LYS PRO GLU GLN LYS VAL LEU GLU ILE ARG
429 SEQRES 7 A 214 ASP SER GLY ILE GLY MET THR LYS ALA GLU LEU ILE ASN
430 SEQRES 8 A 214 ASN LEU GLY THR ILE ALA LYS SER GLY THR LYS ALA PHE
431 SEQRES 9 A 214 MET GLU ALA LEU SER ALA GLY ALA ASP VAL SER MET ILE
432 SEQRES 10 A 214 GLY GLN PHE GLY VAL GLY PHE TYR SER LEU PHE LEU VAL
433 SEQRES 11 A 214 ALA ASP ARG VAL GLN VAL ILE SER LYS SER ASN ASP ASP
434 SEQRES 12 A 214 GLU GLN TYR ILE TRP GLU SER ASN ALA GLY GLY SER PHE
435 SEQRES 13 A 214 THR VAL THR LEU ASP GLU VAL ASN GLU ARG ILE GLY ARG
436 SEQRES 14 A 214 GLY THR ILE LEU ARG LEU PHE LEU LYS ASP ASP GLN LEU
437 SEQRES 15 A 214 GLU TYR LEU GLU GLU LYS ARG ILE LYS GLU VAL ILE LYS
438 SEQRES 16 A 214 ARG HIS SER GLU PHE VAL ALA TYR PRO ILE GLN LEU VAL
439 SEQRES 17 A 214 VAL THR LYS GLU VAL GLU
440 HET CT5 A1215 26
441 HETNAM CT5 4-[4-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-3-METHYL-1H-
442 HETNAM 2 CT5 PYRAZOL-5-YL]-6-ETHYLBENZENE-1,3-DIOL
443 FORMUL 2 CT5 C20 H20 N2 O4
444 FORMUL 3 HOH *258(H2 O)
445 HELIX 1 1 GLN A 9 THR A 22 1 14
446 HELIX 2 2 GLU A 28 LEU A 50 1 23
447 HELIX 3 3 ASP A 52 GLU A 57 5 6
448 HELIX 4 4 PRO A 70 GLN A 72 5 3
449 HELIX 5 5 THR A 85 THR A 95 1 11
450 HELIX 6 6 ALA A 97 GLY A 111 1 15
451 HELIX 7 7 ASP A 113 GLY A 121 5 9
452 HELIX 8 8 VAL A 122 LEU A 129 5 8
453 HELIX 9 9 GLN A 181 LEU A 185 5 5
454 HELIX 10 10 GLU A 186 SER A 198 1 13
455 SHEET 1 AA 8 GLU A 4 GLU A 7 0
456 SHEET 2 AA 8 SER A 155 LEU A 160 -1 O PHE A 156 N PHE A 6
457 SHEET 3 AA 8 TYR A 146 SER A 150 -1 O ILE A 147 N THR A 159
458 SHEET 4 AA 8 ALA A 131 LYS A 139 -1 O VAL A 134 N SER A 150
459 SHEET 5 AA 8 GLY A 170 LEU A 177 -1 O GLY A 170 N LYS A 139
460 SHEET 6 AA 8 VAL A 74 ASP A 79 -1 O LEU A 75 N LEU A 175
461 SHEET 7 AA 8 ILE A 64 LYS A 69 -1 O ARG A 65 N ARG A 78
462 SHEET 8 AA 8 ILE A 205 LEU A 207 1 O GLN A 206 N ILE A 66
463 SITE 1 AC1 13 ASN A 37 ASP A 40 ALA A 41 ASP A 79
464 SITE 2 AC1 13 ILE A 82 GLY A 83 MET A 84 LEU A 93
465 SITE 3 AC1 13 PHE A 124 THR A 171 LEU A 173 HOH A2137
466 SITE 4 AC1 13 HOH A2258
467 CRYST1 74.001 74.001 110.792 90.00 90.00 90.00 P 43 2 2 8
468 ORIGX1 1.000000 0.000000 0.000000 0.00000
469 ORIGX2 0.000000 1.000000 0.000000 0.00000
470 ORIGX3 0.000000 0.000000 1.000000 0.00000
471 SCALE1 0.013513 0.000000 0.000000 0.00000
472 SCALE2 0.000000 0.013513 0.000000 0.00000
473 SCALE3 0.000000 0.000000 0.009026 0.00000
474 ATOM 1 N MET A 1 33.050 12.973 3.916 1.00 39.39 N
475 ATOM 2 CA MET A 1 32.080 14.100 3.862 1.00 38.29 C
476 ATOM 3 C MET A 1 30.953 13.936 4.885 1.00 37.36 C
477 ATOM 4 O MET A 1 30.838 12.911 5.590 1.00 37.93 O
478 ATOM 5 CB MET A 1 31.526 14.308 2.438 1.00 38.85 C
479 ATOM 6 N ALA A 2 30.143 14.975 4.991 1.00 35.49 N
480 ATOM 7 CA ALA A 2 29.061 14.961 5.946 1.00 33.10 C
481 ATOM 8 C ALA A 2 27.916 14.113 5.410 1.00 31.03 C
482 ATOM 9 O ALA A 2 27.625 14.096 4.218 1.00 30.48 O
483 ATOM 10 CB ALA A 2 28.585 16.359 6.229 1.00 33.84 C
484 ATOM 11 N SER A 3 27.291 13.413 6.329 1.00 28.88 N
485 ATOM 12 CA SER A 3 26.114 12.628 6.050 1.00 26.78 C
486 ATOM 13 C SER A 3 24.897 13.548 6.013 1.00 25.46 C
487 ATOM 14 O SER A 3 24.903 14.616 6.635 1.00 27.72 O
488 ATOM 15 CB SER A 3 25.930 11.628 7.186 1.00 26.97 C
489 ATOM 16 OG SER A 3 27.070 10.778 7.297 1.00 29.95 O
490 ATOM 17 N GLU A 4 23.863 13.159 5.271 1.00 22.40 N
491 ATOM 18 CA GLU A 4 22.588 13.858 5.311 1.00 21.11 C
492 ATOM 19 C GLU A 4 21.595 12.891 5.949 1.00 20.34 C
493 ATOM 20 O GLU A 4 21.680 11.672 5.722 1.00 18.50 O
494 ATOM 21 CB GLU A 4 22.116 14.172 3.908 1.00 21.46 C
495 ATOM 22 CG GLU A 4 22.892 15.306 3.261 1.00 26.09 C
496 ATOM 23 CD GLU A 4 22.630 15.384 1.769 1.00 32.97 C
497 ATOM 24 OE1 GLU A 4 21.465 15.617 1.387 1.00 38.16 O
498 ATOM 25 OE2 GLU A 4 23.584 15.218 0.979 1.00 38.74 O
499 ATOM 26 N THR A 5 20.671 13.426 6.740 1.00 19.30 N
500 ATOM 27 CA THR A 5 19.715 12.600 7.462 1.00 19.48 C
501 ATOM 28 C THR A 5 18.312 12.789 6.889 1.00 19.54 C
502 ATOM 29 O THR A 5 17.901 13.921 6.561 1.00 20.44 O
503 ATOM 30 CB THR A 5 19.775 12.951 8.950 1.00 19.50 C
504 ATOM 31 OG1 THR A 5 21.094 12.635 9.456 1.00 22.43 O
505 ATOM 32 CG2 THR A 5 18.817 12.038 9.749 1.00 20.59 C
506 ATOM 33 N PHE A 6 17.570 11.685 6.771 1.00 17.16 N
507 ATOM 34 CA PHE A 6 16.219 11.691 6.196 1.00 18.00 C
508 ATOM 35 C PHE A 6 15.277 10.891 7.072 1.00 18.44 C
509 ATOM 36 O PHE A 6 15.706 9.976 7.751 1.00 19.31 O
510 ATOM 37 CB PHE A 6 16.222 11.038 4.820 1.00 18.96 C
511 ATOM 38 CG PHE A 6 17.102 11.720 3.856 1.00 18.53 C
512 ATOM 39 CD1 PHE A 6 18.460 11.409 3.840 1.00 19.17 C
513 ATOM 40 CD2 PHE A 6 16.606 12.683 2.970 1.00 20.58 C
514 ATOM 41 CE1 PHE A 6 19.305 12.036 2.947 1.00 20.28 C
515 ATOM 42 CE2 PHE A 6 17.477 13.329 2.083 1.00 20.49 C
516 ATOM 43 CZ PHE A 6 18.835 12.997 2.105 1.00 18.85 C
517 ATOM 44 N GLU A 7 14.000 11.235 7.054 1.00 19.84 N
518 ATOM 45 CA GLU A 7 13.026 10.478 7.815 1.00 20.66 C
519 ATOM 46 C GLU A 7 12.367 9.406 6.945 1.00 18.60 C
520 ATOM 47 O GLU A 7 11.979 9.660 5.773 1.00 19.08 O
521 ATOM 48 CB GLU A 7 11.936 11.421 8.358 1.00 22.17 C
522 ATOM 49 CG GLU A 7 11.461 11.020 9.746 1.00 31.05 C
523 ATOM 50 CD GLU A 7 10.354 11.905 10.307 1.00 38.00 C
524 ATOM 51 OE1 GLU A 7 10.102 13.015 9.752 1.00 42.43 O
525 ATOM 52 OE2 GLU A 7 9.709 11.470 11.301 1.00 42.74 O
526 ATOM 53 N PHE A 8 12.185 8.203 7.495 1.00 17.76 N
527 ATOM 54 CA PHE A 8 11.420 7.180 6.764 1.00 16.56 C
528 ATOM 55 C PHE A 8 9.939 7.518 6.766 1.00 16.37 C
529 ATOM 56 O PHE A 8 9.451 8.139 7.723 1.00 17.80 O
530 ATOM 57 CB PHE A 8 11.434 5.827 7.525 1.00 15.52 C
531 ATOM 58 CG PHE A 8 12.691 5.033 7.334 1.00 14.96 C
532 ATOM 59 CD1 PHE A 8 13.717 5.136 8.248 1.00 15.44 C
533 ATOM 60 CD2 PHE A 8 12.796 4.137 6.278 1.00 14.37 C
534 ATOM 61 CE1 PHE A 8 14.905 4.424 8.076 1.00 15.27 C
535 ATOM 62 CE2 PHE A 8 13.944 3.411 6.109 1.00 16.20 C
536 ATOM 63 CZ PHE A 8 14.987 3.529 7.018 1.00 14.18 C
537 ATOM 64 N GLN A 9 9.228 7.080 5.743 1.00 17.29 N
538 ATOM 65 CA GLN A 9 7.761 7.073 5.824 1.00 18.07 C
539 ATOM 66 C GLN A 9 7.390 6.260 7.074 1.00 18.98 C
540 ATOM 67 O GLN A 9 7.955 5.180 7.321 1.00 17.09 O
541 ATOM 68 CB GLN A 9 7.110 6.478 4.582 1.00 19.54 C
542 ATOM 69 CG GLN A 9 7.297 7.306 3.341 1.00 25.55 C
543 ATOM 70 CD GLN A 9 6.715 8.695 3.500 1.00 36.08 C
544 ATOM 71 OE1 GLN A 9 5.859 8.919 4.358 1.00 40.04 O
545 ATOM 72 NE2 GLN A 9 7.172 9.632 2.670 1.00 39.83 N
546 ATOM 73 N ALA A 10 6.427 6.741 7.875 1.00 18.03 N
547 ATOM 74 CA ALA A 10 6.229 6.140 9.195 1.00 18.26 C
548 ATOM 75 C ALA A 10 5.871 4.663 9.159 1.00 16.53 C
549 ATOM 76 O ALA A 10 6.261 3.930 10.041 1.00 15.94 O
550 ATOM 77 CB ALA A 10 5.146 6.919 9.974 1.00 18.39 C
551 ATOM 78 N GLU A 11 5.145 4.237 8.138 1.00 16.79 N
552 ATOM 79 CA GLU A 11 4.766 2.820 8.081 1.00 17.31 C
553 ATOM 80 C GLU A 11 5.978 1.910 7.879 1.00 16.34 C
554 ATOM 81 O GLU A 11 5.963 0.767 8.326 1.00 15.78 O
555 ATOM 82 CB GLU A 11 3.729 2.560 6.986 1.00 17.95 C
556 ATOM 83 CG GLU A 11 2.392 3.203 7.340 1.00 22.32 C
557 ATOM 84 CD GLU A 11 2.314 4.667 6.971 1.00 29.15 C
558 ATOM 85 OE1 GLU A 11 3.332 5.274 6.491 1.00 28.32 O
559 ATOM 86 OE2 GLU A 11 1.201 5.223 7.169 1.00 32.62 O
560 ATOM 87 N ILE A 12 7.024 2.412 7.229 1.00 16.67 N
561 ATOM 88 CA ILE A 12 8.258 1.607 7.104 1.00 15.50 C
562 ATOM 89 C ILE A 12 8.935 1.466 8.464 1.00 14.39 C
563 ATOM 90 O ILE A 12 9.411 0.400 8.826 1.00 14.97 O
564 ATOM 91 CB ILE A 12 9.201 2.230 6.076 1.00 15.30 C
565 ATOM 92 CG1 ILE A 12 8.477 2.372 4.738 1.00 16.65 C
566 ATOM 93 CG2 ILE A 12 10.476 1.327 5.877 1.00 16.74 C
567 ATOM 94 CD1 ILE A 12 9.313 3.089 3.666 1.00 16.80 C
568 ATOM 95 N THR A 13 8.939 2.548 9.250 1.00 13.97 N
569 ATOM 96 CA THR A 13 9.480 2.509 10.589 1.00 14.12 C
570 ATOM 97 C THR A 13 8.682 1.506 11.448 1.00 14.40 C
571 ATOM 98 O THR A 13 9.270 0.766 12.236 1.00 14.26 O
572 ATOM 99 CB THR A 13 9.360 3.911 11.197 1.00 14.71 C
573 ATOM 100 OG1 THR A 13 10.101 4.812 10.346 1.00 17.51 O
574 ATOM 101 CG2 THR A 13 10.061 3.970 12.538 1.00 15.96 C
575 ATOM 102 N GLN A 14 7.369 1.489 11.288 1.00 14.19 N
576 ATOM 103 CA GLN A 14 6.547 0.490 11.976 1.00 14.43 C
577 ATOM 104 C GLN A 14 6.941 -0.922 11.575 1.00 14.53 C
578 ATOM 105 O GLN A 14 7.160 -1.773 12.431 1.00 14.71 O
579 ATOM 106 CB GLN A 14 5.073 0.698 11.679 1.00 14.06 C
580 ATOM 107 CG GLN A 14 4.571 2.042 12.200 1.00 16.56 C
581 ATOM 108 CD GLN A 14 3.131 2.332 11.834 1.00 20.58 C
582 ATOM 109 OE1 GLN A 14 2.411 1.446 11.349 1.00 22.79 O
583 ATOM 110 NE2 GLN A 14 2.693 3.561 12.081 1.00 21.20 N
584 ATOM 111 N LEU A 15 7.094 -1.151 10.275 1.00 15.20 N
585 ATOM 112 CA LEU A 15 7.469 -2.503 9.837 1.00 15.41 C
586 ATOM 113 C LEU A 15 8.837 -2.917 10.374 1.00 15.73 C
587 ATOM 114 O LEU A 15 9.035 -4.039 10.865 1.00 14.31 O
588 ATOM 115 CB LEU A 15 7.370 -2.639 8.311 1.00 16.07 C
589 ATOM 116 CG LEU A 15 7.710 -4.099 7.905 1.00 17.62 C
590 ATOM 117 CD1 LEU A 15 6.805 -5.170 8.555 1.00 19.96 C
591 ATOM 118 CD2 LEU A 15 7.693 -4.207 6.394 1.00 22.75 C
592 ATOM 119 N MET A 16 9.801 -2.009 10.301 1.00 14.02 N
593 ATOM 120 CA MET A 16 11.142 -2.365 10.806 1.00 14.70 C
594 ATOM 121 C MET A 16 11.125 -2.749 12.270 1.00 14.80 C
595 ATOM 122 O MET A 16 11.873 -3.626 12.697 1.00 16.45 O
596 ATOM 123 CB MET A 16 12.140 -1.228 10.586 1.00 15.72 C
597 ATOM 124 CG MET A 16 12.434 -1.027 9.103 1.00 15.71 C
598 ATOM 125 SD MET A 16 13.743 0.161 8.798 1.00 14.62 S
599 ATOM 126 CE MET A 16 13.037 1.668 9.384 1.00 17.53 C
600 ATOM 127 N SER A 17 10.343 -2.009 13.045 1.00 15.41 N
601 ATOM 128 CA SER A 17 10.215 -2.248 14.485 1.00 16.73 C
602 ATOM 129 C SER A 17 9.645 -3.639 14.738 1.00 16.08 C
603 ATOM 130 O SER A 17 10.178 -4.379 15.584 1.00 18.39 O
604 ATOM 131 CB SER A 17 9.303 -1.172 15.113 1.00 17.08 C
605 ATOM 132 OG SER A 17 9.231 -1.370 16.546 1.00 20.25 O
606 ATOM 133 N LEU A 18 8.603 -4.007 14.009 1.00 17.24 N
607 ATOM 134 CA LEU A 18 7.993 -5.343 14.145 1.00 17.40 C
608 ATOM 135 C LEU A 18 8.999 -6.439 13.809 1.00 17.57 C
609 ATOM 136 O LEU A 18 9.127 -7.436 14.524 1.00 19.19 O
610 ATOM 137 CB LEU A 18 6.757 -5.487 13.252 1.00 18.58 C
611 ATOM 138 CG LEU A 18 5.539 -4.634 13.612 1.00 21.34 C
612 ATOM 139 CD1 LEU A 18 4.408 -4.815 12.618 1.00 23.10 C
613 ATOM 140 CD2 LEU A 18 5.097 -5.086 15.037 1.00 23.09 C
614 ATOM 141 N ILE A 19 9.801 -6.213 12.768 1.00 16.55 N
615 ATOM 142 CA ILE A 19 10.680 -7.277 12.291 1.00 15.73 C
616 ATOM 143 C ILE A 19 11.904 -7.436 13.176 1.00 16.36 C
617 ATOM 144 O ILE A 19 12.377 -8.523 13.422 1.00 16.63 O
618 ATOM 145 CB ILE A 19 11.133 -6.976 10.845 1.00 14.90 C
619 ATOM 146 CG1 ILE A 19 9.936 -7.046 9.942 1.00 14.03 C
620 ATOM 147 CG2 ILE A 19 12.211 -7.997 10.371 1.00 16.14 C
621 ATOM 148 CD1 ILE A 19 10.251 -6.792 8.496 1.00 19.55 C
622 ATOM 149 N ILE A 20 12.510 -6.307 13.585 1.00 16.30 N
623 ATOM 150 CA ILE A 20 13.705 -6.384 14.410 1.00 16.06 C
624 ATOM 151 C ILE A 20 13.364 -7.000 15.756 1.00 17.71 C
625 ATOM 152 O ILE A 20 14.210 -7.635 16.362 1.00 18.45 O
626 ATOM 153 CB ILE A 20 14.446 -5.021 14.561 1.00 17.18 C
627 ATOM 154 CG1 ILE A 20 15.902 -5.254 14.988 1.00 16.16 C
628 ATOM 155 CG2 ILE A 20 13.671 -4.065 15.543 1.00 18.19 C
629 ATOM 156 CD1 ILE A 20 16.736 -3.966 15.023 1.00 19.08 C
630 ATOM 157 N ASN A 21 12.111 -6.837 16.183 1.00 18.15 N
631 ATOM 158 CA ASN A 21 11.735 -7.389 17.489 1.00 20.14 C
632 ATOM 159 C ASN A 21 11.055 -8.749 17.473 1.00 21.10 C
633 ATOM 160 O ASN A 21 10.930 -9.372 18.538 1.00 22.19 O
634 ATOM 161 CB ASN A 21 10.848 -6.376 18.245 1.00 19.88 C
635 ATOM 162 CG ASN A 21 11.635 -5.173 18.763 1.00 19.89 C
636 ATOM 163 OD1 ASN A 21 12.554 -5.326 19.584 1.00 26.86 O
637 ATOM 164 ND2 ASN A 21 11.325 -3.977 18.255 1.00 21.02 N
638 ATOM 165 N THR A 22 10.597 -9.236 16.315 1.00 20.09 N
639 ATOM 166 CA THR A 22 9.792 -10.438 16.337 1.00 20.83 C
640 ATOM 167 C THR A 22 10.554 -11.666 16.755 1.00 21.40 C
641 ATOM 168 O THR A 22 11.758 -11.820 16.475 1.00 20.89 O
642 ATOM 169 CB THR A 22 9.130 -10.655 15.002 1.00 21.58 C
643 ATOM 170 OG1 THR A 22 8.375 -11.870 15.047 1.00 21.08 O
644 ATOM 171 CG2 THR A 22 10.194 -10.923 13.921 1.00 20.57 C
645 ATOM 172 N VAL A 23 9.836 -12.584 17.401 1.00 21.53 N
646 ATOM 173 CA VAL A 23 10.480 -13.833 17.786 1.00 22.16 C
647 ATOM 174 C VAL A 23 10.234 -14.961 16.787 1.00 22.54 C
648 ATOM 175 O VAL A 23 10.479 -16.119 17.085 1.00 22.96 O
649 ATOM 176 CB VAL A 23 10.118 -14.284 19.247 1.00 22.59 C
650 ATOM 177 CG1 VAL A 23 10.649 -13.294 20.267 1.00 23.39 C
651 ATOM 178 CG2 VAL A 23 8.631 -14.518 19.381 1.00 24.37 C
652 ATOM 179 N TYR A 24 9.757 -14.616 15.591 1.00 21.82 N
653 ATOM 180 CA TYR A 24 9.594 -15.556 14.468 1.00 22.38 C
654 ATOM 181 C TYR A 24 10.749 -16.555 14.358 1.00 22.68 C
655 ATOM 182 O TYR A 24 11.929 -16.165 14.391 1.00 24.00 O
656 ATOM 183 CB TYR A 24 9.524 -14.715 13.173 1.00 22.24 C
657 ATOM 184 CG TYR A 24 9.316 -15.501 11.903 1.00 22.63 C
658 ATOM 185 CD1 TYR A 24 8.089 -16.162 11.643 1.00 22.57 C
659 ATOM 186 CD2 TYR A 24 10.332 -15.603 10.963 1.00 20.99 C
660 ATOM 187 CE1 TYR A 24 7.899 -16.860 10.471 1.00 21.70 C
661 ATOM 188 CE2 TYR A 24 10.157 -16.316 9.787 1.00 23.00 C
662 ATOM 189 CZ TYR A 24 8.944 -16.941 9.548 1.00 23.48 C
663 ATOM 190 OH TYR A 24 8.760 -17.642 8.390 1.00 23.07 O
664 ATOM 191 N SER A 25 10.431 -17.835 14.208 1.00 23.15 N
665 ATOM 192 CA SER A 25 11.454 -18.855 14.244 1.00 25.14 C
666 ATOM 193 C SER A 25 12.383 -18.922 13.024 1.00 24.97 C
667 ATOM 194 O SER A 25 13.599 -19.047 13.167 1.00 27.74 O
668 ATOM 195 CB SER A 25 10.823 -20.237 14.485 1.00 25.30 C
669 ATOM 196 OG SER A 25 10.036 -20.633 13.378 1.00 31.33 O
670 ATOM 197 N ASN A 26 11.798 -18.803 11.838 1.00 23.87 N
671 ATOM 198 CA ASN A 26 12.496 -19.085 10.593 1.00 22.96 C
672 ATOM 199 C ASN A 26 13.247 -17.877 10.025 1.00 21.23 C
673 ATOM 200 O ASN A 26 12.992 -17.475 8.889 1.00 21.66 O
674 ATOM 201 CB ASN A 26 11.544 -19.663 9.550 1.00 24.64 C
675 ATOM 202 CG ASN A 26 12.270 -20.539 8.497 1.00 28.78 C
676 ATOM 203 OD1 ASN A 26 13.306 -21.164 8.787 1.00 38.08 O
677 ATOM 204 ND2 ASN A 26 11.720 -20.593 7.290 1.00 36.26 N
678 ATOM 205 N LYS A 27 14.176 -17.357 10.812 1.00 20.46 N
679 ATOM 206 CA LYS A 27 14.887 -16.108 10.416 1.00 19.75 C
680 ATOM 207 C LYS A 27 15.671 -16.267 9.129 1.00 19.93 C
681 ATOM 208 O LYS A 27 15.891 -15.253 8.412 1.00 17.92 O
682 ATOM 209 CB LYS A 27 15.768 -15.579 11.552 1.00 19.28 C
683 ATOM 210 CG LYS A 27 14.969 -15.026 12.730 1.00 22.26 C
684 ATOM 211 CD LYS A 27 15.824 -14.970 13.974 1.00 27.88 C
685 ATOM 212 CE LYS A 27 15.074 -14.344 15.172 1.00 32.92 C
686 ATOM 213 NZ LYS A 27 15.235 -12.881 15.161 1.00 27.85 N
687 ATOM 214 N GLU A 28 16.016 -17.502 8.765 1.00 19.23 N
688 ATOM 215 CA GLU A 28 16.848 -17.692 7.578 1.00 18.59 C
689 ATOM 216 C GLU A 28 16.212 -17.196 6.255 1.00 19.16 C
690 ATOM 217 O GLU A 28 16.907 -17.053 5.241 1.00 18.42 O
691 ATOM 218 CB GLU A 28 17.256 -19.175 7.445 1.00 19.75 C
692 ATOM 219 CG GLU A 28 16.147 -20.029 6.898 1.00 21.64 C
693 ATOM 220 CD GLU A 28 16.495 -21.511 6.935 1.00 27.68 C
694 ATOM 221 OE1 GLU A 28 17.064 -21.954 7.950 1.00 31.50 O
695 ATOM 222 OE2 GLU A 28 16.189 -22.218 5.965 1.00 29.17 O
696 ATOM 223 N ILE A 29 14.903 -16.924 6.253 1.00 18.52 N
697 ATOM 224 CA ILE A 29 14.232 -16.474 5.048 1.00 19.25 C
698 ATOM 225 C ILE A 29 14.761 -15.121 4.554 1.00 16.72 C
699 ATOM 226 O ILE A 29 14.521 -14.730 3.416 1.00 17.64 O
700 ATOM 227 CB ILE A 29 12.685 -16.398 5.258 1.00 21.15 C
701 ATOM 228 CG1 ILE A 29 12.322 -15.367 6.301 1.00 23.38 C
702 ATOM 229 CG2 ILE A 29 12.130 -17.761 5.592 1.00 24.43 C
703 ATOM 230 CD1 ILE A 29 11.831 -14.115 5.693 1.00 30.18 C
704 ATOM 231 N PHE A 30 15.473 -14.416 5.409 1.00 15.77 N
705 ATOM 232 CA PHE A 30 15.999 -13.123 4.971 1.00 15.38 C
706 ATOM 233 C PHE A 30 16.868 -13.300 3.733 1.00 14.93 C
707 ATOM 234 O PHE A 30 16.874 -12.453 2.841 1.00 14.87 O
708 ATOM 235 CB PHE A 30 16.804 -12.414 6.068 1.00 14.77 C
709 ATOM 236 CG PHE A 30 18.227 -12.889 6.186 1.00 15.59 C
710 ATOM 237 CD1 PHE A 30 19.266 -12.200 5.563 1.00 15.68 C
711 ATOM 238 CD2 PHE A 30 18.526 -14.040 6.899 1.00 16.71 C
712 ATOM 239 CE1 PHE A 30 20.573 -12.675 5.658 1.00 15.08 C
713 ATOM 240 CE2 PHE A 30 19.818 -14.529 6.997 1.00 17.37 C
714 ATOM 241 CZ PHE A 30 20.876 -13.831 6.366 1.00 16.40 C
715 ATOM 242 N LEU A 31 17.628 -14.392 3.701 1.00 14.51 N
716 ATOM 243 CA LEU A 31 18.619 -14.550 2.601 1.00 14.88 C
717 ATOM 244 C LEU A 31 17.935 -14.729 1.252 1.00 15.81 C
718 ATOM 245 O LEU A 31 18.366 -14.182 0.246 1.00 15.41 O
719 ATOM 246 CB LEU A 31 19.615 -15.677 2.935 1.00 14.46 C
720 ATOM 247 CG LEU A 31 20.798 -15.661 1.967 1.00 16.52 C
721 ATOM 248 CD1 LEU A 31 21.592 -14.382 2.076 1.00 18.11 C
722 ATOM 249 CD2 LEU A 31 21.707 -16.842 2.335 1.00 19.15 C
723 ATOM 250 N ARG A 32 16.866 -15.510 1.217 1.00 14.66 N
724 ATOM 251 CA ARG A 32 16.105 -15.591 -0.015 1.00 15.94 C
725 ATOM 252 C ARG A 32 15.599 -14.266 -0.527 1.00 15.08 C
726 ATOM 253 O ARG A 32 15.628 -13.961 -1.707 1.00 14.59 O
727 ATOM 254 CB ARG A 32 14.931 -16.544 0.192 1.00 17.02 C
728 ATOM 255 CG ARG A 32 14.060 -16.647 -1.006 1.00 21.60 C
729 ATOM 256 N GLU A 33 15.102 -13.432 0.375 1.00 14.07 N
730 ATOM 257 CA GLU A 33 14.563 -12.176 -0.092 1.00 13.86 C
731 ATOM 258 C GLU A 33 15.666 -11.268 -0.622 1.00 12.47 C
732 ATOM 259 O GLU A 33 15.479 -10.556 -1.570 1.00 14.44 O
733 ATOM 260 CB GLU A 33 13.825 -11.436 1.033 1.00 14.67 C
734 ATOM 261 CG GLU A 33 12.642 -12.229 1.563 1.00 17.13 C
735 ATOM 262 CD GLU A 33 11.572 -12.404 0.510 1.00 20.17 C
736 ATOM 263 OE1 GLU A 33 11.467 -11.604 -0.413 1.00 20.09 O
737 ATOM 264 OE2 GLU A 33 10.889 -13.467 0.567 1.00 24.99 O
738 ATOM 265 N LEU A 34 16.824 -11.287 0.015 1.00 13.39 N
739 ATOM 266 CA LEU A 34 17.891 -10.392 -0.456 1.00 12.89 C
740 ATOM 267 C LEU A 34 18.503 -10.935 -1.771 1.00 12.50 C
741 ATOM 268 O LEU A 34 18.916 -10.154 -2.649 1.00 12.65 O
742 ATOM 269 CB LEU A 34 18.940 -10.227 0.644 1.00 12.93 C
743 ATOM 270 CG LEU A 34 18.466 -9.646 1.990 1.00 12.89 C
744 ATOM 271 CD1 LEU A 34 19.716 -9.397 2.845 1.00 14.02 C
745 ATOM 272 CD2 LEU A 34 17.688 -8.346 1.788 1.00 13.51 C
746 ATOM 273 N ILE A 35 18.556 -12.262 -1.921 1.00 12.47 N
747 ATOM 274 CA ILE A 35 19.039 -12.848 -3.183 1.00 12.88 C
748 ATOM 275 C ILE A 35 18.034 -12.523 -4.304 1.00 13.04 C
749 ATOM 276 O ILE A 35 18.399 -12.159 -5.407 1.00 13.57 O
750 ATOM 277 CB ILE A 35 19.287 -14.370 -3.030 1.00 12.90 C
751 ATOM 278 CG1 ILE A 35 20.522 -14.589 -2.177 1.00 13.18 C
752 ATOM 279 CG2 ILE A 35 19.378 -15.023 -4.483 1.00 12.63 C
753 ATOM 280 CD1 ILE A 35 20.810 -16.071 -1.854 1.00 16.31 C
754 ATOM 281 N SER A 36 16.764 -12.596 -3.974 1.00 14.35 N
755 ATOM 282 CA SER A 36 15.734 -12.221 -4.937 1.00 13.99 C
756 ATOM 283 C SER A 36 15.874 -10.755 -5.382 1.00 14.51 C
757 ATOM 284 O SER A 36 15.782 -10.423 -6.584 1.00 14.23 O
758 ATOM 285 CB SER A 36 14.358 -12.432 -4.293 1.00 16.17 C
759 ATOM 286 OG SER A 36 13.375 -12.084 -5.239 1.00 21.10 O
760 ATOM 287 N ASN A 37 16.092 -9.845 -4.422 1.00 13.05 N
761 ATOM 288 CA ASN A 37 16.265 -8.459 -4.810 1.00 12.99 C
762 ATOM 289 C ASN A 37 17.497 -8.223 -5.690 1.00 13.12 C
763 ATOM 290 O ASN A 37 17.456 -7.431 -6.621 1.00 13.24 O
764 ATOM 291 CB ASN A 37 16.388 -7.582 -3.559 1.00 13.52 C
765 ATOM 292 CG ASN A 37 15.069 -7.371 -2.840 1.00 17.86 C
766 ATOM 293 OD1 ASN A 37 15.033 -6.613 -1.866 1.00 23.35 O
767 ATOM 294 ND2 ASN A 37 14.028 -8.001 -3.271 1.00 16.49 N
768 ATOM 295 N ALA A 38 18.584 -8.907 -5.326 1.00 12.77 N
769 ATOM 296 CA ALA A 38 19.815 -8.876 -6.125 1.00 13.02 C
770 ATOM 297 C ALA A 38 19.535 -9.340 -7.553 1.00 12.05 C
771 ATOM 298 O ALA A 38 19.988 -8.695 -8.507 1.00 12.25 O
772 ATOM 299 CB ALA A 38 20.902 -9.742 -5.476 1.00 13.69 C
773 ATOM 300 N SER A 39 18.824 -10.448 -7.656 1.00 13.06 N
774 ATOM 301 CA SER A 39 18.500 -11.003 -8.988 1.00 12.93 C
775 ATOM 302 C SER A 39 17.668 -10.003 -9.769 1.00 13.20 C
776 ATOM 303 O SER A 39 17.896 -9.778 -10.955 1.00 13.96 O
777 ATOM 304 CB SER A 39 17.768 -12.340 -8.805 1.00 14.53 C
778 ATOM 305 OG SER A 39 17.439 -12.927 -10.093 1.00 17.61 O
779 ATOM 306 N ASP A 40 16.714 -9.364 -9.110 1.00 13.40 N
780 ATOM 307 CA ASP A 40 15.893 -8.381 -9.796 1.00 14.26 C
781 ATOM 308 C ASP A 40 16.747 -7.228 -10.322 1.00 14.50 C
782 ATOM 309 O ASP A 40 16.553 -6.715 -11.410 1.00 13.85 O
783 ATOM 310 CB ASP A 40 14.834 -7.840 -8.854 1.00 16.11 C
784 ATOM 311 CG ASP A 40 13.750 -8.871 -8.539 1.00 20.50 C
785 ATOM 312 OD1 ASP A 40 13.700 -9.955 -9.196 1.00 26.06 O
786 ATOM 313 OD2 ASP A 40 12.878 -8.665 -7.660 1.00 26.67 O
787 ATOM 314 N ALA A 41 17.719 -6.761 -9.513 1.00 12.23 N
788 ATOM 315 CA ALA A 41 18.537 -5.647 -9.954 1.00 11.86 C
789 ATOM 316 C ALA A 41 19.427 -6.029 -11.116 1.00 12.19 C
790 ATOM 317 O ALA A 41 19.742 -5.187 -11.971 1.00 12.46 O
791 ATOM 318 CB ALA A 41 19.432 -5.156 -8.748 1.00 13.68 C
792 ATOM 319 N LEU A 42 19.865 -7.290 -11.128 1.00 11.91 N
793 ATOM 320 CA LEU A 42 20.674 -7.797 -12.243 1.00 11.90 C
794 ATOM 321 C LEU A 42 19.749 -7.920 -13.504 1.00 11.89 C
795 ATOM 322 O LEU A 42 20.170 -7.626 -14.625 1.00 13.86 O
796 ATOM 323 CB LEU A 42 21.217 -9.177 -11.867 1.00 11.79 C
797 ATOM 324 CG LEU A 42 22.425 -9.047 -10.930 1.00 10.59 C
798 ATOM 325 CD1 LEU A 42 22.603 -10.336 -10.157 1.00 10.82 C
799 ATOM 326 CD2 LEU A 42 23.702 -8.749 -11.716 1.00 12.07 C
800 ATOM 327 N ASP A 43 18.505 -8.314 -13.300 1.00 12.39 N
801 ATOM 328 CA ASP A 43 17.550 -8.346 -14.413 1.00 14.12 C
802 ATOM 329 C ASP A 43 17.472 -6.988 -15.010 1.00 14.73 C
803 ATOM 330 O ASP A 43 17.430 -6.823 -16.223 1.00 14.72 O
804 ATOM 331 CB ASP A 43 16.183 -8.851 -13.984 1.00 14.76 C
805 ATOM 332 CG ASP A 43 16.116 -10.337 -13.724 1.00 15.12 C
806 ATOM 333 OD1 ASP A 43 15.049 -10.695 -13.145 1.00 19.52 O
807 ATOM 334 OD2 ASP A 43 17.016 -11.183 -14.007 1.00 16.95 O
808 ATOM 335 N LYS A 44 17.408 -5.979 -14.150 1.00 13.53 N
809 ATOM 336 CA LYS A 44 17.230 -4.615 -14.651 1.00 14.22 C
810 ATOM 337 C LYS A 44 18.400 -4.117 -15.496 1.00 14.37 C
811 ATOM 338 O LYS A 44 18.200 -3.518 -16.552 1.00 14.29 O
812 ATOM 339 CB LYS A 44 16.846 -3.598 -13.544 1.00 14.30 C
813 ATOM 340 CG LYS A 44 15.539 -3.893 -12.801 1.00 20.28 C
814 ATOM 341 CD LYS A 44 14.353 -4.070 -13.683 1.00 29.20 C
815 ATOM 342 CE LYS A 44 13.036 -3.998 -12.860 1.00 34.00 C
816 ATOM 343 NZ LYS A 44 12.369 -5.335 -12.692 1.00 35.02 N
817 ATOM 344 N ILE A 45 19.626 -4.362 -15.059 1.00 12.95 N
818 ATOM 345 CA ILE A 45 20.735 -3.896 -15.872 1.00 14.59 C
819 ATOM 346 C ILE A 45 20.852 -4.701 -17.175 1.00 14.56 C
820 ATOM 347 O ILE A 45 21.233 -4.101 -18.198 1.00 15.02 O
821 ATOM 348 CB ILE A 45 22.056 -3.855 -15.090 1.00 14.32 C
822 ATOM 349 CG1 ILE A 45 23.162 -3.181 -15.927 1.00 15.55 C
823 ATOM 350 CG2 ILE A 45 22.423 -5.236 -14.629 1.00 16.09 C
824 ATOM 351 CD1 ILE A 45 22.910 -1.689 -16.070 1.00 18.20 C
825 ATOM 352 N ARG A 46 20.508 -5.989 -17.141 1.00 14.66 N
826 ATOM 353 CA ARG A 46 20.579 -6.808 -18.364 1.00 16.20 C
827 ATOM 354 C ARG A 46 19.556 -6.247 -19.347 1.00 15.98 C
828 ATOM 355 O ARG A 46 19.843 -6.064 -20.535 1.00 16.23 O
829 ATOM 356 CB ARG A 46 20.245 -8.253 -18.050 1.00 17.46 C
830 ATOM 357 CG ARG A 46 20.530 -9.253 -19.145 1.00 24.26 C
831 ATOM 358 CD ARG A 46 20.930 -10.638 -18.524 1.00 28.56 C
832 ATOM 359 NE ARG A 46 19.873 -11.086 -17.618 1.00 33.89 N
833 ATOM 360 CZ ARG A 46 18.778 -11.691 -18.032 1.00 33.07 C
834 ATOM 361 NH1 ARG A 46 18.636 -11.951 -19.332 1.00 35.89 N
835 ATOM 362 NH2 ARG A 46 17.837 -12.064 -17.170 1.00 33.67 N
836 ATOM 363 N TYR A 47 18.358 -5.990 -18.855 1.00 14.80 N
837 ATOM 364 CA TYR A 47 17.297 -5.490 -19.747 1.00 14.96 C
838 ATOM 365 C TYR A 47 17.651 -4.098 -20.298 1.00 14.96 C
839 ATOM 366 O TYR A 47 17.504 -3.809 -21.513 1.00 16.15 O
840 ATOM 367 CB TYR A 47 15.953 -5.448 -19.003 1.00 13.85 C
841 ATOM 368 CG TYR A 47 14.805 -5.177 -19.933 1.00 14.55 C
842 ATOM 369 CD1 TYR A 47 14.095 -6.205 -20.490 1.00 17.13 C
843 ATOM 370 CD2 TYR A 47 14.443 -3.880 -20.181 1.00 16.54 C
844 ATOM 371 CE1 TYR A 47 13.040 -5.905 -21.377 1.00 20.17 C
845 ATOM 372 CE2 TYR A 47 13.412 -3.580 -21.027 1.00 20.37 C
846 ATOM 373 CZ TYR A 47 12.735 -4.594 -21.596 1.00 19.46 C
847 ATOM 374 OH TYR A 47 11.705 -4.176 -22.427 1.00 27.15 O
848 ATOM 375 N LYS A 48 18.162 -3.216 -19.436 1.00 13.95 N
849 ATOM 376 CA LYS A 48 18.519 -1.879 -19.871 1.00 14.91 C
850 ATOM 377 C LYS A 48 19.582 -1.965 -20.949 1.00 15.86 C
851 ATOM 378 O LYS A 48 19.540 -1.200 -21.937 1.00 17.33 O
852 ATOM 379 CB LYS A 48 19.000 -1.017 -18.683 1.00 16.15 C
853 ATOM 380 CG LYS A 48 19.371 0.429 -19.050 1.00 17.06 C
854 ATOM 381 CD LYS A 48 19.813 1.160 -17.800 1.00 23.42 C
855 ATOM 382 CE LYS A 48 19.836 2.668 -17.965 1.00 28.37 C
856 ATOM 383 NZ LYS A 48 19.344 3.214 -16.637 1.00 30.37 N
857 ATOM 384 N SER A 49 20.498 -2.915 -20.810 1.00 15.95 N
858 ATOM 385 CA SER A 49 21.632 -3.040 -21.710 1.00 16.76 C
859 ATOM 386 C SER A 49 21.223 -3.556 -23.104 1.00 16.96 C
860 ATOM 387 O SER A 49 22.049 -3.487 -24.018 1.00 18.21 O
861 ATOM 388 CB SER A 49 22.712 -3.971 -21.115 1.00 19.00 C
862 ATOM 389 OG SER A 49 22.367 -5.349 -21.248 1.00 24.42 O
863 ATOM 390 N LEU A 50 20.009 -4.083 -23.243 1.00 17.32 N
864 ATOM 391 CA LEU A 50 19.537 -4.568 -24.555 1.00 17.68 C
865 ATOM 392 C LEU A 50 19.563 -3.447 -25.555 1.00 18.56 C
866 ATOM 393 O LEU A 50 19.818 -3.659 -26.718 1.00 19.54 O
867 ATOM 394 CB LEU A 50 18.087 -5.058 -24.466 1.00 17.57 C
868 ATOM 395 CG LEU A 50 17.910 -6.349 -23.712 1.00 17.37 C
869 ATOM 396 CD1 LEU A 50 16.418 -6.638 -23.599 1.00 21.58 C
870 ATOM 397 CD2 LEU A 50 18.650 -7.488 -24.415 1.00 22.19 C
871 ATOM 398 N SER A 51 19.301 -2.242 -25.088 1.00 18.17 N
872 ATOM 399 CA SER A 51 19.308 -1.058 -25.958 1.00 18.25 C
873 ATOM 400 C SER A 51 20.368 -0.026 -25.629 1.00 20.34 C
874 ATOM 401 O SER A 51 20.533 0.979 -26.326 1.00 21.20 O
875 ATOM 402 CB SER A 51 17.944 -0.380 -25.935 1.00 20.69 C
876 ATOM 403 OG SER A 51 16.959 -1.243 -26.460 1.00 22.34 O
877 ATOM 404 N ASP A 52 21.211 -0.319 -24.638 1.00 20.30 N
878 ATOM 405 CA ASP A 52 22.284 0.598 -24.236 1.00 20.67 C
879 ATOM 406 C ASP A 52 23.417 -0.314 -23.686 1.00 21.11 C
880 ATOM 407 O ASP A 52 23.678 -0.378 -22.482 1.00 20.46 O
881 ATOM 408 CB ASP A 52 21.731 1.542 -23.151 1.00 21.13 C
882 ATOM 409 CG ASP A 52 22.635 2.735 -22.863 1.00 21.46 C
883 ATOM 410 OD1 ASP A 52 23.785 2.778 -23.330 1.00 23.40 O
884 ATOM 411 OD2 ASP A 52 22.241 3.669 -22.139 1.00 26.89 O
885 ATOM 412 N PRO A 53 24.032 -1.080 -24.553 1.00 20.60 N
886 ATOM 413 CA PRO A 53 25.077 -2.043 -24.203 1.00 20.82 C
887 ATOM 414 C PRO A 53 26.261 -1.471 -23.397 1.00 21.27 C
888 ATOM 415 O PRO A 53 26.871 -2.219 -22.591 1.00 21.38 O
889 ATOM 416 CB PRO A 53 25.542 -2.563 -25.572 1.00 22.97 C
890 ATOM 417 CG PRO A 53 24.879 -1.646 -26.583 1.00 22.00 C
891 ATOM 418 CD PRO A 53 23.654 -1.169 -25.972 1.00 21.84 C
892 ATOM 419 N LYS A 54 26.569 -0.193 -23.565 1.00 21.87 N
893 ATOM 420 CA LYS A 54 27.712 0.367 -22.853 1.00 21.49 C
894 ATOM 421 C LYS A 54 27.440 0.332 -21.349 1.00 21.44 C
895 ATOM 422 O LYS A 54 28.371 0.388 -20.528 1.00 20.69 O
896 ATOM 423 CB LYS A 54 27.965 1.803 -23.276 1.00 22.79 C
897 ATOM 424 CG LYS A 54 29.345 2.276 -22.872 1.00 28.00 C
898 ATOM 425 N GLN A 55 26.180 0.202 -20.987 1.00 19.49 N
899 ATOM 426 CA GLN A 55 25.841 0.214 -19.554 1.00 18.45 C
900 ATOM 427 C GLN A 55 26.484 -0.922 -18.797 1.00 18.80 C
901 ATOM 428 O GLN A 55 26.635 -0.824 -17.555 1.00 17.82 O
902 ATOM 429 CB GLN A 55 24.329 0.202 -19.313 1.00 18.52 C
903 ATOM 430 CG GLN A 55 23.595 1.399 -19.882 1.00 19.34 C
904 ATOM 431 CD GLN A 55 23.429 2.547 -18.902 1.00 25.19 C
905 ATOM 432 OE1 GLN A 55 23.674 2.392 -17.696 1.00 23.31 O
906 ATOM 433 NE2 GLN A 55 22.977 3.692 -19.397 1.00 23.87 N
907 ATOM 434 N LEU A 56 26.775 -2.016 -19.475 1.00 17.43 N
908 ATOM 435 CA LEU A 56 27.393 -3.154 -18.815 1.00 17.45 C
909 ATOM 436 C LEU A 56 28.878 -2.947 -18.575 1.00 18.38 C
910 ATOM 437 O LEU A 56 29.459 -3.657 -17.754 1.00 19.36 O
911 ATOM 438 CB LEU A 56 27.215 -4.428 -19.654 1.00 18.46 C
912 ATOM 439 CG LEU A 56 25.807 -5.000 -19.689 1.00 18.40 C
913 ATOM 440 CD1 LEU A 56 25.687 -6.068 -20.820 1.00 22.89 C
914 ATOM 441 CD2 LEU A 56 25.490 -5.626 -18.309 1.00 22.83 C
915 ATOM 442 N GLU A 57 29.500 -2.003 -19.271 1.00 19.23 N
916 ATOM 443 CA GLU A 57 30.970 -1.890 -19.240 1.00 20.61 C
917 ATOM 444 C GLU A 57 31.592 -1.561 -17.889 1.00 20.46 C
918 ATOM 445 O GLU A 57 32.759 -1.873 -17.658 1.00 20.98 O
919 ATOM 446 CB GLU A 57 31.460 -0.893 -20.293 1.00 22.20 C
920 ATOM 447 CG GLU A 57 31.153 -1.356 -21.697 1.00 25.86 C
921 ATOM 448 CD GLU A 57 31.726 -0.397 -22.740 1.00 31.79 C
922 ATOM 449 OE1 GLU A 57 32.596 0.426 -22.388 1.00 35.41 O
923 ATOM 450 OE2 GLU A 57 31.303 -0.472 -23.912 1.00 36.24 O
924 ATOM 451 N THR A 58 30.803 -0.948 -17.009 1.00 18.87 N
925 ATOM 452 CA THR A 58 31.323 -0.612 -15.687 1.00 18.57 C
926 ATOM 453 C THR A 58 31.541 -1.826 -14.833 1.00 17.97 C
927 ATOM 454 O THR A 58 32.281 -1.768 -13.862 1.00 18.08 O
928 ATOM 455 CB THR A 58 30.380 0.313 -14.956 1.00 16.87 C
929 ATOM 456 OG1 THR A 58 29.037 -0.104 -15.221 1.00 17.30 O
930 ATOM 457 CG2 THR A 58 30.460 1.693 -15.554 1.00 19.24 C
931 ATOM 458 N GLU A 59 30.948 -2.952 -15.217 1.00 18.08 N
932 ATOM 459 CA GLU A 59 31.133 -4.223 -14.512 1.00 17.74 C
933 ATOM 460 C GLU A 59 30.465 -5.278 -15.358 1.00 18.87 C
934 ATOM 461 O GLU A 59 29.340 -5.693 -15.107 1.00 18.80 O
935 ATOM 462 CB GLU A 59 30.446 -4.174 -13.145 1.00 19.29 C
936 ATOM 463 CG GLU A 59 30.503 -5.516 -12.431 1.00 21.21 C
937 ATOM 464 CD GLU A 59 31.893 -6.104 -12.433 1.00 24.41 C
938 ATOM 465 OE1 GLU A 59 32.645 -5.796 -11.480 1.00 29.01 O
939 ATOM 466 OE2 GLU A 59 32.256 -6.862 -13.373 1.00 24.34 O
940 ATOM 467 N PRO A 60 31.236 -5.816 -16.300 1.00 18.63 N
941 ATOM 468 CA PRO A 60 30.693 -6.771 -17.261 1.00 19.32 C
942 ATOM 469 C PRO A 60 30.265 -8.084 -16.659 1.00 19.20 C
943 ATOM 470 O PRO A 60 29.477 -8.800 -17.276 1.00 21.25 O
944 ATOM 471 CB PRO A 60 31.862 -7.022 -18.236 1.00 19.50 C
945 ATOM 472 CG PRO A 60 32.881 -6.005 -17.936 1.00 21.70 C
946 ATOM 473 CD PRO A 60 32.672 -5.526 -16.503 1.00 19.71 C
947 ATOM 474 N ASP A 61 30.799 -8.435 -15.493 1.00 19.17 N
948 ATOM 475 CA ASP A 61 30.492 -9.706 -14.826 1.00 19.75 C
949 ATOM 476 C ASP A 61 29.175 -9.531 -14.026 1.00 19.06 C
950 ATOM 477 O ASP A 61 29.070 -8.618 -13.213 1.00 19.50 O
951 ATOM 478 CB ASP A 61 31.634 -10.065 -13.905 1.00 19.45 C
952 ATOM 479 CG ASP A 61 32.766 -10.796 -14.643 1.00 25.63 C
953 ATOM 480 OD1 ASP A 61 32.480 -11.291 -15.752 1.00 32.09 O
954 ATOM 481 OD2 ASP A 61 33.929 -10.846 -14.225 1.00 30.10 O
955 ATOM 482 N LEU A 62 28.200 -10.423 -14.281 1.00 17.71 N
956 ATOM 483 CA LEU A 62 26.872 -10.405 -13.599 1.00 16.84 C
957 ATOM 484 C LEU A 62 26.811 -11.503 -12.563 1.00 16.65 C
958 ATOM 485 O LEU A 62 26.804 -12.678 -12.901 1.00 17.45 O
959 ATOM 486 CB LEU A 62 25.729 -10.553 -14.595 1.00 17.76 C
960 ATOM 487 CG LEU A 62 25.738 -9.589 -15.774 1.00 19.97 C
961 ATOM 488 CD1 LEU A 62 24.442 -9.721 -16.546 1.00 24.98 C
962 ATOM 489 CD2 LEU A 62 25.902 -8.159 -15.283 1.00 24.27 C
963 ATOM 490 N PHE A 63 26.773 -11.121 -11.275 1.00 14.60 N
964 ATOM 491 CA PHE A 63 26.878 -12.095 -10.204 1.00 14.18 C
965 ATOM 492 C PHE A 63 26.203 -11.611 -8.922 1.00 12.23 C
966 ATOM 493 O PHE A 63 25.930 -10.413 -8.792 1.00 13.01 O
967 ATOM 494 CB PHE A 63 28.387 -12.375 -9.875 1.00 14.58 C
968 ATOM 495 CG PHE A 63 29.150 -11.134 -9.474 1.00 16.43 C
969 ATOM 496 CD1 PHE A 63 29.164 -10.714 -8.140 1.00 17.33 C
970 ATOM 497 CD2 PHE A 63 29.787 -10.349 -10.427 1.00 16.27 C
971 ATOM 498 CE1 PHE A 63 29.830 -9.560 -7.740 1.00 16.94 C
972 ATOM 499 CE2 PHE A 63 30.469 -9.164 -10.042 1.00 15.90 C
973 ATOM 500 CZ PHE A 63 30.486 -8.768 -8.681 1.00 17.80 C
974 ATOM 501 N ILE A 64 25.976 -12.569 -8.029 1.00 12.55 N
975 ATOM 502 CA ILE A 64 25.568 -12.290 -6.654 1.00 13.47 C
976 ATOM 503 C ILE A 64 26.701 -12.910 -5.817 1.00 14.61 C
977 ATOM 504 O ILE A 64 27.173 -14.025 -6.103 1.00 15.90 O
978 ATOM 505 CB ILE A 64 24.233 -12.954 -6.355 1.00 12.93 C
979 ATOM 506 CG1 ILE A 64 23.179 -12.381 -7.293 1.00 12.51 C
980 ATOM 507 CG2 ILE A 64 23.858 -12.751 -4.859 1.00 14.64 C
981 ATOM 508 CD1 ILE A 64 21.821 -13.108 -7.196 1.00 14.58 C
982 ATOM 509 N ARG A 65 27.182 -12.171 -4.815 1.00 13.37 N
983 ATOM 510 CA ARG A 65 28.352 -12.627 -4.070 1.00 13.72 C
984 ATOM 511 C ARG A 65 28.104 -12.417 -2.594 1.00 12.95 C
985 ATOM 512 O ARG A 65 27.690 -11.334 -2.176 1.00 13.38 O
986 ATOM 513 CB ARG A 65 29.597 -11.853 -4.532 1.00 13.58 C
987 ATOM 514 CG ARG A 65 30.881 -12.267 -3.777 1.00 15.26 C
988 ATOM 515 CD ARG A 65 32.138 -11.550 -4.320 1.00 18.55 C
989 ATOM 516 NE ARG A 65 32.254 -11.791 -5.760 1.00 20.69 N
990 ATOM 517 CZ ARG A 65 32.780 -10.952 -6.642 1.00 21.46 C
991 ATOM 518 NH1 ARG A 65 33.317 -9.790 -6.278 1.00 22.25 N
992 ATOM 519 NH2 ARG A 65 32.767 -11.312 -7.921 1.00 22.58 N
993 ATOM 520 N ILE A 66 28.331 -13.455 -1.800 1.00 12.08 N
994 ATOM 521 CA ILE A 66 28.068 -13.377 -0.382 1.00 12.85 C
995 ATOM 522 C ILE A 66 29.415 -13.499 0.344 1.00 13.11 C
996 ATOM 523 O ILE A 66 30.131 -14.475 0.107 1.00 13.10 O
997 ATOM 524 CB ILE A 66 27.113 -14.529 0.018 1.00 12.84 C
998 ATOM 525 CG1 ILE A 66 25.767 -14.304 -0.700 1.00 16.82 C
999 ATOM 526 CG2 ILE A 66 26.908 -14.541 1.518 1.00 13.90 C
1000 ATOM 527 CD1 ILE A 66 24.900 -15.521 -0.616 1.00 20.38 C
1001 ATOM 528 N THR A 67 29.736 -12.546 1.224 1.00 12.90 N
1002 ATOM 529 CA THR A 67 31.015 -12.476 1.966 1.00 13.50 C
1003 ATOM 530 C THR A 67 30.788 -12.327 3.447 1.00 14.05 C
1004 ATOM 531 O THR A 67 30.462 -11.243 3.934 1.00 12.95 O
1005 ATOM 532 CB THR A 67 31.841 -11.273 1.485 1.00 13.52 C
1006 ATOM 533 OG1 THR A 67 32.031 -11.340 0.065 1.00 14.65 O
1007 ATOM 534 CG2 THR A 67 33.251 -11.338 2.061 1.00 12.87 C
1008 ATOM 535 N PRO A 68 31.000 -13.388 4.211 1.00 15.08 N
1009 ATOM 536 CA PRO A 68 30.992 -13.205 5.656 1.00 15.99 C
1010 ATOM 537 C PRO A 68 32.274 -12.530 6.125 1.00 16.99 C
1011 ATOM 538 O PRO A 68 33.354 -12.809 5.583 1.00 17.28 O
1012 ATOM 539 CB PRO A 68 30.926 -14.642 6.216 1.00 16.79 C
1013 ATOM 540 CG PRO A 68 31.182 -15.510 5.112 1.00 18.04 C
1014 ATOM 541 CD PRO A 68 31.165 -14.783 3.795 1.00 16.14 C
1015 ATOM 542 N LYS A 69 32.144 -11.632 7.087 1.00 16.62 N
1016 ATOM 543 CA LYS A 69 33.264 -10.931 7.705 1.00 17.18 C
1017 ATOM 544 C LYS A 69 33.165 -11.130 9.206 1.00 18.71 C
1018 ATOM 545 O LYS A 69 32.718 -10.229 9.930 1.00 16.77 O
1019 ATOM 546 CB LYS A 69 33.216 -9.454 7.355 1.00 17.12 C
1020 ATOM 547 CG LYS A 69 33.457 -9.194 5.847 1.00 17.38 C
1021 ATOM 548 CD LYS A 69 33.436 -7.691 5.570 1.00 18.98 C
1022 ATOM 549 CE LYS A 69 33.964 -7.347 4.160 1.00 21.71 C
1023 ATOM 550 NZ LYS A 69 33.957 -5.867 3.919 1.00 22.59 N
1024 ATOM 551 N PRO A 70 33.626 -12.297 9.650 1.00 20.56 N
1025 ATOM 552 CA PRO A 70 33.454 -12.729 11.055 1.00 22.21 C
1026 ATOM 553 C PRO A 70 33.941 -11.728 12.090 1.00 23.44 C
1027 ATOM 554 O PRO A 70 33.165 -11.417 12.995 1.00 24.42 O
1028 ATOM 555 CB PRO A 70 34.241 -14.041 11.107 1.00 22.44 C
1029 ATOM 556 CG PRO A 70 34.290 -14.544 9.686 1.00 24.03 C
1030 ATOM 557 CD PRO A 70 34.316 -13.311 8.836 1.00 20.93 C
1031 ATOM 558 N GLU A 71 35.157 -11.201 11.950 1.00 24.87 N
1032 ATOM 559 CA GLU A 71 35.680 -10.283 12.947 1.00 25.52 C
1033 ATOM 560 C GLU A 71 34.784 -9.077 13.183 1.00 25.63 C
1034 ATOM 561 O GLU A 71 34.666 -8.604 14.296 1.00 26.65 O
1035 ATOM 562 CB GLU A 71 37.086 -9.778 12.558 1.00 27.14 C
1036 ATOM 563 N GLN A 72 34.125 -8.588 12.137 1.00 22.63 N
1037 ATOM 564 CA GLN A 72 33.201 -7.466 12.306 1.00 21.99 C
1038 ATOM 565 C GLN A 72 31.739 -7.891 12.529 1.00 19.55 C
1039 ATOM 566 O GLN A 72 30.891 -7.010 12.685 1.00 20.60 O
1040 ATOM 567 CB GLN A 72 33.262 -6.507 11.115 1.00 22.56 C
1041 ATOM 568 CG GLN A 72 34.685 -6.033 10.771 1.00 27.88 C
1042 ATOM 569 CD GLN A 72 35.270 -6.873 9.650 1.00 33.64 C
1043 ATOM 570 OE1 GLN A 72 35.560 -8.056 9.850 1.00 35.29 O
1044 ATOM 571 NE2 GLN A 72 35.374 -6.292 8.447 1.00 34.20 N
1045 ATOM 572 N LYS A 73 31.474 -9.193 12.551 1.00 18.63 N
1046 ATOM 573 CA LYS A 73 30.120 -9.693 12.708 1.00 17.46 C
1047 ATOM 574 C LYS A 73 29.261 -9.132 11.621 1.00 15.77 C
1048 ATOM 575 O LYS A 73 28.131 -8.692 11.842 1.00 17.01 O
1049 ATOM 576 CB LYS A 73 29.529 -9.379 14.083 1.00 18.93 C
1050 ATOM 577 CG LYS A 73 30.306 -10.125 15.214 1.00 21.20 C
1051 ATOM 578 CD LYS A 73 29.596 -9.904 16.541 1.00 27.87 C
1052 ATOM 579 CE LYS A 73 29.704 -8.451 16.961 1.00 33.10 C
1053 ATOM 580 NZ LYS A 73 29.351 -8.261 18.413 1.00 38.37 N
1054 ATOM 581 N VAL A 74 29.816 -9.171 10.426 1.00 15.70 N
1055 ATOM 582 CA VAL A 74 29.104 -8.638 9.257 1.00 14.28 C
1056 ATOM 583 C VAL A 74 28.897 -9.686 8.201 1.00 14.18 C
1057 ATOM 584 O VAL A 74 29.743 -10.550 7.976 1.00 15.18 O
1058 ATOM 585 CB VAL A 74 29.954 -7.488 8.690 1.00 15.41 C
1059 ATOM 586 CG1 VAL A 74 29.681 -7.238 7.190 1.00 14.46 C
1060 ATOM 587 CG2 VAL A 74 29.709 -6.217 9.504 1.00 13.68 C
1061 ATOM 588 N LEU A 75 27.742 -9.644 7.526 1.00 12.63 N
1062 ATOM 589 CA LEU A 75 27.534 -10.477 6.340 1.00 12.81 C
1063 ATOM 590 C LEU A 75 27.226 -9.524 5.179 1.00 12.09 C
1064 ATOM 591 O LEU A 75 26.321 -8.725 5.299 1.00 12.18 O
1065 ATOM 592 CB LEU A 75 26.348 -11.410 6.532 1.00 12.08 C
1066 ATOM 593 CG LEU A 75 26.035 -12.323 5.357 1.00 12.97 C
1067 ATOM 594 CD1 LEU A 75 27.205 -13.294 5.066 1.00 14.11 C
1068 ATOM 595 CD2 LEU A 75 24.774 -13.090 5.660 1.00 13.64 C
1069 ATOM 596 N GLU A 76 27.993 -9.614 4.078 1.00 11.33 N
1070 ATOM 597 CA GLU A 76 27.719 -8.757 2.900 1.00 11.66 C
1071 ATOM 598 C GLU A 76 27.086 -9.542 1.777 1.00 11.82 C
1072 ATOM 599 O GLU A 76 27.482 -10.667 1.514 1.00 12.57 O
1073 ATOM 600 CB GLU A 76 29.029 -8.139 2.386 1.00 10.43 C
1074 ATOM 601 CG GLU A 76 29.507 -7.032 3.305 1.00 12.82 C
1075 ATOM 602 CD GLU A 76 30.767 -6.341 2.855 1.00 15.10 C
1076 ATOM 603 OE1 GLU A 76 31.257 -6.634 1.744 1.00 15.58 O
1077 ATOM 604 OE2 GLU A 76 31.262 -5.480 3.620 1.00 15.13 O
1078 ATOM 605 N ILE A 77 26.102 -8.948 1.095 1.00 11.91 N
1079 ATOM 606 CA ILE A 77 25.461 -9.586 -0.071 1.00 13.41 C
1080 ATOM 607 C ILE A 77 25.593 -8.533 -1.154 1.00 12.39 C
1081 ATOM 608 O ILE A 77 24.977 -7.461 -1.093 1.00 12.40 O
1082 ATOM 609 CB ILE A 77 23.993 -9.832 0.176 1.00 14.23 C
1083 ATOM 610 CG1 ILE A 77 23.820 -10.889 1.247 1.00 18.68 C
1084 ATOM 611 CG2 ILE A 77 23.364 -10.499 -1.037 1.00 16.45 C
1085 ATOM 612 CD1 ILE A 77 23.471 -10.294 2.495 1.00 22.52 C
1086 ATOM 613 N ARG A 78 26.367 -8.886 -2.175 1.00 12.30 N
1087 ATOM 614 CA ARG A 78 26.685 -7.951 -3.252 1.00 12.47 C
1088 ATOM 615 C ARG A 78 26.074 -8.444 -4.548 1.00 12.07 C
1089 ATOM 616 O ARG A 78 26.020 -9.640 -4.827 1.00 13.61 O
1090 ATOM 617 CB ARG A 78 28.196 -7.931 -3.428 1.00 12.22 C
1091 ATOM 618 CG ARG A 78 28.699 -7.121 -4.646 1.00 14.93 C
1092 ATOM 619 CD ARG A 78 30.240 -6.831 -4.633 1.00 18.53 C
1093 ATOM 620 NE ARG A 78 30.682 -6.055 -5.800 1.00 17.99 N
1094 ATOM 621 CZ ARG A 78 31.898 -5.693 -5.988 1.00 20.83 C
1095 ATOM 622 NH1 ARG A 78 32.840 -6.079 -5.116 1.00 24.76 N
1096 ATOM 623 NH2 ARG A 78 32.205 -4.971 -7.055 1.00 25.64 N
1097 ATOM 624 N ASP A 79 25.658 -7.498 -5.371 1.00 11.40 N
1098 ATOM 625 CA ASP A 79 25.303 -7.872 -6.742 1.00 11.41 C
1099 ATOM 626 C ASP A 79 25.909 -6.823 -7.659 1.00 11.19 C
1100 ATOM 627 O ASP A 79 26.249 -5.694 -7.243 1.00 11.62 O
1101 ATOM 628 CB ASP A 79 23.775 -7.954 -6.931 1.00 11.82 C
1102 ATOM 629 CG ASP A 79 23.109 -6.650 -6.688 1.00 10.90 C
1103 ATOM 630 OD1 ASP A 79 22.421 -6.453 -5.650 1.00 13.93 O
1104 ATOM 631 OD2 ASP A 79 23.192 -5.712 -7.493 1.00 12.45 O
1105 ATOM 632 N SER A 80 26.048 -7.197 -8.924 1.00 12.54 N
1106 ATOM 633 CA SER A 80 26.479 -6.241 -9.949 1.00 12.23 C
1107 ATOM 634 C SER A 80 25.266 -5.801 -10.803 1.00 12.15 C
1108 ATOM 635 O SER A 80 25.356 -5.634 -12.038 1.00 12.77 O
1109 ATOM 636 CB SER A 80 27.593 -6.810 -10.823 1.00 12.57 C
1110 ATOM 637 OG SER A 80 27.229 -8.106 -11.306 1.00 13.60 O
1111 ATOM 638 N GLY A 81 24.132 -5.628 -10.154 1.00 11.30 N
1112 ATOM 639 CA GLY A 81 22.935 -5.097 -10.802 1.00 12.18 C
1113 ATOM 640 C GLY A 81 22.996 -3.634 -11.141 1.00 10.98 C
1114 ATOM 641 O GLY A 81 24.048 -3.016 -11.222 1.00 12.29 O
1115 ATOM 642 N ILE A 82 21.803 -3.073 -11.371 1.00 11.99 N
1116 ATOM 643 CA ILE A 82 21.710 -1.715 -11.871 1.00 13.69 C
1117 ATOM 644 C ILE A 82 22.172 -0.663 -10.848 1.00 12.76 C
1118 ATOM 645 O ILE A 82 22.531 0.450 -11.211 1.00 13.99 O
1119 ATOM 646 CB ILE A 82 20.280 -1.455 -12.388 1.00 14.44 C
1120 ATOM 647 CG1 ILE A 82 20.207 -0.140 -13.137 1.00 17.06 C
1121 ATOM 648 CG2 ILE A 82 19.294 -1.463 -11.260 1.00 16.36 C
1122 ATOM 649 CD1 ILE A 82 19.110 -0.202 -14.201 1.00 19.33 C
1123 ATOM 650 N GLY A 83 22.220 -1.032 -9.562 1.00 12.09 N
1124 ATOM 651 CA GLY A 83 22.608 -0.020 -8.600 1.00 12.95 C
1125 ATOM 652 C GLY A 83 21.503 1.008 -8.337 1.00 13.05 C
1126 ATOM 653 O GLY A 83 20.432 1.031 -8.986 1.00 13.52 O
1127 ATOM 654 N MET A 84 21.794 1.937 -7.424 1.00 11.90 N
1128 ATOM 655 CA MET A 84 20.880 3.012 -7.072 1.00 11.82 C
1129 ATOM 656 C MET A 84 21.658 4.320 -6.913 1.00 12.29 C
1130 ATOM 657 O MET A 84 22.675 4.336 -6.238 1.00 12.49 O
1131 ATOM 658 CB MET A 84 20.185 2.707 -5.728 1.00 12.94 C
1132 ATOM 659 CG MET A 84 19.116 1.619 -5.855 1.00 13.41 C
1133 ATOM 660 SD MET A 84 18.376 1.198 -4.277 1.00 15.75 S
1134 ATOM 661 CE MET A 84 19.571 0.058 -3.679 1.00 17.75 C
1135 ATOM 662 N THR A 85 21.196 5.401 -7.556 1.00 12.06 N
1136 ATOM 663 CA THR A 85 21.726 6.740 -7.329 1.00 11.66 C
1137 ATOM 664 C THR A 85 21.335 7.215 -5.919 1.00 11.75 C
1138 ATOM 665 O THR A 85 20.554 6.575 -5.209 1.00 12.17 O
1139 ATOM 666 CB THR A 85 21.088 7.735 -8.306 1.00 12.16 C
1140 ATOM 667 OG1 THR A 85 19.684 7.821 -8.029 1.00 15.14 O
1141 ATOM 668 CG2 THR A 85 21.197 7.186 -9.704 1.00 12.35 C
1142 ATOM 669 N LYS A 86 21.916 8.341 -5.495 1.00 12.63 N
1143 ATOM 670 CA LYS A 86 21.531 8.917 -4.213 1.00 13.17 C
1144 ATOM 671 C LYS A 86 20.010 9.078 -4.105 1.00 13.42 C
1145 ATOM 672 O LYS A 86 19.403 8.679 -3.101 1.00 12.88 O
1146 ATOM 673 CB LYS A 86 22.205 10.281 -4.047 1.00 13.11 C
1147 ATOM 674 CG LYS A 86 21.924 10.940 -2.716 1.00 14.52 C
1148 ATOM 675 CD LYS A 86 22.523 12.340 -2.674 1.00 17.44 C
1149 ATOM 676 CE LYS A 86 22.196 12.983 -1.370 1.00 21.81 C
1150 ATOM 677 NZ LYS A 86 22.725 14.374 -1.345 1.00 25.44 N
1151 ATOM 678 N ALA A 87 19.405 9.638 -5.167 1.00 13.68 N
1152 ATOM 679 CA ALA A 87 17.965 9.847 -5.136 1.00 14.26 C
1153 ATOM 680 C ALA A 87 17.188 8.540 -5.080 1.00 13.89 C
1154 ATOM 681 O ALA A 87 16.185 8.484 -4.388 1.00 14.98 O
1155 ATOM 682 CB ALA A 87 17.524 10.660 -6.369 1.00 14.72 C
1156 ATOM 683 N GLU A 88 17.675 7.511 -5.759 1.00 13.78 N
1157 ATOM 684 CA GLU A 88 16.993 6.213 -5.722 1.00 13.30 C
1158 ATOM 685 C GLU A 88 17.121 5.568 -4.357 1.00 12.84 C
1159 ATOM 686 O GLU A 88 16.201 4.899 -3.874 1.00 14.63 O
1160 ATOM 687 CB GLU A 88 17.519 5.291 -6.806 1.00 14.68 C
1161 ATOM 688 CG GLU A 88 17.055 5.749 -8.190 1.00 15.76 C
1162 ATOM 689 CD GLU A 88 17.705 5.029 -9.319 1.00 21.27 C
1163 ATOM 690 OE1 GLU A 88 18.862 4.608 -9.227 1.00 15.60 O
1164 ATOM 691 OE2 GLU A 88 17.057 4.951 -10.380 1.00 26.24 O
1165 ATOM 692 N LEU A 89 18.282 5.729 -3.719 1.00 12.80 N
1166 ATOM 693 CA LEU A 89 18.410 5.165 -2.378 1.00 12.81 C
1167 ATOM 694 C LEU A 89 17.393 5.780 -1.434 1.00 14.77 C
1168 ATOM 695 O LEU A 89 16.708 5.071 -0.678 1.00 15.82 O
1169 ATOM 696 CB LEU A 89 19.820 5.440 -1.810 1.00 13.17 C
1170 ATOM 697 CG LEU A 89 20.905 4.582 -2.450 1.00 11.59 C
1171 ATOM 698 CD1 LEU A 89 22.276 5.147 -2.012 1.00 14.15 C
1172 ATOM 699 CD2 LEU A 89 20.828 3.120 -1.998 1.00 12.52 C
1173 ATOM 700 N ILE A 90 17.310 7.104 -1.459 1.00 14.92 N
1174 ATOM 701 CA ILE A 90 16.364 7.816 -0.592 1.00 16.06 C
1175 ATOM 702 C ILE A 90 14.937 7.364 -0.896 1.00 17.30 C
1176 ATOM 703 O ILE A 90 14.174 7.006 0.031 1.00 18.87 O
1177 ATOM 704 CB ILE A 90 16.525 9.287 -0.817 1.00 13.89 C
1178 ATOM 705 CG1 ILE A 90 17.930 9.737 -0.379 1.00 16.63 C
1179 ATOM 706 CG2 ILE A 90 15.428 10.112 -0.047 1.00 17.66 C
1180 ATOM 707 CD1 ILE A 90 18.233 11.173 -0.798 1.00 16.56 C
1181 ATOM 708 N ASN A 91 14.593 7.288 -2.176 1.00 17.39 N
1182 ATOM 709 CA ASN A 91 13.230 6.926 -2.596 1.00 19.23 C
1183 ATOM 710 C ASN A 91 12.907 5.447 -2.401 1.00 19.37 C
1184 ATOM 711 O ASN A 91 11.871 5.096 -1.786 1.00 20.83 O
1185 ATOM 712 CB ASN A 91 13.036 7.331 -4.075 1.00 19.87 C
1186 ATOM 713 CG ASN A 91 11.552 7.244 -4.531 1.00 23.09 C
1187 ATOM 714 OD1 ASN A 91 10.662 7.733 -3.840 1.00 26.42 O
1188 ATOM 715 ND2 ASN A 91 11.309 6.615 -5.666 1.00 26.08 N
1189 ATOM 716 N ASN A 92 13.749 4.572 -2.928 1.00 17.44 N
1190 ATOM 717 CA ASN A 92 13.468 3.135 -2.893 1.00 18.15 C
1191 ATOM 718 C ASN A 92 13.463 2.565 -1.493 1.00 18.04 C
1192 ATOM 719 O ASN A 92 12.688 1.662 -1.191 1.00 19.98 O
1193 ATOM 720 CB ASN A 92 14.475 2.342 -3.754 1.00 18.82 C
1194 ATOM 721 CG ASN A 92 14.326 2.614 -5.242 1.00 20.94 C
1195 ATOM 722 OD1 ASN A 92 13.386 3.298 -5.674 1.00 25.18 O
1196 ATOM 723 ND2 ASN A 92 15.294 2.135 -6.029 1.00 20.73 N
1197 ATOM 724 N LEU A 93 14.358 3.069 -0.643 1.00 16.10 N
1198 ATOM 725 CA LEU A 93 14.523 2.480 0.680 1.00 15.44 C
1199 ATOM 726 C LEU A 93 13.815 3.191 1.823 1.00 16.19 C
1200 ATOM 727 O LEU A 93 13.507 2.587 2.866 1.00 16.86 O
1201 ATOM 728 CB LEU A 93 16.009 2.280 0.982 1.00 14.08 C
1202 ATOM 729 CG LEU A 93 16.784 1.547 -0.114 1.00 14.17 C
1203 ATOM 730 CD1 LEU A 93 18.242 1.424 0.293 1.00 14.27 C
1204 ATOM 731 CD2 LEU A 93 16.203 0.130 -0.341 1.00 17.07 C
1205 ATOM 732 N GLY A 94 13.553 4.485 1.636 1.00 16.50 N
1206 ATOM 733 CA GLY A 94 12.895 5.217 2.682 1.00 18.50 C
1207 ATOM 734 C GLY A 94 11.469 5.677 2.398 1.00 21.34 C
1208 ATOM 735 O GLY A 94 10.821 6.178 3.313 1.00 20.50 O
1209 ATOM 736 N THR A 95 10.982 5.471 1.170 1.00 21.68 N
1210 ATOM 737 CA THR A 95 9.665 5.967 0.745 1.00 24.08 C
1211 ATOM 738 C THR A 95 8.658 4.978 0.095 1.00 23.36 C
1212 ATOM 739 O THR A 95 7.529 4.846 0.561 1.00 23.74 O
1213 ATOM 740 CB THR A 95 9.861 7.053 -0.280 1.00 24.87 C
1214 ATOM 741 OG1 THR A 95 10.420 8.204 0.346 1.00 30.63 O
1215 ATOM 742 CG2 THR A 95 8.485 7.512 -0.788 1.00 26.23 C
1216 ATOM 743 N ILE A 96 9.057 4.351 -1.014 1.00 24.29 N
1217 ATOM 744 CA ILE A 96 8.121 3.604 -1.874 1.00 24.83 C
1218 ATOM 745 C ILE A 96 7.557 2.364 -1.232 1.00 25.04 C
1219 ATOM 746 O ILE A 96 6.511 1.857 -1.681 1.00 25.75 O
1220 ATOM 747 CB ILE A 96 8.725 3.262 -3.269 1.00 25.27 C
1221 ATOM 748 CG1 ILE A 96 9.824 2.200 -3.158 1.00 26.83 C
1222 ATOM 749 CG2 ILE A 96 9.204 4.513 -4.009 1.00 26.39 C
1223 ATOM 750 CD1 ILE A 96 10.302 1.661 -4.535 1.00 30.12 C
1224 ATOM 751 N ALA A 97 8.227 1.871 -0.190 1.00 23.96 N
1225 ATOM 752 CA ALA A 97 7.738 0.715 0.533 1.00 24.57 C
1226 ATOM 753 C ALA A 97 6.566 0.990 1.471 1.00 24.96 C
1227 ATOM 754 O ALA A 97 6.041 0.065 2.088 1.00 25.75 O
1228 ATOM 755 CB ALA A 97 8.875 0.025 1.288 1.00 23.80 C
1229 ATOM 756 N LYS A 98 6.154 2.247 1.582 1.00 25.53 N
1230 ATOM 757 CA LYS A 98 5.032 2.582 2.445 1.00 26.29 C
1231 ATOM 758 C LYS A 98 3.795 1.692 2.184 1.00 26.96 C
1232 ATOM 759 O LYS A 98 3.263 1.080 3.130 1.00 29.61 O
1233 ATOM 760 CB LYS A 98 4.677 4.065 2.235 1.00 26.01 C
1234 ATOM 761 N SER A 99 3.384 1.544 0.930 1.00 27.94 N
1235 ATOM 762 CA SER A 99 2.134 0.865 0.640 1.00 28.50 C
1236 ATOM 763 C SER A 99 2.224 -0.628 0.967 1.00 27.30 C
1237 ATOM 764 O SER A 99 1.362 -1.197 1.650 1.00 28.11 O
1238 ATOM 765 CB SER A 99 1.751 1.076 -0.817 1.00 29.09 C
1239 ATOM 766 OG SER A 99 2.634 0.326 -1.608 1.00 34.91 O
1240 ATOM 767 N GLY A 100 3.261 -1.278 0.470 1.00 26.28 N
1241 ATOM 768 CA GLY A 100 3.438 -2.686 0.797 1.00 24.97 C
1242 ATOM 769 C GLY A 100 3.518 -2.942 2.296 1.00 23.62 C
1243 ATOM 770 O GLY A 100 2.966 -3.956 2.758 1.00 21.30 O
1244 ATOM 771 N THR A 101 4.247 -2.101 3.042 1.00 22.40 N
1245 ATOM 772 CA THR A 101 4.452 -2.363 4.450 1.00 22.75 C
1246 ATOM 773 C THR A 101 3.108 -2.308 5.168 1.00 22.69 C
1247 ATOM 774 O THR A 101 2.848 -3.130 6.000 1.00 21.58 O
1248 ATOM 775 CB THR A 101 5.524 -1.456 5.212 1.00 23.07 C
1249 ATOM 776 OG1 THR A 101 5.133 -0.081 5.240 1.00 25.02 O
1250 ATOM 777 CG2 THR A 101 6.892 -1.481 4.505 1.00 22.76 C
1251 ATOM 778 N LYS A 102 2.266 -1.342 4.825 1.00 23.73 N
1252 ATOM 779 CA LYS A 102 0.972 -1.252 5.501 1.00 24.00 C
1253 ATOM 780 C LYS A 102 0.128 -2.505 5.307 1.00 23.10 C
1254 ATOM 781 O LYS A 102 -0.338 -3.128 6.275 1.00 23.57 O
1255 ATOM 782 CB LYS A 102 0.197 0.005 5.080 1.00 24.94 C
1256 ATOM 783 CG LYS A 102 -0.912 0.322 6.059 1.00 27.73 C
1257 ATOM 784 N ALA A 103 -0.038 -2.901 4.058 1.00 22.87 N
1258 ATOM 785 CA ALA A 103 -0.783 -4.105 3.754 1.00 20.64 C
1259 ATOM 786 C ALA A 103 -0.167 -5.351 4.402 1.00 19.07 C
1260 ATOM 787 O ALA A 103 -0.866 -6.213 4.882 1.00 19.19 O
1261 ATOM 788 CB ALA A 103 -0.895 -4.281 2.247 1.00 22.95 C
1262 ATOM 789 N PHE A 104 1.152 -5.450 4.392 1.00 17.13 N
1263 ATOM 790 CA PHE A 104 1.797 -6.616 5.017 1.00 15.24 C
1264 ATOM 791 C PHE A 104 1.565 -6.636 6.531 1.00 15.56 C
1265 ATOM 792 O PHE A 104 1.351 -7.710 7.101 1.00 15.96 O
1266 ATOM 793 CB PHE A 104 3.307 -6.586 4.736 1.00 15.70 C
1267 ATOM 794 CG PHE A 104 4.035 -7.726 5.317 1.00 12.43 C
1268 ATOM 795 CD1 PHE A 104 3.633 -9.044 5.046 1.00 16.27 C
1269 ATOM 796 CD2 PHE A 104 5.136 -7.515 6.126 1.00 14.81 C
1270 ATOM 797 CE1 PHE A 104 4.373 -10.105 5.622 1.00 15.60 C
1271 ATOM 798 CE2 PHE A 104 5.859 -8.562 6.662 1.00 17.55 C
1272 ATOM 799 CZ PHE A 104 5.459 -9.848 6.421 1.00 15.62 C
1273 ATOM 800 N MET A 105 1.636 -5.487 7.193 1.00 16.45 N
1274 ATOM 801 CA MET A 105 1.397 -5.502 8.624 1.00 16.05 C
1275 ATOM 802 C MET A 105 -0.005 -5.915 8.979 1.00 16.91 C
1276 ATOM 803 O MET A 105 -0.195 -6.553 10.014 1.00 17.10 O
1277 ATOM 804 CB MET A 105 1.674 -4.131 9.237 1.00 16.66 C
1278 ATOM 805 CG MET A 105 3.154 -3.834 9.195 1.00 17.35 C
1279 ATOM 806 SD MET A 105 3.589 -2.287 10.105 1.00 20.19 S
1280 ATOM 807 CE MET A 105 3.020 -1.198 9.041 1.00 17.97 C
1281 ATOM 808 N GLU A 106 -0.963 -5.543 8.153 1.00 16.85 N
1282 ATOM 809 CA GLU A 106 -2.355 -5.959 8.400 1.00 18.32 C
1283 ATOM 810 C GLU A 106 -2.448 -7.474 8.236 1.00 19.34 C
1284 ATOM 811 O GLU A 106 -3.151 -8.162 9.011 1.00 20.11 O
1285 ATOM 812 CB GLU A 106 -3.285 -5.248 7.461 1.00 20.07 C
1286 ATOM 813 CG GLU A 106 -3.339 -3.746 7.749 1.00 24.58 C
1287 ATOM 814 CD GLU A 106 -4.107 -2.973 6.697 1.00 33.23 C
1288 ATOM 815 OE1 GLU A 106 -4.212 -3.460 5.564 1.00 37.02 O
1289 ATOM 816 OE2 GLU A 106 -4.598 -1.863 7.009 1.00 40.23 O
1290 ATOM 817 N ALA A 107 -1.752 -8.008 7.223 1.00 17.43 N
1291 ATOM 818 CA ALA A 107 -1.713 -9.451 7.062 1.00 18.02 C
1292 ATOM 819 C ALA A 107 -1.063 -10.143 8.263 1.00 18.06 C
1293 ATOM 820 O ALA A 107 -1.566 -11.164 8.713 1.00 17.92 O
1294 ATOM 821 CB ALA A 107 -1.043 -9.873 5.687 1.00 16.98 C
1295 ATOM 822 N LEU A 108 0.048 -9.594 8.774 1.00 17.66 N
1296 ATOM 823 CA LEU A 108 0.709 -10.140 9.943 1.00 18.18 C
1297 ATOM 824 C LEU A 108 -0.296 -10.140 11.088 1.00 18.32 C
1298 ATOM 825 O LEU A 108 -0.379 -11.116 11.836 1.00 19.56 O
1299 ATOM 826 CB LEU A 108 1.927 -9.300 10.337 1.00 17.94 C
1300 ATOM 827 CG LEU A 108 3.133 -9.495 9.400 1.00 18.20 C
1301 ATOM 828 CD1 LEU A 108 4.257 -8.547 9.875 1.00 18.57 C
1302 ATOM 829 CD2 LEU A 108 3.635 -10.934 9.401 1.00 18.81 C
1303 ATOM 830 N SER A 109 -1.070 -9.074 11.216 1.00 20.01 N
1304 ATOM 831 CA SER A 109 -2.043 -8.976 12.305 1.00 22.25 C
1305 ATOM 832 C SER A 109 -2.966 -10.179 12.323 1.00 22.34 C
1306 ATOM 833 O SER A 109 -3.370 -10.694 13.373 1.00 23.41 O
1307 ATOM 834 CB SER A 109 -2.941 -7.764 12.101 1.00 22.88 C
1308 ATOM 835 OG SER A 109 -2.353 -6.599 12.613 1.00 32.91 O
1309 ATOM 836 N ALA A 110 -3.328 -10.606 11.125 1.00 20.39 N
1310 ATOM 837 CA ALA A 110 -4.329 -11.661 10.944 1.00 19.69 C
1311 ATOM 838 C ALA A 110 -3.761 -13.035 11.043 1.00 18.67 C
1312 ATOM 839 O ALA A 110 -4.513 -14.000 11.115 1.00 18.31 O
1313 ATOM 840 CB ALA A 110 -5.006 -11.482 9.605 1.00 19.26 C
1314 ATOM 841 N GLY A 111 -2.439 -13.156 11.008 1.00 18.14 N
1315 ATOM 842 CA GLY A 111 -1.787 -14.427 11.142 1.00 18.32 C
1316 ATOM 843 C GLY A 111 -0.861 -14.850 10.012 1.00 18.35 C
1317 ATOM 844 O GLY A 111 -0.348 -15.956 10.039 1.00 19.03 O
1318 ATOM 845 N ALA A 112 -0.649 -13.979 9.030 1.00 18.07 N
1319 ATOM 846 CA ALA A 112 0.240 -14.351 7.924 1.00 18.40 C
1320 ATOM 847 C ALA A 112 1.625 -14.688 8.387 1.00 18.93 C
1321 ATOM 848 O ALA A 112 2.150 -14.097 9.345 1.00 19.67 O
1322 ATOM 849 CB ALA A 112 0.328 -13.200 6.897 1.00 17.74 C
1323 ATOM 850 N ASP A 113 2.260 -15.618 7.687 1.00 18.09 N
1324 ATOM 851 CA ASP A 113 3.626 -15.920 8.018 1.00 19.25 C
1325 ATOM 852 C ASP A 113 4.546 -14.772 7.577 1.00 18.36 C
1326 ATOM 853 O ASP A 113 4.378 -14.226 6.485 1.00 17.77 O
1327 ATOM 854 CB ASP A 113 4.060 -17.172 7.310 1.00 19.74 C
1328 ATOM 855 CG ASP A 113 5.240 -17.775 7.970 1.00 24.85 C
1329 ATOM 856 OD1 ASP A 113 6.346 -17.479 7.535 1.00 22.56 O
1330 ATOM 857 OD2 ASP A 113 5.156 -18.468 9.018 1.00 27.45 O
1331 ATOM 858 N VAL A 114 5.518 -14.445 8.428 1.00 17.96 N
1332 ATOM 859 CA VAL A 114 6.497 -13.414 8.090 1.00 17.23 C
1333 ATOM 860 C VAL A 114 7.140 -13.722 6.733 1.00 17.60 C
1334 ATOM 861 O VAL A 114 7.547 -12.806 6.010 1.00 18.67 O
1335 ATOM 862 CB VAL A 114 7.578 -13.337 9.170 1.00 17.85 C
1336 ATOM 863 CG1 VAL A 114 8.697 -12.396 8.764 1.00 19.83 C
1337 ATOM 864 CG2 VAL A 114 6.941 -12.860 10.496 1.00 19.01 C
1338 ATOM 865 N SER A 115 7.224 -15.001 6.374 1.00 18.40 N
1339 ATOM 866 CA SER A 115 7.821 -15.348 5.085 1.00 17.85 C
1340 ATOM 867 C SER A 115 7.079 -14.833 3.860 1.00 18.23 C
1341 ATOM 868 O SER A 115 7.637 -14.828 2.753 1.00 18.81 O
1342 ATOM 869 CB SER A 115 8.085 -16.864 4.966 1.00 20.01 C
1343 ATOM 870 OG SER A 115 6.840 -17.553 4.814 1.00 21.84 O
1344 ATOM 871 N MET A 116 5.851 -14.351 4.028 1.00 16.17 N
1345 ATOM 872 CA MET A 116 5.127 -13.736 2.907 1.00 17.38 C
1346 ATOM 873 C MET A 116 5.633 -12.347 2.526 1.00 16.07 C
1347 ATOM 874 O MET A 116 5.161 -11.755 1.558 1.00 16.26 O
1348 ATOM 875 CB MET A 116 3.609 -13.569 3.196 1.00 17.66 C
1349 ATOM 876 CG MET A 116 2.908 -14.852 3.385 1.00 20.83 C
1350 ATOM 877 SD MET A 116 1.111 -14.572 3.322 1.00 21.11 S
1351 ATOM 878 CE MET A 116 0.900 -14.117 1.605 1.00 23.57 C
1352 ATOM 879 N ILE A 117 6.594 -11.836 3.299 1.00 14.75 N
1353 ATOM 880 CA ILE A 117 6.991 -10.440 3.148 1.00 14.73 C
1354 ATOM 881 C ILE A 117 7.344 -10.075 1.707 1.00 14.23 C
1355 ATOM 882 O ILE A 117 7.001 -8.990 1.254 1.00 14.16 O
1356 ATOM 883 CB ILE A 117 8.138 -10.142 4.152 1.00 14.11 C
1357 ATOM 884 CG1 ILE A 117 8.460 -8.635 4.138 1.00 14.31 C
1358 ATOM 885 CG2 ILE A 117 9.387 -11.012 3.819 1.00 15.85 C
1359 ATOM 886 CD1 ILE A 117 9.432 -8.242 5.282 1.00 16.35 C
1360 ATOM 887 N GLY A 118 7.994 -10.965 0.972 1.00 14.99 N
1361 ATOM 888 CA GLY A 118 8.356 -10.665 -0.402 1.00 15.09 C
1362 ATOM 889 C GLY A 118 7.184 -10.487 -1.349 1.00 14.91 C
1363 ATOM 890 O GLY A 118 7.254 -9.725 -2.321 1.00 15.86 O
1364 ATOM 891 N GLN A 119 6.104 -11.188 -1.064 1.00 15.37 N
1365 ATOM 892 CA GLN A 119 4.913 -11.056 -1.874 1.00 14.86 C
1366 ATOM 893 C GLN A 119 4.236 -9.711 -1.706 1.00 15.71 C
1367 ATOM 894 O GLN A 119 3.385 -9.317 -2.511 1.00 15.27 O
1368 ATOM 895 CB GLN A 119 3.965 -12.214 -1.563 1.00 16.40 C
1369 ATOM 896 CG GLN A 119 4.536 -13.508 -2.118 1.00 19.15 C
1370 ATOM 897 CD GLN A 119 3.744 -14.681 -1.658 1.00 21.60 C
1371 ATOM 898 OE1 GLN A 119 4.176 -15.431 -0.762 1.00 26.29 O
1372 ATOM 899 NE2 GLN A 119 2.591 -14.874 -2.271 1.00 22.22 N
1373 ATOM 900 N PHE A 120 4.622 -8.987 -0.661 1.00 14.82 N
1374 ATOM 901 CA PHE A 120 4.105 -7.645 -0.472 1.00 15.03 C
1375 ATOM 902 C PHE A 120 5.119 -6.606 -0.940 1.00 14.90 C
1376 ATOM 903 O PHE A 120 4.912 -5.405 -0.786 1.00 15.91 O
1377 ATOM 904 CB PHE A 120 3.704 -7.373 0.980 1.00 15.26 C
1378 ATOM 905 CG PHE A 120 2.469 -8.130 1.416 1.00 15.54 C
1379 ATOM 906 CD1 PHE A 120 2.506 -9.485 1.695 1.00 16.82 C
1380 ATOM 907 CD2 PHE A 120 1.266 -7.434 1.553 1.00 16.43 C
1381 ATOM 908 CE1 PHE A 120 1.359 -10.164 2.092 1.00 17.87 C
1382 ATOM 909 CE2 PHE A 120 0.118 -8.112 1.945 1.00 15.19 C
1383 ATOM 910 CZ PHE A 120 0.164 -9.453 2.221 1.00 18.18 C
1384 ATOM 911 N GLY A 121 6.227 -7.082 -1.502 1.00 15.65 N
1385 ATOM 912 CA GLY A 121 7.189 -6.198 -2.151 1.00 15.90 C
1386 ATOM 913 C GLY A 121 8.142 -5.481 -1.207 1.00 15.39 C
1387 ATOM 914 O GLY A 121 8.834 -4.497 -1.597 1.00 17.26 O
1388 ATOM 915 N VAL A 122 8.186 -5.963 0.027 1.00 14.54 N
1389 ATOM 916 CA VAL A 122 8.973 -5.299 1.065 1.00 13.51 C
1390 ATOM 917 C VAL A 122 9.974 -6.233 1.746 1.00 13.20 C
1391 ATOM 918 O VAL A 122 10.370 -6.040 2.894 1.00 12.82 O
1392 ATOM 919 CB VAL A 122 8.059 -4.558 2.102 1.00 12.77 C
1393 ATOM 920 CG1 VAL A 122 7.341 -3.384 1.451 1.00 16.38 C
1394 ATOM 921 CG2 VAL A 122 7.053 -5.538 2.781 1.00 12.77 C
1395 ATOM 922 N GLY A 123 10.349 -7.302 1.037 1.00 13.26 N
1396 ATOM 923 CA GLY A 123 11.315 -8.257 1.538 1.00 13.10 C
1397 ATOM 924 C GLY A 123 12.658 -7.737 2.017 1.00 11.65 C
1398 ATOM 925 O GLY A 123 13.277 -8.370 2.820 1.00 13.24 O
1399 ATOM 926 N PHE A 124 13.051 -6.559 1.539 1.00 12.17 N
1400 ATOM 927 CA PHE A 124 14.313 -5.977 1.938 1.00 11.79 C
1401 ATOM 928 C PHE A 124 14.381 -5.876 3.451 1.00 12.06 C
1402 ATOM 929 O PHE A 124 15.415 -6.195 4.081 1.00 12.37 O
1403 ATOM 930 CB PHE A 124 14.441 -4.551 1.341 1.00 11.10 C
1404 ATOM 931 CG PHE A 124 15.526 -3.714 1.954 1.00 12.28 C
1405 ATOM 932 CD1 PHE A 124 16.873 -3.983 1.732 1.00 13.16 C
1406 ATOM 933 CD2 PHE A 124 15.183 -2.635 2.731 1.00 14.28 C
1407 ATOM 934 CE1 PHE A 124 17.881 -3.184 2.290 1.00 14.04 C
1408 ATOM 935 CE2 PHE A 124 16.189 -1.782 3.271 1.00 15.55 C
1409 ATOM 936 CZ PHE A 124 17.554 -2.078 3.048 1.00 14.12 C
1410 ATOM 937 N TYR A 125 13.241 -5.521 4.070 1.00 12.61 N
1411 ATOM 938 CA TYR A 125 13.256 -5.251 5.486 1.00 10.90 C
1412 ATOM 939 C TYR A 125 13.344 -6.487 6.363 1.00 12.09 C
1413 ATOM 940 O TYR A 125 13.611 -6.366 7.575 1.00 12.99 O
1414 ATOM 941 CB TYR A 125 12.052 -4.369 5.856 1.00 11.74 C
1415 ATOM 942 CG TYR A 125 12.054 -3.053 5.072 1.00 11.42 C
1416 ATOM 943 CD1 TYR A 125 11.284 -2.915 3.927 1.00 13.77 C
1417 ATOM 944 CD2 TYR A 125 12.844 -1.994 5.464 1.00 11.61 C
1418 ATOM 945 CE1 TYR A 125 11.302 -1.781 3.182 1.00 12.78 C
1419 ATOM 946 CE2 TYR A 125 12.876 -0.806 4.692 1.00 11.71 C
1420 ATOM 947 CZ TYR A 125 12.093 -0.729 3.560 1.00 12.11 C
1421 ATOM 948 OH TYR A 125 12.105 0.412 2.785 1.00 16.17 O
1422 ATOM 949 N SER A 126 13.226 -7.650 5.716 1.00 12.39 N
1423 ATOM 950 CA SER A 126 13.437 -8.907 6.426 1.00 12.52 C
1424 ATOM 951 C SER A 126 14.868 -9.036 6.955 1.00 12.05 C
1425 ATOM 952 O SER A 126 15.132 -9.859 7.804 1.00 12.66 O
1426 ATOM 953 CB SER A 126 13.090 -10.110 5.533 1.00 13.27 C
1427 ATOM 954 OG SER A 126 14.079 -10.320 4.527 1.00 14.42 O
1428 ATOM 955 N LEU A 127 15.808 -8.214 6.478 1.00 11.81 N
1429 ATOM 956 CA LEU A 127 17.153 -8.298 7.016 1.00 11.81 C
1430 ATOM 957 C LEU A 127 17.170 -8.029 8.516 1.00 12.38 C
1431 ATOM 958 O LEU A 127 18.076 -8.480 9.195 1.00 13.12 O
1432 ATOM 959 CB LEU A 127 18.070 -7.336 6.229 1.00 12.61 C
1433 ATOM 960 CG LEU A 127 17.792 -5.838 6.433 1.00 12.21 C
1434 ATOM 961 CD1 LEU A 127 18.592 -5.273 7.599 1.00 12.07 C
1435 ATOM 962 CD2 LEU A 127 18.305 -5.102 5.180 1.00 13.15 C
1436 ATOM 963 N PHE A 128 16.174 -7.290 9.045 1.00 12.36 N
1437 ATOM 964 CA PHE A 128 16.189 -7.023 10.467 1.00 13.30 C
1438 ATOM 965 C PHE A 128 15.818 -8.205 11.353 1.00 14.18 C
1439 ATOM 966 O PHE A 128 15.901 -8.110 12.577 1.00 16.00 O
1440 ATOM 967 CB PHE A 128 15.291 -5.799 10.752 1.00 12.70 C
1441 ATOM 968 CG PHE A 128 15.910 -4.506 10.274 1.00 14.40 C
1442 ATOM 969 CD1 PHE A 128 15.381 -3.822 9.178 1.00 13.24 C
1443 ATOM 970 CD2 PHE A 128 17.037 -4.005 10.899 1.00 13.66 C
1444 ATOM 971 CE1 PHE A 128 15.929 -2.609 8.757 1.00 14.00 C
1445 ATOM 972 CE2 PHE A 128 17.628 -2.792 10.480 1.00 14.46 C
1446 ATOM 973 CZ PHE A 128 17.059 -2.093 9.404 1.00 13.48 C
1447 ATOM 974 N LEU A 129 15.503 -9.334 10.708 1.00 14.40 N
1448 ATOM 975 CA LEU A 129 15.371 -10.575 11.479 1.00 14.30 C
1449 ATOM 976 C LEU A 129 16.734 -10.997 12.025 1.00 16.03 C
1450 ATOM 977 O LEU A 129 16.825 -11.571 13.112 1.00 17.98 O
1451 ATOM 978 CB LEU A 129 14.838 -11.708 10.624 1.00 14.56 C
1452 ATOM 979 CG LEU A 129 13.440 -11.556 10.079 1.00 13.73 C
1453 ATOM 980 CD1 LEU A 129 13.081 -12.595 8.995 1.00 16.03 C
1454 ATOM 981 CD2 LEU A 129 12.412 -11.653 11.254 1.00 16.08 C
1455 ATOM 982 N VAL A 130 17.792 -10.748 11.259 1.00 14.45 N
1456 ATOM 983 CA VAL A 130 19.117 -11.184 11.691 1.00 14.98 C
1457 ATOM 984 C VAL A 130 20.078 -10.100 11.985 1.00 14.24 C
1458 ATOM 985 O VAL A 130 21.122 -10.342 12.599 1.00 15.26 O
1459 ATOM 986 CB VAL A 130 19.730 -12.196 10.689 1.00 14.03 C
1460 ATOM 987 CG1 VAL A 130 18.851 -13.459 10.517 1.00 15.29 C
1461 ATOM 988 CG2 VAL A 130 19.945 -11.538 9.310 1.00 16.29 C
1462 ATOM 989 N ALA A 131 19.784 -8.869 11.553 1.00 14.48 N
1463 ATOM 990 CA ALA A 131 20.678 -7.757 11.702 1.00 14.40 C
1464 ATOM 991 C ALA A 131 20.058 -6.614 12.477 1.00 14.37 C
1465 ATOM 992 O ALA A 131 18.855 -6.380 12.392 1.00 15.60 O
1466 ATOM 993 CB ALA A 131 21.130 -7.228 10.304 1.00 14.33 C
1467 ATOM 994 N ASP A 132 20.884 -5.869 13.211 1.00 15.35 N
1468 ATOM 995 CA ASP A 132 20.357 -4.683 13.865 1.00 17.16 C
1469 ATOM 996 C ASP A 132 20.747 -3.398 13.209 1.00 16.38 C
1470 ATOM 997 O ASP A 132 20.398 -2.334 13.681 1.00 17.74 O
1471 ATOM 998 CB ASP A 132 20.656 -4.629 15.351 1.00 20.69 C
1472 ATOM 999 CG ASP A 132 22.082 -4.697 15.644 1.00 23.97 C
1473 ATOM 1000 OD1 ASP A 132 22.409 -4.925 16.844 1.00 33.27 O
1474 ATOM 1001 OD2 ASP A 132 22.975 -4.567 14.804 1.00 28.92 O
1475 ATOM 1002 N ARG A 133 21.471 -3.483 12.107 1.00 14.83 N
1476 ATOM 1003 CA ARG A 133 21.932 -2.290 11.416 1.00 14.59 C
1477 ATOM 1004 C ARG A 133 22.352 -2.758 10.026 1.00 13.64 C
1478 ATOM 1005 O ARG A 133 22.753 -3.918 9.849 1.00 13.27 O
1479 ATOM 1006 CB ARG A 133 23.117 -1.683 12.173 1.00 15.99 C
1480 ATOM 1007 CG ARG A 133 23.981 -0.749 11.393 1.00 21.03 C
1481 ATOM 1008 CD ARG A 133 24.930 0.025 12.311 1.00 27.88 C
1482 ATOM 1009 NE ARG A 133 26.010 0.754 11.652 1.00 35.17 N
1483 ATOM 1010 CZ ARG A 133 27.244 0.773 12.113 1.00 37.25 C
1484 ATOM 1011 NH1 ARG A 133 27.545 0.109 13.219 1.00 39.70 N
1485 ATOM 1012 NH2 ARG A 133 28.181 1.464 11.480 1.00 39.55 N
1486 ATOM 1013 N VAL A 134 22.182 -1.876 9.043 1.00 12.91 N
1487 ATOM 1014 CA VAL A 134 22.540 -2.210 7.654 1.00 12.96 C
1488 ATOM 1015 C VAL A 134 23.084 -0.982 6.995 1.00 12.61 C
1489 ATOM 1016 O VAL A 134 22.608 0.129 7.221 1.00 11.97 O
1490 ATOM 1017 CB VAL A 134 21.305 -2.756 6.845 1.00 12.06 C
1491 ATOM 1018 CG1 VAL A 134 20.112 -1.829 6.944 1.00 13.31 C
1492 ATOM 1019 CG2 VAL A 134 21.725 -3.061 5.384 1.00 12.39 C
1493 ATOM 1020 N GLN A 135 24.114 -1.191 6.170 1.00 11.84 N
1494 ATOM 1021 CA GLN A 135 24.572 -0.158 5.228 1.00 11.12 C
1495 ATOM 1022 C GLN A 135 24.289 -0.716 3.866 1.00 11.42 C
1496 ATOM 1023 O GLN A 135 24.680 -1.862 3.558 1.00 12.71 O
1497 ATOM 1024 CB GLN A 135 26.086 0.110 5.346 1.00 11.86 C
1498 ATOM 1025 CG GLN A 135 26.399 0.850 6.631 1.00 11.99 C
1499 ATOM 1026 CD GLN A 135 27.864 0.923 6.941 1.00 15.51 C
1500 ATOM 1027 OE1 GLN A 135 28.688 0.363 6.212 1.00 17.56 O
1501 ATOM 1028 NE2 GLN A 135 28.200 1.637 8.011 1.00 17.38 N
1502 ATOM 1029 N VAL A 136 23.583 0.089 3.065 1.00 10.51 N
1503 ATOM 1030 CA VAL A 136 23.412 -0.270 1.655 1.00 10.22 C
1504 ATOM 1031 C VAL A 136 24.414 0.587 0.880 1.00 10.45 C
1505 ATOM 1032 O VAL A 136 24.297 1.823 0.884 1.00 11.81 O
1506 ATOM 1033 CB VAL A 136 21.988 0.028 1.175 1.00 10.63 C
1507 ATOM 1034 CG1 VAL A 136 21.855 -0.304 -0.316 1.00 11.56 C
1508 ATOM 1035 CG2 VAL A 136 21.066 -0.944 1.920 1.00 11.39 C
1509 ATOM 1036 N ILE A 137 25.410 -0.025 0.237 1.00 9.29 N
1510 ATOM 1037 CA ILE A 137 26.435 0.766 -0.476 1.00 9.26 C
1511 ATOM 1038 C ILE A 137 26.097 0.576 -1.953 1.00 9.73 C
1512 ATOM 1039 O ILE A 137 25.981 -0.547 -2.389 1.00 11.17 O
1513 ATOM 1040 CB ILE A 137 27.815 0.161 -0.135 1.00 10.17 C
1514 ATOM 1041 CG1 ILE A 137 28.076 0.224 1.369 1.00 13.01 C
1515 ATOM 1042 CG2 ILE A 137 28.929 0.908 -0.892 1.00 12.24 C
1516 ATOM 1043 CD1 ILE A 137 29.027 -0.863 1.855 1.00 15.67 C
1517 ATOM 1044 N SER A 138 25.924 1.656 -2.713 1.00 10.35 N
1518 ATOM 1045 CA SER A 138 25.430 1.372 -4.067 1.00 10.59 C
1519 ATOM 1046 C SER A 138 26.091 2.324 -5.063 1.00 10.49 C
1520 ATOM 1047 O SER A 138 26.434 3.480 -4.747 1.00 11.13 O
1521 ATOM 1048 CB SER A 138 23.906 1.535 -4.128 1.00 11.33 C
1522 ATOM 1049 OG SER A 138 23.431 0.978 -5.364 1.00 11.76 O
1523 ATOM 1050 N LYS A 139 26.282 1.795 -6.272 1.00 11.83 N
1524 ATOM 1051 CA LYS A 139 26.852 2.592 -7.377 1.00 11.77 C
1525 ATOM 1052 C LYS A 139 26.033 2.331 -8.623 1.00 11.53 C
1526 ATOM 1053 O LYS A 139 26.058 1.231 -9.196 1.00 11.60 O
1527 ATOM 1054 CB LYS A 139 28.299 2.160 -7.636 1.00 11.42 C
1528 ATOM 1055 CG LYS A 139 28.970 2.869 -8.863 1.00 13.16 C
1529 ATOM 1056 CD LYS A 139 29.260 4.337 -8.571 1.00 11.65 C
1530 ATOM 1057 CE LYS A 139 30.021 4.999 -9.718 1.00 12.90 C
1531 ATOM 1058 NZ LYS A 139 29.180 5.080 -10.968 1.00 13.92 N
1532 ATOM 1059 N SER A 140 25.298 3.357 -9.007 1.00 12.77 N
1533 ATOM 1060 CA SER A 140 24.576 3.311 -10.284 1.00 12.20 C
1534 ATOM 1061 C SER A 140 25.507 3.928 -11.343 1.00 13.94 C
1535 ATOM 1062 O SER A 140 26.323 4.784 -11.020 1.00 13.76 O
1536 ATOM 1063 CB SER A 140 23.339 4.164 -10.150 1.00 12.31 C
1537 ATOM 1064 OG SER A 140 22.818 4.522 -11.473 1.00 16.30 O
1538 ATOM 1065 N ASN A 141 25.373 3.539 -12.620 1.00 14.28 N
1539 ATOM 1066 CA ASN A 141 26.179 4.219 -13.636 1.00 15.29 C
1540 ATOM 1067 C ASN A 141 25.876 5.715 -13.687 1.00 16.59 C
1541 ATOM 1068 O ASN A 141 26.684 6.481 -14.234 1.00 18.54 O
1542 ATOM 1069 CB ASN A 141 25.882 3.646 -15.030 1.00 15.40 C
1543 ATOM 1070 CG ASN A 141 26.390 2.240 -15.203 1.00 16.22 C
1544 ATOM 1071 OD1 ASN A 141 27.303 1.803 -14.487 1.00 17.13 O
1545 ATOM 1072 ND2 ASN A 141 25.842 1.511 -16.171 1.00 15.29 N
1546 ATOM 1073 N ASP A 142 24.763 6.132 -13.093 1.00 17.60 N
1547 ATOM 1074 CA ASP A 142 24.325 7.522 -13.211 1.00 17.95 C
1548 ATOM 1075 C ASP A 142 24.679 8.426 -12.040 1.00 17.82 C
1549 ATOM 1076 O ASP A 142 24.252 9.565 -11.993 1.00 18.62 O
1550 ATOM 1077 CB ASP A 142 22.829 7.560 -13.477 1.00 20.29 C
1551 ATOM 1078 CG ASP A 142 22.469 6.840 -14.784 1.00 26.11 C
1552 ATOM 1079 OD1 ASP A 142 23.072 7.183 -15.817 1.00 34.44 O
1553 ATOM 1080 OD2 ASP A 142 21.614 5.935 -14.887 1.00 33.53 O
1554 ATOM 1081 N ASP A 143 25.417 7.889 -11.068 1.00 15.65 N
1555 ATOM 1082 CA ASP A 143 25.807 8.697 -9.911 1.00 14.48 C
1556 ATOM 1083 C ASP A 143 27.077 8.146 -9.299 1.00 14.33 C
1557 ATOM 1084 O ASP A 143 27.645 7.156 -9.754 1.00 15.08 O
1558 ATOM 1085 CB ASP A 143 24.674 8.641 -8.885 1.00 15.37 C
1559 ATOM 1086 CG ASP A 143 24.581 9.868 -7.993 1.00 14.41 C
1560 ATOM 1087 OD1 ASP A 143 25.488 10.753 -7.985 1.00 16.01 O
1561 ATOM 1088 OD2 ASP A 143 23.594 10.019 -7.219 1.00 16.07 O
1562 ATOM 1089 N GLU A 144 27.556 8.870 -8.297 1.00 13.68 N
1563 ATOM 1090 CA GLU A 144 28.674 8.448 -7.466 1.00 14.39 C
1564 ATOM 1091 C GLU A 144 28.258 7.333 -6.531 1.00 12.46 C
1565 ATOM 1092 O GLU A 144 27.065 7.035 -6.379 1.00 13.58 O
1566 ATOM 1093 CB GLU A 144 29.190 9.620 -6.628 1.00 15.81 C
1567 ATOM 1094 CG GLU A 144 29.552 10.823 -7.485 1.00 22.32 C
1568 ATOM 1095 CD GLU A 144 30.789 10.614 -8.323 1.00 30.85 C
1569 ATOM 1096 OE1 GLU A 144 31.501 9.603 -8.147 1.00 32.36 O
1570 ATOM 1097 OE2 GLU A 144 31.083 11.505 -9.160 1.00 38.81 O
1571 ATOM 1098 N GLN A 145 29.246 6.714 -5.872 1.00 12.73 N
1572 ATOM 1099 CA GLN A 145 28.953 5.645 -4.893 1.00 11.60 C
1573 ATOM 1100 C GLN A 145 28.484 6.288 -3.589 1.00 12.06 C
1574 ATOM 1101 O GLN A 145 29.123 7.225 -3.105 1.00 12.85 O
1575 ATOM 1102 CB GLN A 145 30.227 4.811 -4.637 1.00 10.86 C
1576 ATOM 1103 CG GLN A 145 29.994 3.570 -3.770 1.00 10.90 C
1577 ATOM 1104 CD GLN A 145 31.125 2.581 -3.915 1.00 12.71 C
1578 ATOM 1105 OE1 GLN A 145 31.530 2.220 -5.032 1.00 13.38 O
1579 ATOM 1106 NE2 GLN A 145 31.668 2.135 -2.759 1.00 11.17 N
1580 ATOM 1107 N TYR A 146 27.371 5.777 -3.042 1.00 11.72 N
1581 ATOM 1108 CA TYR A 146 26.768 6.315 -1.805 1.00 11.47 C
1582 ATOM 1109 C TYR A 146 26.498 5.213 -0.797 1.00 10.96 C
1583 ATOM 1110 O TYR A 146 26.359 4.049 -1.169 1.00 11.85 O
1584 ATOM 1111 CB TYR A 146 25.430 7.045 -2.068 1.00 12.15 C
1585 ATOM 1112 CG TYR A 146 25.624 8.444 -2.571 1.00 11.81 C
1586 ATOM 1113 CD1 TYR A 146 25.717 8.701 -3.943 1.00 13.56 C
1587 ATOM 1114 CD2 TYR A 146 25.748 9.498 -1.687 1.00 12.17 C
1588 ATOM 1115 CE1 TYR A 146 25.909 9.997 -4.386 1.00 14.07 C
1589 ATOM 1116 CE2 TYR A 146 25.889 10.808 -2.148 1.00 14.14 C
1590 ATOM 1117 CZ TYR A 146 26.017 11.024 -3.482 1.00 14.57 C
1591 ATOM 1118 OH TYR A 146 26.209 12.342 -3.940 1.00 16.70 O
1592 ATOM 1119 N ILE A 147 26.404 5.620 0.483 1.00 10.75 N
1593 ATOM 1120 CA ILE A 147 26.112 4.666 1.581 1.00 10.85 C
1594 ATOM 1121 C ILE A 147 24.825 5.124 2.240 1.00 10.91 C
1595 ATOM 1122 O ILE A 147 24.747 6.266 2.699 1.00 12.59 O
1596 ATOM 1123 CB ILE A 147 27.201 4.733 2.678 1.00 11.55 C
1597 ATOM 1124 CG1 ILE A 147 28.568 4.449 2.052 1.00 13.08 C
1598 ATOM 1125 CG2 ILE A 147 26.865 3.691 3.790 1.00 13.23 C
1599 ATOM 1126 CD1 ILE A 147 29.722 5.081 2.853 1.00 11.89 C
1600 ATOM 1127 N TRP A 148 23.819 4.246 2.266 1.00 10.85 N
1601 ATOM 1128 CA TRP A 148 22.567 4.503 2.987 1.00 10.01 C
1602 ATOM 1129 C TRP A 148 22.639 3.655 4.251 1.00 12.15 C
1603 ATOM 1130 O TRP A 148 23.040 2.485 4.192 1.00 11.80 O
1604 ATOM 1131 CB TRP A 148 21.439 4.044 2.061 1.00 11.26 C
1605 ATOM 1132 CG TRP A 148 20.035 4.084 2.594 1.00 11.05 C
1606 ATOM 1133 CD1 TRP A 148 19.079 5.030 2.302 1.00 12.78 C
1607 ATOM 1134 CD2 TRP A 148 19.389 3.087 3.382 1.00 13.14 C
1608 ATOM 1135 NE1 TRP A 148 17.879 4.697 2.902 1.00 13.62 N
1609 ATOM 1136 CE2 TRP A 148 18.030 3.515 3.568 1.00 13.21 C
1610 ATOM 1137 CE3 TRP A 148 19.809 1.885 3.957 1.00 14.02 C
1611 ATOM 1138 CZ2 TRP A 148 17.093 2.764 4.324 1.00 14.97 C
1612 ATOM 1139 CZ3 TRP A 148 18.862 1.108 4.690 1.00 16.27 C
1613 ATOM 1140 CH2 TRP A 148 17.534 1.570 4.855 1.00 13.95 C
1614 ATOM 1141 N GLU A 149 22.316 4.239 5.409 1.00 11.49 N
1615 ATOM 1142 CA GLU A 149 22.456 3.448 6.657 1.00 11.80 C
1616 ATOM 1143 C GLU A 149 21.238 3.566 7.521 1.00 12.07 C
1617 ATOM 1144 O GLU A 149 20.712 4.673 7.697 1.00 13.43 O
1618 ATOM 1145 CB GLU A 149 23.679 3.906 7.468 1.00 12.61 C
1619 ATOM 1146 CG GLU A 149 23.980 3.014 8.681 1.00 13.31 C
1620 ATOM 1147 CD GLU A 149 25.417 3.171 9.238 1.00 17.06 C
1621 ATOM 1148 OE1 GLU A 149 26.056 4.165 8.978 1.00 19.56 O
1622 ATOM 1149 OE2 GLU A 149 25.939 2.248 9.887 1.00 24.58 O
1623 ATOM 1150 N SER A 150 20.855 2.434 8.107 1.00 11.79 N
1624 ATOM 1151 CA SER A 150 19.683 2.397 9.000 1.00 11.73 C
1625 ATOM 1152 C SER A 150 19.912 1.456 10.164 1.00 14.43 C
1626 ATOM 1153 O SER A 150 20.557 0.428 10.018 1.00 14.24 O
1627 ATOM 1154 CB SER A 150 18.456 1.874 8.203 1.00 14.27 C
1628 ATOM 1155 OG SER A 150 17.334 1.617 9.059 1.00 15.27 O
1629 ATOM 1156 N ASN A 151 19.350 1.824 11.319 1.00 15.32 N
1630 ATOM 1157 CA ASN A 151 19.394 0.926 12.469 1.00 16.43 C
1631 ATOM 1158 C ASN A 151 17.996 0.614 12.892 1.00 16.72 C
1632 ATOM 1159 O ASN A 151 17.713 0.355 14.054 1.00 17.35 O
1633 ATOM 1160 CB ASN A 151 20.169 1.632 13.586 1.00 16.64 C
1634 ATOM 1161 CG ASN A 151 19.475 2.886 14.043 1.00 18.66 C
1635 ATOM 1162 OD1 ASN A 151 18.510 3.322 13.434 1.00 19.97 O
1636 ATOM 1163 ND2 ASN A 151 20.011 3.518 15.076 1.00 27.08 N
1637 ATOM 1164 N ALA A 152 17.109 0.568 11.902 1.00 16.13 N
1638 ATOM 1165 CA ALA A 152 15.677 0.252 12.091 1.00 16.92 C
1639 ATOM 1166 C ALA A 152 14.937 1.362 12.836 1.00 17.67 C
1640 ATOM 1167 O ALA A 152 13.762 1.180 13.188 1.00 20.28 O
1641 ATOM 1168 CB ALA A 152 15.433 -1.157 12.754 1.00 17.38 C
1642 ATOM 1169 N GLY A 153 15.597 2.482 13.078 1.00 18.99 N
1643 ATOM 1170 CA GLY A 153 14.950 3.613 13.716 1.00 20.17 C
1644 ATOM 1171 C GLY A 153 14.252 4.446 12.658 1.00 20.28 C
1645 ATOM 1172 O GLY A 153 14.283 4.097 11.477 1.00 19.83 O
1646 ATOM 1173 N GLY A 154 13.691 5.582 13.066 1.00 19.18 N
1647 ATOM 1174 CA GLY A 154 12.881 6.401 12.178 1.00 19.18 C
1648 ATOM 1175 C GLY A 154 13.606 7.260 11.163 1.00 17.89 C
1649 ATOM 1176 O GLY A 154 12.979 7.863 10.295 1.00 18.61 O
1650 ATOM 1177 N SER A 155 14.923 7.326 11.281 1.00 18.53 N
1651 ATOM 1178 CA SER A 155 15.714 8.147 10.356 1.00 17.74 C
1652 ATOM 1179 C SER A 155 16.843 7.321 9.748 1.00 17.16 C
1653 ATOM 1180 O SER A 155 17.312 6.335 10.341 1.00 17.80 O
1654 ATOM 1181 CB SER A 155 16.301 9.381 11.090 1.00 19.73 C
1655 ATOM 1182 OG SER A 155 17.220 8.989 12.096 1.00 26.25 O
1656 ATOM 1183 N PHE A 156 17.263 7.707 8.548 1.00 16.50 N
1657 ATOM 1184 CA PHE A 156 18.406 7.039 7.922 1.00 14.54 C
1658 ATOM 1185 C PHE A 156 19.360 8.113 7.395 1.00 14.23 C
1659 ATOM 1186 O PHE A 156 18.989 9.286 7.256 1.00 15.84 O
1660 ATOM 1187 CB PHE A 156 17.994 6.121 6.750 1.00 14.53 C
1661 ATOM 1188 CG PHE A 156 17.229 6.805 5.645 1.00 14.03 C
1662 ATOM 1189 CD1 PHE A 156 17.904 7.315 4.530 1.00 14.63 C
1663 ATOM 1190 CD2 PHE A 156 15.831 6.897 5.681 1.00 15.75 C
1664 ATOM 1191 CE1 PHE A 156 17.222 7.896 3.458 1.00 14.51 C
1665 ATOM 1192 CE2 PHE A 156 15.130 7.472 4.614 1.00 15.57 C
1666 ATOM 1193 CZ PHE A 156 15.834 7.980 3.480 1.00 16.38 C
1667 ATOM 1194 N THR A 157 20.585 7.701 7.092 1.00 13.59 N
1668 ATOM 1195 CA THR A 157 21.533 8.657 6.546 1.00 13.39 C
1669 ATOM 1196 C THR A 157 21.964 8.215 5.171 1.00 12.77 C
1670 ATOM 1197 O THR A 157 21.902 7.038 4.820 1.00 13.77 O
1671 ATOM 1198 CB THR A 157 22.788 8.763 7.394 1.00 13.97 C
1672 ATOM 1199 OG1 THR A 157 23.420 7.478 7.555 1.00 14.77 O
1673 ATOM 1200 CG2 THR A 157 22.426 9.202 8.843 1.00 15.40 C
1674 ATOM 1201 N VAL A 158 22.397 9.198 4.397 1.00 12.76 N
1675 ATOM 1202 CA VAL A 158 22.982 8.906 3.100 1.00 13.30 C
1676 ATOM 1203 C VAL A 158 24.266 9.727 3.048 1.00 14.50 C
1677 ATOM 1204 O VAL A 158 24.234 10.945 3.324 1.00 15.25 O
1678 ATOM 1205 CB VAL A 158 22.049 9.336 1.946 1.00 13.60 C
1679 ATOM 1206 CG1 VAL A 158 22.728 9.077 0.629 1.00 15.90 C
1680 ATOM 1207 CG2 VAL A 158 20.756 8.524 2.005 1.00 15.19 C
1681 ATOM 1208 N THR A 159 25.366 9.082 2.669 1.00 13.56 N
1682 ATOM 1209 CA THR A 159 26.714 9.700 2.705 1.00 13.32 C
1683 ATOM 1210 C THR A 159 27.468 9.329 1.429 1.00 13.50 C
1684 ATOM 1211 O THR A 159 27.459 8.186 0.997 1.00 11.95 O
1685 ATOM 1212 CB THR A 159 27.484 9.155 3.914 1.00 14.44 C
1686 ATOM 1213 OG1 THR A 159 26.725 9.332 5.124 1.00 16.00 O
1687 ATOM 1214 CG2 THR A 159 28.812 9.900 4.154 1.00 15.59 C
1688 ATOM 1215 N LEU A 160 28.080 10.342 0.799 1.00 13.14 N
1689 ATOM 1216 CA LEU A 160 28.933 10.052 -0.350 1.00 13.06 C
1690 ATOM 1217 C LEU A 160 30.040 9.131 0.158 1.00 13.41 C
1691 ATOM 1218 O LEU A 160 30.606 9.347 1.227 1.00 13.08 O
1692 ATOM 1219 CB LEU A 160 29.554 11.381 -0.849 1.00 14.42 C
1693 ATOM 1220 CG LEU A 160 30.563 11.210 -1.972 1.00 15.27 C
1694 ATOM 1221 CD1 LEU A 160 29.835 10.755 -3.205 1.00 18.45 C
1695 ATOM 1222 CD2 LEU A 160 31.192 12.591 -2.210 1.00 20.38 C
1696 ATOM 1223 N ASP A 161 30.320 8.068 -0.594 1.00 12.14 N
1697 ATOM 1224 CA ASP A 161 31.235 6.991 -0.147 1.00 12.28 C
1698 ATOM 1225 C ASP A 161 32.716 7.257 -0.422 1.00 13.61 C
1699 ATOM 1226 O ASP A 161 33.150 7.198 -1.570 1.00 14.56 O
1700 ATOM 1227 CB ASP A 161 30.827 5.679 -0.806 1.00 12.50 C
1701 ATOM 1228 CG ASP A 161 31.481 4.498 -0.172 1.00 11.91 C
1702 ATOM 1229 OD1 ASP A 161 32.556 4.630 0.447 1.00 12.01 O
1703 ATOM 1230 OD2 ASP A 161 30.996 3.387 -0.266 1.00 10.42 O
1704 ATOM 1231 N GLU A 162 33.467 7.572 0.623 1.00 13.84 N
1705 ATOM 1232 CA GLU A 162 34.907 7.713 0.496 1.00 15.60 C
1706 ATOM 1233 C GLU A 162 35.595 6.706 1.443 1.00 15.64 C
1707 ATOM 1234 O GLU A 162 36.732 6.930 1.856 1.00 15.88 O
1708 ATOM 1235 CB GLU A 162 35.338 9.151 0.834 1.00 17.66 C
1709 ATOM 1236 CG GLU A 162 34.864 10.215 -0.154 1.00 21.53 C
1710 ATOM 1237 CD GLU A 162 35.251 11.639 0.232 1.00 31.70 C
1711 ATOM 1238 OE1 GLU A 162 36.009 11.812 1.207 1.00 35.33 O
1712 ATOM 1239 OE2 GLU A 162 34.787 12.572 -0.456 1.00 37.57 O
1713 ATOM 1240 N VAL A 163 34.903 5.632 1.807 1.00 13.23 N
1714 ATOM 1241 CA VAL A 163 35.465 4.675 2.782 1.00 14.00 C
1715 ATOM 1242 C VAL A 163 35.434 3.203 2.403 1.00 12.84 C
1716 ATOM 1243 O VAL A 163 36.120 2.385 2.999 1.00 14.20 O
1717 ATOM 1244 CB VAL A 163 34.849 4.852 4.184 1.00 13.34 C
1718 ATOM 1245 CG1 VAL A 163 35.147 6.283 4.697 1.00 15.53 C
1719 ATOM 1246 CG2 VAL A 163 33.311 4.619 4.158 1.00 15.01 C
1720 ATOM 1247 N ASN A 164 34.603 2.831 1.433 1.00 11.93 N
1721 ATOM 1248 CA ASN A 164 34.473 1.434 1.041 1.00 11.68 C
1722 ATOM 1249 C ASN A 164 35.150 1.095 -0.281 1.00 12.42 C
1723 ATOM 1250 O ASN A 164 35.438 2.006 -1.056 1.00 13.46 O
1724 ATOM 1251 CB ASN A 164 32.991 1.030 0.979 1.00 11.52 C
1725 ATOM 1252 CG ASN A 164 32.303 1.177 2.315 1.00 11.17 C
1726 ATOM 1253 OD1 ASN A 164 32.755 0.558 3.302 1.00 12.59 O
1727 ATOM 1254 ND2 ASN A 164 31.279 2.001 2.390 1.00 11.10 N
1728 ATOM 1255 N GLU A 165 35.378 -0.185 -0.535 1.00 12.65 N
1729 ATOM 1256 CA GLU A 165 35.922 -0.564 -1.852 1.00 14.49 C
1730 ATOM 1257 C GLU A 165 35.026 -0.022 -2.962 1.00 14.69 C
1731 ATOM 1258 O GLU A 165 33.784 0.100 -2.815 1.00 14.56 O
1732 ATOM 1259 CB GLU A 165 36.016 -2.086 -1.955 1.00 14.62 C
1733 ATOM 1260 CG GLU A 165 34.661 -2.790 -1.895 1.00 19.09 C
1734 ATOM 1261 CD GLU A 165 34.767 -4.294 -2.020 1.00 26.46 C
1735 ATOM 1262 OE1 GLU A 165 35.596 -4.782 -2.843 1.00 27.35 O
1736 ATOM 1263 OE2 GLU A 165 34.048 -4.982 -1.257 1.00 30.42 O
1737 ATOM 1264 N ARG A 166 35.611 0.358 -4.092 1.00 13.76 N
1738 ATOM 1265 CA ARG A 166 34.794 0.756 -5.214 1.00 15.12 C
1739 ATOM 1266 C ARG A 166 34.056 -0.443 -5.771 1.00 16.22 C
1740 ATOM 1267 O ARG A 166 34.653 -1.516 -5.983 1.00 17.84 O
1741 ATOM 1268 CB ARG A 166 35.672 1.287 -6.333 1.00 14.19 C
1742 ATOM 1269 CG ARG A 166 36.437 2.527 -5.932 1.00 14.02 C
1743 ATOM 1270 CD ARG A 166 35.583 3.665 -5.486 1.00 13.32 C
1744 ATOM 1271 NE ARG A 166 35.368 3.615 -4.015 1.00 13.41 N
1745 ATOM 1272 CZ ARG A 166 34.675 4.532 -3.350 1.00 14.51 C
1746 ATOM 1273 NH1 ARG A 166 34.109 5.520 -4.025 1.00 16.27 N
1747 ATOM 1274 NH2 ARG A 166 34.533 4.453 -2.013 1.00 15.62 N
1748 ATOM 1275 N ILE A 167 32.768 -0.233 -6.044 1.00 15.59 N
1749 ATOM 1276 CA ILE A 167 31.904 -1.211 -6.672 1.00 17.51 C
1750 ATOM 1277 C ILE A 167 31.998 -0.699 -8.152 1.00 18.10 C
1751 ATOM 1278 O ILE A 167 31.987 0.463 -8.412 1.00 20.54 O
1752 ATOM 1279 CB ILE A 167 30.436 -0.982 -6.119 1.00 16.99 C
1753 ATOM 1280 CG1 ILE A 167 30.342 -1.274 -4.624 1.00 22.57 C
1754 ATOM 1281 CG2 ILE A 167 29.406 -1.786 -6.911 1.00 20.53 C
1755 ATOM 1282 CD1 ILE A 167 28.890 -1.036 -4.085 1.00 22.86 C
1756 ATOM 1283 N GLY A 168 32.081 -1.548 -9.109 1.00 19.91 N
1757 ATOM 1284 CA GLY A 168 32.107 -1.014 -10.448 1.00 16.64 C
1758 ATOM 1285 C GLY A 168 30.708 -0.523 -10.758 1.00 16.02 C
1759 ATOM 1286 O GLY A 168 30.507 0.574 -11.328 1.00 15.28 O
1760 ATOM 1287 N ARG A 169 29.754 -1.385 -10.416 1.00 13.71 N
1761 ATOM 1288 CA ARG A 169 28.323 -1.048 -10.529 1.00 12.75 C
1762 ATOM 1289 C ARG A 169 27.601 -2.080 -9.695 1.00 13.29 C
1763 ATOM 1290 O ARG A 169 27.993 -3.244 -9.685 1.00 14.68 O
1764 ATOM 1291 CB ARG A 169 27.850 -1.254 -11.992 1.00 12.87 C
1765 ATOM 1292 CG ARG A 169 26.416 -0.855 -12.240 1.00 12.66 C
1766 ATOM 1293 CD ARG A 169 25.813 -1.448 -13.586 1.00 12.67 C
1767 ATOM 1294 NE ARG A 169 25.899 -2.917 -13.623 1.00 12.81 N
1768 ATOM 1295 CZ ARG A 169 26.759 -3.606 -14.391 1.00 13.50 C
1769 ATOM 1296 NH1 ARG A 169 27.574 -2.946 -15.201 1.00 15.22 N
1770 ATOM 1297 NH2 ARG A 169 26.787 -4.939 -14.358 1.00 14.88 N
1771 ATOM 1298 N GLY A 170 26.533 -1.645 -8.999 1.00 11.60 N
1772 ATOM 1299 CA GLY A 170 25.748 -2.580 -8.211 1.00 11.81 C
1773 ATOM 1300 C GLY A 170 25.575 -2.142 -6.784 1.00 11.08 C
1774 ATOM 1301 O GLY A 170 25.657 -0.960 -6.457 1.00 12.69 O
1775 ATOM 1302 N THR A 171 25.315 -3.129 -5.929 1.00 10.25 N
1776 ATOM 1303 CA THR A 171 24.936 -2.776 -4.565 1.00 11.12 C
1777 ATOM 1304 C THR A 171 25.505 -3.827 -3.617 1.00 11.28 C
1778 ATOM 1305 O THR A 171 25.513 -5.023 -3.915 1.00 12.20 O
1779 ATOM 1306 CB THR A 171 23.393 -2.853 -4.494 1.00 12.08 C
1780 ATOM 1307 OG1 THR A 171 22.816 -1.800 -5.313 1.00 11.85 O
1781 ATOM 1308 CG2 THR A 171 22.878 -2.566 -3.082 1.00 13.21 C
1782 ATOM 1309 N ILE A 172 25.927 -3.354 -2.439 1.00 10.31 N
1783 ATOM 1310 CA ILE A 172 26.300 -4.243 -1.335 1.00 10.95 C
1784 ATOM 1311 C ILE A 172 25.370 -3.966 -0.173 1.00 10.69 C
1785 ATOM 1312 O ILE A 172 25.225 -2.813 0.247 1.00 11.91 O
1786 ATOM 1313 CB ILE A 172 27.700 -3.917 -0.848 1.00 11.22 C
1787 ATOM 1314 CG1 ILE A 172 28.695 -4.250 -1.965 1.00 11.78 C
1788 ATOM 1315 CG2 ILE A 172 28.044 -4.796 0.398 1.00 12.79 C
1789 ATOM 1316 CD1 ILE A 172 30.176 -3.871 -1.634 1.00 15.37 C
1790 ATOM 1317 N LEU A 173 24.756 -5.009 0.356 1.00 10.88 N
1791 ATOM 1318 CA LEU A 173 24.007 -4.907 1.585 1.00 11.32 C
1792 ATOM 1319 C LEU A 173 24.973 -5.427 2.638 1.00 10.85 C
1793 ATOM 1320 O LEU A 173 25.332 -6.609 2.619 1.00 12.64 O
1794 ATOM 1321 CB LEU A 173 22.755 -5.791 1.531 1.00 11.03 C
1795 ATOM 1322 CG LEU A 173 21.487 -4.991 1.193 1.00 12.32 C
1796 ATOM 1323 CD1 LEU A 173 21.559 -4.418 -0.201 1.00 14.11 C
1797 ATOM 1324 CD2 LEU A 173 20.321 -5.971 1.309 1.00 13.62 C
1798 ATOM 1325 N ARG A 174 25.363 -4.547 3.554 1.00 10.22 N
1799 ATOM 1326 CA ARG A 174 26.299 -4.924 4.608 1.00 11.54 C
1800 ATOM 1327 C ARG A 174 25.463 -5.038 5.887 1.00 10.89 C
1801 ATOM 1328 O ARG A 174 25.007 -4.024 6.438 1.00 11.44 O
1802 ATOM 1329 CB ARG A 174 27.417 -3.877 4.718 1.00 10.94 C
1803 ATOM 1330 CG ARG A 174 28.383 -4.128 5.942 1.00 11.31 C
1804 ATOM 1331 CD ARG A 174 29.438 -3.065 6.014 1.00 11.90 C
1805 ATOM 1332 NE ARG A 174 30.352 -3.153 4.857 1.00 11.17 N
1806 ATOM 1333 CZ ARG A 174 31.107 -2.146 4.433 1.00 11.79 C
1807 ATOM 1334 NH1 ARG A 174 30.986 -0.933 5.000 1.00 13.28 N
1808 ATOM 1335 NH2 ARG A 174 31.974 -2.390 3.420 1.00 11.72 N
1809 ATOM 1336 N LEU A 175 25.268 -6.281 6.338 1.00 11.00 N
1810 ATOM 1337 CA LEU A 175 24.378 -6.575 7.475 1.00 11.72 C
1811 ATOM 1338 C LEU A 175 25.256 -6.706 8.709 1.00 11.91 C
1812 ATOM 1339 O LEU A 175 26.235 -7.463 8.701 1.00 13.39 O
1813 ATOM 1340 CB LEU A 175 23.653 -7.907 7.267 1.00 12.19 C
1814 ATOM 1341 CG LEU A 175 22.823 -8.055 5.996 1.00 15.78 C
1815 ATOM 1342 CD1 LEU A 175 21.923 -9.283 6.271 1.00 16.90 C
1816 ATOM 1343 CD2 LEU A 175 21.992 -6.894 5.638 1.00 17.48 C
1817 ATOM 1344 N PHE A 176 24.916 -5.927 9.736 1.00 12.89 N
1818 ATOM 1345 CA PHE A 176 25.616 -6.076 11.026 1.00 13.38 C
1819 ATOM 1346 C PHE A 176 24.753 -6.999 11.838 1.00 14.40 C
1820 ATOM 1347 O PHE A 176 23.688 -6.629 12.339 1.00 14.72 O
1821 ATOM 1348 CB PHE A 176 25.786 -4.719 11.687 1.00 14.28 C
1822 ATOM 1349 CG PHE A 176 26.679 -3.787 10.905 1.00 15.59 C
1823 ATOM 1350 CD1 PHE A 176 26.176 -3.064 9.849 1.00 13.59 C
1824 ATOM 1351 CD2 PHE A 176 28.021 -3.643 11.241 1.00 16.41 C
1825 ATOM 1352 CE1 PHE A 176 27.004 -2.238 9.106 1.00 15.77 C
1826 ATOM 1353 CE2 PHE A 176 28.869 -2.805 10.525 1.00 18.31 C
1827 ATOM 1354 CZ PHE A 176 28.342 -2.077 9.447 1.00 15.80 C
1828 ATOM 1355 N LEU A 177 25.203 -8.238 11.920 1.00 14.60 N
1829 ATOM 1356 CA LEU A 177 24.423 -9.300 12.531 1.00 14.77 C
1830 ATOM 1357 C LEU A 177 24.225 -9.138 14.033 1.00 15.75 C
1831 ATOM 1358 O LEU A 177 25.103 -8.676 14.760 1.00 16.26 O
1832 ATOM 1359 CB LEU A 177 25.099 -10.631 12.234 1.00 15.17 C
1833 ATOM 1360 CG LEU A 177 25.171 -11.070 10.771 1.00 15.43 C
1834 ATOM 1361 CD1 LEU A 177 25.866 -12.458 10.708 1.00 19.53 C
1835 ATOM 1362 CD2 LEU A 177 23.823 -11.186 10.067 1.00 16.38 C
1836 ATOM 1363 N LYS A 178 23.037 -9.540 14.459 1.00 16.17 N
1837 ATOM 1364 CA LYS A 178 22.733 -9.594 15.912 1.00 18.03 C
1838 ATOM 1365 C LYS A 178 23.618 -10.647 16.571 1.00 19.55 C
1839 ATOM 1366 O LYS A 178 23.992 -11.614 15.945 1.00 19.64 O
1840 ATOM 1367 CB LYS A 178 21.282 -9.978 16.107 1.00 18.01 C
1841 ATOM 1368 CG LYS A 178 20.278 -8.938 15.624 1.00 17.30 C
1842 ATOM 1369 CD LYS A 178 18.885 -9.556 15.559 1.00 15.68 C
1843 ATOM 1370 CE LYS A 178 17.796 -8.529 15.399 1.00 18.54 C
1844 ATOM 1371 NZ LYS A 178 16.381 -9.113 15.295 1.00 17.82 N
1845 ATOM 1372 N ASP A 179 23.871 -10.481 17.862 1.00 22.26 N
1846 ATOM 1373 CA ASP A 179 24.811 -11.372 18.561 1.00 25.69 C
1847 ATOM 1374 C ASP A 179 24.383 -12.833 18.593 1.00 26.32 C
1848 ATOM 1375 O ASP A 179 25.235 -13.734 18.717 1.00 26.73 O
1849 ATOM 1376 CB ASP A 179 25.031 -10.873 19.988 1.00 26.97 C
1850 ATOM 1377 CG ASP A 179 26.019 -9.756 20.060 1.00 32.62 C
1851 ATOM 1378 OD1 ASP A 179 26.803 -9.622 19.099 1.00 34.82 O
1852 ATOM 1379 OD2 ASP A 179 26.091 -8.966 21.023 1.00 38.46 O
1853 ATOM 1380 N ASP A 180 23.088 -13.095 18.464 1.00 26.82 N
1854 ATOM 1381 CA ASP A 180 22.637 -14.471 18.489 1.00 27.71 C
1855 ATOM 1382 C ASP A 180 22.365 -15.026 17.105 1.00 26.39 C
1856 ATOM 1383 O ASP A 180 21.808 -16.111 16.951 1.00 25.25 O
1857 ATOM 1384 CB ASP A 180 21.413 -14.618 19.394 1.00 29.28 C
1858 ATOM 1385 CG ASP A 180 20.174 -14.010 18.804 1.00 33.69 C
1859 ATOM 1386 OD1 ASP A 180 20.268 -12.943 18.160 1.00 34.86 O
1860 ATOM 1387 OD2 ASP A 180 19.044 -14.525 18.948 1.00 40.63 O
1861 ATOM 1388 N GLN A 181 22.789 -14.294 16.066 1.00 24.20 N
1862 ATOM 1389 CA GLN A 181 22.552 -14.768 14.727 1.00 24.10 C
1863 ATOM 1390 C GLN A 181 23.860 -14.949 13.965 1.00 24.09 C
1864 ATOM 1391 O GLN A 181 23.862 -14.929 12.738 1.00 24.15 O
1865 ATOM 1392 CB GLN A 181 21.621 -13.794 13.957 1.00 22.71 C
1866 ATOM 1393 CG GLN A 181 20.299 -13.572 14.629 1.00 24.69 C
1867 ATOM 1394 CD GLN A 181 19.468 -14.827 14.708 1.00 24.79 C
1868 ATOM 1395 OE1 GLN A 181 19.446 -15.638 13.789 1.00 25.92 O
1869 ATOM 1396 NE2 GLN A 181 18.741 -14.970 15.820 1.00 27.75 N
1870 ATOM 1397 N LEU A 182 24.950 -15.203 14.688 1.00 24.19 N
1871 ATOM 1398 CA LEU A 182 26.232 -15.342 14.021 1.00 23.90 C
1872 ATOM 1399 C LEU A 182 26.367 -16.613 13.204 1.00 23.75 C
1873 ATOM 1400 O LEU A 182 27.361 -16.808 12.512 1.00 23.12 O
1874 ATOM 1401 CB LEU A 182 27.382 -15.186 15.012 1.00 24.53 C
1875 ATOM 1402 CG LEU A 182 27.338 -13.899 15.822 1.00 25.60 C
1876 ATOM 1403 CD1 LEU A 182 28.549 -13.788 16.696 1.00 26.28 C
1877 ATOM 1404 CD2 LEU A 182 27.270 -12.683 14.827 1.00 26.82 C
1878 ATOM 1405 N GLU A 183 25.369 -17.493 13.246 1.00 22.60 N
1879 ATOM 1406 CA GLU A 183 25.490 -18.695 12.437 1.00 21.74 C
1880 ATOM 1407 C GLU A 183 25.550 -18.346 10.951 1.00 21.94 C
1881 ATOM 1408 O GLU A 183 25.972 -19.138 10.116 1.00 20.97 O
1882 ATOM 1409 CB GLU A 183 24.284 -19.631 12.687 1.00 22.81 C
1883 ATOM 1410 CG GLU A 183 22.952 -19.030 12.254 1.00 22.91 C
1884 ATOM 1411 CD GLU A 183 21.726 -19.856 12.736 1.00 22.62 C
1885 ATOM 1412 OE1 GLU A 183 21.387 -19.653 13.921 1.00 27.68 O
1886 ATOM 1413 OE2 GLU A 183 21.136 -20.627 11.951 1.00 25.34 O
1887 ATOM 1414 N TYR A 184 25.049 -17.158 10.616 1.00 20.91 N
1888 ATOM 1415 CA TYR A 184 25.007 -16.803 9.208 1.00 21.03 C
1889 ATOM 1416 C TYR A 184 26.342 -16.333 8.692 1.00 22.08 C
1890 ATOM 1417 O TYR A 184 26.411 -15.858 7.557 1.00 22.28 O
1891 ATOM 1418 CB TYR A 184 23.883 -15.778 8.920 1.00 19.57 C
1892 ATOM 1419 CG TYR A 184 22.557 -16.401 9.264 1.00 18.59 C
1893 ATOM 1420 CD1 TYR A 184 21.855 -16.011 10.402 1.00 19.58 C
1894 ATOM 1421 CD2 TYR A 184 22.051 -17.436 8.500 1.00 17.34 C
1895 ATOM 1422 CE1 TYR A 184 20.643 -16.674 10.768 1.00 19.52 C
1896 ATOM 1423 CE2 TYR A 184 20.863 -18.093 8.828 1.00 19.74 C
1897 ATOM 1424 CZ TYR A 184 20.156 -17.689 9.972 1.00 21.83 C
1898 ATOM 1425 OH TYR A 184 18.989 -18.366 10.311 1.00 21.51 O
1899 ATOM 1426 N LEU A 185 27.370 -16.428 9.522 1.00 21.86 N
1900 ATOM 1427 CA LEU A 185 28.764 -16.187 9.101 1.00 22.26 C
1901 ATOM 1428 C LEU A 185 29.407 -17.489 8.659 1.00 24.03 C
1902 ATOM 1429 O LEU A 185 30.464 -17.500 8.037 1.00 24.03 O
1903 ATOM 1430 CB LEU A 185 29.597 -15.607 10.242 1.00 23.19 C
1904 ATOM 1431 CG LEU A 185 29.202 -14.242 10.801 1.00 22.47 C
1905 ATOM 1432 CD1 LEU A 185 29.972 -13.928 12.078 1.00 24.83 C
1906 ATOM 1433 CD2 LEU A 185 29.417 -13.144 9.753 1.00 23.98 C
1907 ATOM 1434 N GLU A 186 28.779 -18.605 8.998 1.00 23.84 N
1908 ATOM 1435 CA GLU A 186 29.375 -19.906 8.679 1.00 24.98 C
1909 ATOM 1436 C GLU A 186 29.098 -20.443 7.268 1.00 23.62 C
1910 ATOM 1437 O GLU A 186 27.959 -20.513 6.776 1.00 23.62 O
1911 ATOM 1438 CB GLU A 186 28.893 -20.924 9.718 1.00 24.45 C
1912 ATOM 1439 CG GLU A 186 29.200 -20.572 11.159 1.00 29.99 C
1913 ATOM 1440 CD GLU A 186 28.417 -21.465 12.118 1.00 35.36 C
1914 ATOM 1441 OE1 GLU A 186 27.623 -22.327 11.661 1.00 37.91 O
1915 ATOM 1442 OE2 GLU A 186 28.605 -21.289 13.336 1.00 40.41 O
1916 ATOM 1443 N GLU A 187 30.157 -20.911 6.606 1.00 24.73 N
1917 ATOM 1444 CA GLU A 187 30.053 -21.429 5.264 1.00 23.89 C
1918 ATOM 1445 C GLU A 187 28.987 -22.493 5.056 1.00 24.37 C
1919 ATOM 1446 O GLU A 187 28.227 -22.447 4.110 1.00 24.09 O
1920 ATOM 1447 CB GLU A 187 31.430 -22.006 4.829 1.00 24.81 C
1921 ATOM 1448 CG GLU A 187 31.413 -22.699 3.486 1.00 26.69 C
1922 ATOM 1449 CD GLU A 187 32.790 -23.256 3.073 1.00 24.13 C
1923 ATOM 1450 OE1 GLU A 187 33.662 -23.355 3.965 1.00 30.45 O
1924 ATOM 1451 OE2 GLU A 187 32.978 -23.572 1.881 1.00 28.81 O
1925 ATOM 1452 N LYS A 188 28.968 -23.485 5.936 1.00 24.97 N
1926 ATOM 1453 CA LYS A 188 28.039 -24.587 5.769 1.00 25.73 C
1927 ATOM 1454 C LYS A 188 26.578 -24.114 5.898 1.00 24.13 C
1928 ATOM 1455 O LYS A 188 25.727 -24.483 5.089 1.00 25.46 O
1929 ATOM 1456 CB LYS A 188 28.363 -25.679 6.795 1.00 26.22 C
1930 ATOM 1457 CG LYS A 188 27.519 -26.921 6.673 1.00 30.35 C
1931 ATOM 1458 N ARG A 189 26.344 -23.246 6.872 1.00 24.94 N
1932 ATOM 1459 CA ARG A 189 25.009 -22.692 7.104 1.00 24.59 C
1933 ATOM 1460 C ARG A 189 24.530 -21.875 5.902 1.00 24.04 C
1934 ATOM 1461 O ARG A 189 23.431 -22.067 5.378 1.00 24.27 O
1935 ATOM 1462 CB ARG A 189 25.006 -21.834 8.356 1.00 24.34 C
1936 ATOM 1463 CG ARG A 189 23.608 -21.322 8.694 1.00 23.56 C
1937 ATOM 1464 CD ARG A 189 22.629 -22.427 9.164 1.00 25.79 C
1938 ATOM 1465 NE ARG A 189 21.376 -21.808 9.644 1.00 23.93 N
1939 ATOM 1466 CZ ARG A 189 20.168 -22.072 9.180 1.00 24.40 C
1940 ATOM 1467 NH1 ARG A 189 19.967 -22.969 8.221 1.00 26.80 N
1941 ATOM 1468 NH2 ARG A 189 19.132 -21.410 9.698 1.00 25.67 N
1942 ATOM 1469 N ILE A 190 25.385 -20.968 5.434 1.00 24.14 N
1943 ATOM 1470 CA ILE A 190 25.010 -20.194 4.249 1.00 23.19 C
1944 ATOM 1471 C ILE A 190 24.672 -21.042 3.042 1.00 23.92 C
1945 ATOM 1472 O ILE A 190 23.657 -20.851 2.393 1.00 22.40 O
1946 ATOM 1473 CB ILE A 190 26.137 -19.188 3.884 1.00 23.13 C
1947 ATOM 1474 CG1 ILE A 190 26.387 -18.211 5.016 1.00 23.83 C
1948 ATOM 1475 CG2 ILE A 190 25.834 -18.506 2.535 1.00 22.53 C
1949 ATOM 1476 CD1 ILE A 190 27.700 -17.469 4.845 1.00 24.47 C
1950 ATOM 1477 N LYS A 191 25.509 -22.046 2.723 1.00 24.16 N
1951 ATOM 1478 CA LYS A 191 25.239 -22.839 1.552 1.00 25.09 C
1952 ATOM 1479 C LYS A 191 23.919 -23.593 1.723 1.00 24.29 C
1953 ATOM 1480 O LYS A 191 23.192 -23.820 0.752 1.00 24.93 O
1954 ATOM 1481 CB LYS A 191 26.330 -23.920 1.353 1.00 24.97 C
1955 ATOM 1482 CG LYS A 191 27.699 -23.336 1.042 1.00 28.60 C
1956 ATOM 1483 CD LYS A 191 28.682 -24.431 0.591 1.00 35.41 C
1957 ATOM 1484 CE LYS A 191 29.954 -23.737 0.171 1.00 39.40 C
1958 ATOM 1485 NZ LYS A 191 31.007 -24.749 -0.092 1.00 45.73 N
1959 ATOM 1486 N GLU A 192 23.634 -24.021 2.954 1.00 25.29 N
1960 ATOM 1487 CA GLU A 192 22.424 -24.776 3.232 1.00 26.36 C
1961 ATOM 1488 C GLU A 192 21.184 -23.917 3.007 1.00 25.26 C
1962 ATOM 1489 O GLU A 192 20.188 -24.365 2.427 1.00 25.34 O
1963 ATOM 1490 CB GLU A 192 22.462 -25.289 4.670 1.00 26.92 C
1964 ATOM 1491 CG GLU A 192 21.098 -25.705 5.169 1.00 34.28 C
1965 ATOM 1492 CD GLU A 192 21.158 -26.290 6.550 1.00 42.57 C
1966 ATOM 1493 OE1 GLU A 192 22.291 -26.373 7.108 1.00 47.52 O
1967 ATOM 1494 OE2 GLU A 192 20.074 -26.686 7.048 1.00 47.47 O
1968 ATOM 1495 N VAL A 193 21.271 -22.659 3.435 1.00 24.16 N
1969 ATOM 1496 CA VAL A 193 20.135 -21.741 3.257 1.00 23.42 C
1970 ATOM 1497 C VAL A 193 19.855 -21.405 1.791 1.00 23.67 C
1971 ATOM 1498 O VAL A 193 18.701 -21.387 1.361 1.00 23.95 O
1972 ATOM 1499 CB VAL A 193 20.322 -20.475 4.141 1.00 23.01 C
1973 ATOM 1500 CG1 VAL A 193 19.213 -19.446 3.923 1.00 22.68 C
1974 ATOM 1501 CG2 VAL A 193 20.388 -20.877 5.612 1.00 22.76 C
1975 ATOM 1502 N ILE A 194 20.917 -21.169 1.028 1.00 24.02 N
1976 ATOM 1503 CA ILE A 194 20.809 -20.862 -0.398 1.00 26.36 C
1977 ATOM 1504 C ILE A 194 20.224 -22.003 -1.163 1.00 26.80 C
1978 ATOM 1505 O ILE A 194 19.315 -21.841 -1.947 1.00 27.19 O
1979 ATOM 1506 CB ILE A 194 22.230 -20.559 -0.979 1.00 26.21 C
1980 ATOM 1507 CG1 ILE A 194 22.781 -19.267 -0.392 1.00 28.15 C
1981 ATOM 1508 CG2 ILE A 194 22.195 -20.516 -2.495 1.00 26.98 C
1982 ATOM 1509 CD1 ILE A 194 24.237 -19.040 -0.752 1.00 28.63 C
1983 ATOM 1510 N LYS A 195 20.740 -23.205 -0.905 1.00 28.45 N
1984 ATOM 1511 CA LYS A 195 20.309 -24.360 -1.661 1.00 29.81 C
1985 ATOM 1512 C LYS A 195 18.847 -24.618 -1.424 1.00 29.82 C
1986 ATOM 1513 O LYS A 195 18.135 -25.065 -2.305 1.00 31.00 O
1987 ATOM 1514 CB LYS A 195 21.129 -25.609 -1.286 1.00 29.69 C
1988 ATOM 1515 CG LYS A 195 22.578 -25.578 -1.770 1.00 32.97 C
1989 ATOM 1516 CD LYS A 195 23.380 -26.742 -1.178 1.00 37.32 C
1990 ATOM 1517 N ARG A 196 18.385 -24.267 -0.232 1.00 30.12 N
1991 ATOM 1518 CA ARG A 196 17.006 -24.529 0.141 1.00 30.52 C
1992 ATOM 1519 C ARG A 196 15.973 -23.621 -0.514 1.00 31.15 C
1993 ATOM 1520 O ARG A 196 14.962 -24.078 -1.040 1.00 31.18 O
1994 ATOM 1521 CB ARG A 196 16.852 -24.444 1.662 1.00 30.84 C
1995 ATOM 1522 N HIS A 197 16.213 -22.320 -0.472 1.00 31.30 N
1996 ATOM 1523 CA HIS A 197 15.170 -21.381 -0.865 1.00 32.02 C
1997 ATOM 1524 C HIS A 197 15.467 -20.595 -2.109 1.00 31.68 C
1998 ATOM 1525 O HIS A 197 14.626 -19.822 -2.533 1.00 33.03 O
1999 ATOM 1526 CB HIS A 197 14.874 -20.378 0.267 1.00 32.30 C
2000 ATOM 1527 CG HIS A 197 14.333 -20.999 1.516 1.00 34.55 C
2001 ATOM 1528 ND1 HIS A 197 13.022 -21.410 1.637 1.00 35.22 N
2002 ATOM 1529 CD2 HIS A 197 14.925 -21.278 2.702 1.00 36.14 C
2003 ATOM 1530 CE1 HIS A 197 12.831 -21.923 2.840 1.00 36.60 C
2004 ATOM 1531 NE2 HIS A 197 13.970 -21.860 3.505 1.00 36.96 N
2005 ATOM 1532 N SER A 198 16.639 -20.770 -2.711 1.00 31.20 N
2006 ATOM 1533 CA SER A 198 16.951 -20.003 -3.917 1.00 30.12 C
2007 ATOM 1534 C SER A 198 17.495 -20.879 -5.031 1.00 31.02 C
2008 ATOM 1535 O SER A 198 18.578 -20.606 -5.497 1.00 31.93 O
2009 ATOM 1536 CB SER A 198 18.002 -18.890 -3.621 1.00 29.93 C
2010 ATOM 1537 OG SER A 198 17.649 -18.037 -2.528 1.00 26.42 O
2011 ATOM 1538 N GLU A 199 16.734 -21.883 -5.502 1.00 30.63 N
2012 ATOM 1539 CA GLU A 199 17.214 -22.832 -6.546 1.00 30.48 C
2013 ATOM 1540 C GLU A 199 17.195 -22.336 -8.020 1.00 29.62 C
2014 ATOM 1541 O GLU A 199 17.976 -22.780 -8.886 1.00 31.63 O
2015 ATOM 1542 CB GLU A 199 16.366 -24.121 -6.487 1.00 31.88 C
2016 ATOM 1543 CG GLU A 199 16.629 -25.095 -7.643 1.00 34.43 C
2017 ATOM 1544 CD GLU A 199 15.748 -26.356 -7.634 1.00 39.72 C
2018 ATOM 1545 OE1 GLU A 199 14.844 -26.482 -6.777 1.00 42.24 O
2019 ATOM 1546 OE2 GLU A 199 15.955 -27.232 -8.507 1.00 42.99 O
2020 ATOM 1547 N PHE A 200 16.284 -21.437 -8.317 1.00 26.88 N
2021 ATOM 1548 CA PHE A 200 16.134 -20.992 -9.694 1.00 23.59 C
2022 ATOM 1549 C PHE A 200 16.568 -19.563 -9.844 1.00 22.93 C
2023 ATOM 1550 O PHE A 200 15.766 -18.696 -10.127 1.00 23.77 O
2024 ATOM 1551 CB PHE A 200 14.660 -21.137 -10.081 1.00 23.63 C
2025 ATOM 1552 CG PHE A 200 14.217 -22.567 -10.135 1.00 22.76 C
2026 ATOM 1553 CD1 PHE A 200 13.454 -23.104 -9.134 1.00 23.96 C
2027 ATOM 1554 CD2 PHE A 200 14.618 -23.384 -11.182 1.00 24.90 C
2028 ATOM 1555 CE1 PHE A 200 13.069 -24.460 -9.192 1.00 25.09 C
2029 ATOM 1556 CE2 PHE A 200 14.240 -24.716 -11.235 1.00 26.56 C
2030 ATOM 1557 CZ PHE A 200 13.465 -25.241 -10.249 1.00 25.49 C
2031 ATOM 1558 N VAL A 201 17.860 -19.337 -9.700 1.00 21.72 N
2032 ATOM 1559 CA VAL A 201 18.432 -18.003 -9.837 1.00 22.07 C
2033 ATOM 1560 C VAL A 201 19.265 -18.052 -11.097 1.00 22.48 C
2034 ATOM 1561 O VAL A 201 20.046 -18.978 -11.283 1.00 23.25 O
2035 ATOM 1562 CB VAL A 201 19.287 -17.682 -8.578 1.00 22.22 C
2036 ATOM 1563 CG1 VAL A 201 20.004 -16.346 -8.707 1.00 21.83 C
2037 ATOM 1564 CG2 VAL A 201 18.408 -17.689 -7.341 1.00 22.06 C
2038 ATOM 1565 N ALA A 202 19.106 -17.074 -11.972 1.00 20.94 N
2039 ATOM 1566 CA ALA A 202 19.748 -17.091 -13.278 1.00 21.82 C
2040 ATOM 1567 C ALA A 202 21.225 -16.709 -13.245 1.00 22.43 C
2041 ATOM 1568 O ALA A 202 21.946 -16.934 -14.216 1.00 24.86 O
2042 ATOM 1569 CB ALA A 202 18.992 -16.198 -14.251 1.00 21.73 C
2043 ATOM 1570 N TYR A 203 21.686 -16.186 -12.110 1.00 20.88 N
2044 ATOM 1571 CA TYR A 203 23.050 -15.656 -11.979 1.00 19.83 C
2045 ATOM 1572 C TYR A 203 23.854 -16.507 -11.027 1.00 18.78 C
2046 ATOM 1573 O TYR A 203 23.291 -17.098 -10.134 1.00 19.67 O
2047 ATOM 1574 CB TYR A 203 22.945 -14.230 -11.410 1.00 19.91 C
2048 ATOM 1575 CG TYR A 203 22.028 -13.380 -12.257 1.00 17.36 C
2049 ATOM 1576 CD1 TYR A 203 20.700 -13.152 -11.894 1.00 15.52 C
2050 ATOM 1577 CD2 TYR A 203 22.465 -12.864 -13.463 1.00 17.57 C
2051 ATOM 1578 CE1 TYR A 203 19.858 -12.405 -12.692 1.00 16.81 C
2052 ATOM 1579 CE2 TYR A 203 21.652 -12.163 -14.274 1.00 18.19 C
2053 ATOM 1580 CZ TYR A 203 20.319 -11.887 -13.884 1.00 15.49 C
2054 ATOM 1581 OH TYR A 203 19.496 -11.146 -14.692 1.00 18.93 O
2055 ATOM 1582 N PRO A 204 25.181 -16.554 -11.169 1.00 18.13 N
2056 ATOM 1583 CA PRO A 204 26.001 -17.326 -10.245 1.00 17.89 C
2057 ATOM 1584 C PRO A 204 25.905 -16.718 -8.864 1.00 17.11 C
2058 ATOM 1585 O PRO A 204 25.905 -15.480 -8.771 1.00 18.55 O
2059 ATOM 1586 CB PRO A 204 27.440 -17.120 -10.766 1.00 19.77 C
2060 ATOM 1587 CG PRO A 204 27.373 -16.070 -11.818 1.00 20.03 C
2061 ATOM 1588 CD PRO A 204 25.961 -15.878 -12.211 1.00 17.78 C
2062 ATOM 1589 N ILE A 205 25.792 -17.566 -7.855 1.00 17.36 N
2063 ATOM 1590 CA ILE A 205 25.810 -17.109 -6.472 1.00 16.75 C
2064 ATOM 1591 C ILE A 205 27.160 -17.562 -5.917 1.00 18.22 C
2065 ATOM 1592 O ILE A 205 27.458 -18.775 -5.829 1.00 19.73 O
2066 ATOM 1593 CB ILE A 205 24.634 -17.685 -5.663 1.00 17.09 C
2067 ATOM 1594 CG1 ILE A 205 23.309 -17.189 -6.240 1.00 18.02 C
2068 ATOM 1595 CG2 ILE A 205 24.783 -17.265 -4.190 1.00 19.57 C
2069 ATOM 1596 CD1 ILE A 205 22.083 -17.827 -5.600 1.00 17.84 C
2070 ATOM 1597 N GLN A 206 28.023 -16.594 -5.648 1.00 16.15 N
2071 ATOM 1598 CA GLN A 206 29.388 -16.853 -5.190 1.00 15.78 C
2072 ATOM 1599 C GLN A 206 29.480 -16.696 -3.696 1.00 17.50 C
2073 ATOM 1600 O GLN A 206 28.876 -15.790 -3.120 1.00 18.41 O
2074 ATOM 1601 CB GLN A 206 30.333 -15.850 -5.867 1.00 15.65 C
2075 ATOM 1602 CG GLN A 206 30.303 -15.987 -7.365 1.00 18.97 C
2076 ATOM 1603 CD GLN A 206 31.011 -14.893 -8.094 1.00 23.00 C
2077 ATOM 1604 OE1 GLN A 206 31.338 -13.866 -7.526 1.00 22.61 O
2078 ATOM 1605 NE2 GLN A 206 31.241 -15.102 -9.390 1.00 27.66 N
2079 ATOM 1606 N LEU A 207 30.228 -17.581 -3.041 1.00 16.00 N
2080 ATOM 1607 CA LEU A 207 30.426 -17.500 -1.612 1.00 15.46 C
2081 ATOM 1608 C LEU A 207 31.925 -17.327 -1.397 1.00 16.12 C
2082 ATOM 1609 O LEU A 207 32.731 -18.086 -1.938 1.00 16.52 O
2083 ATOM 1610 CB LEU A 207 29.940 -18.752 -0.873 1.00 16.44 C
2084 ATOM 1611 CG LEU A 207 30.187 -18.793 0.630 1.00 18.88 C
2085 ATOM 1612 CD1 LEU A 207 29.480 -17.631 1.321 1.00 17.94 C
2086 ATOM 1613 CD2 LEU A 207 29.738 -20.133 1.215 1.00 23.10 C
2087 ATOM 1614 N VAL A 208 32.280 -16.280 -0.662 1.00 14.72 N
2088 ATOM 1615 CA VAL A 208 33.667 -15.925 -0.407 1.00 16.89 C
2089 ATOM 1616 C VAL A 208 34.009 -16.453 0.958 1.00 18.46 C
2090 ATOM 1617 O VAL A 208 33.405 -16.106 1.967 1.00 20.57 O
2091 ATOM 1618 CB VAL A 208 33.865 -14.417 -0.420 1.00 16.76 C
2092 ATOM 1619 CG1 VAL A 208 35.337 -14.062 -0.102 1.00 18.10 C
2093 ATOM 1620 CG2 VAL A 208 33.439 -13.856 -1.742 1.00 16.87 C
2094 ATOM 1621 N VAL A 209 34.938 -17.398 0.953 1.00 18.67 N
2095 ATOM 1622 CA VAL A 209 35.324 -18.140 2.143 1.00 20.96 C
2096 ATOM 1623 C VAL A 209 36.781 -17.880 2.423 1.00 20.78 C
2097 ATOM 1624 O VAL A 209 37.614 -17.883 1.515 1.00 19.48 O
2098 ATOM 1625 CB VAL A 209 35.129 -19.662 1.934 1.00 22.02 C
2099 ATOM 1626 CG1 VAL A 209 35.595 -20.457 3.151 1.00 24.99 C
2100 ATOM 1627 CG2 VAL A 209 33.678 -20.002 1.614 1.00 25.29 C
2101 ATOM 1628 N THR A 210 37.087 -17.630 3.685 1.00 22.10 N
2102 ATOM 1629 CA THR A 210 38.453 -17.347 4.073 1.00 24.71 C
2103 ATOM 1630 C THR A 210 38.948 -18.522 4.879 1.00 26.51 C
2104 ATOM 1631 O THR A 210 38.313 -18.890 5.881 1.00 28.31 O
2105 ATOM 1632 CB THR A 210 38.465 -16.058 4.913 1.00 24.35 C
2106 ATOM 1633 OG1 THR A 210 38.021 -14.953 4.116 1.00 27.27 O
2107 ATOM 1634 CG2 THR A 210 39.896 -15.664 5.290 1.00 26.08 C
2108 ATOM 1635 N LYS A 211 40.055 -19.127 4.459 1.00 27.01 N
2109 ATOM 1636 CA LYS A 211 40.613 -20.247 5.212 1.00 28.91 C
2110 ATOM 1637 C LYS A 211 42.111 -20.182 5.416 1.00 28.24 C
2111 ATOM 1638 O LYS A 211 42.858 -19.699 4.576 1.00 25.93 O
2112 ATOM 1639 CB LYS A 211 40.305 -21.563 4.536 1.00 29.59 C
2113 ATOM 1640 CG LYS A 211 41.080 -21.771 3.281 1.00 34.09 C
2114 ATOM 1641 CD LYS A 211 40.475 -22.924 2.489 1.00 40.10 C
2115 ATOM 1642 CE LYS A 211 41.184 -23.109 1.171 1.00 41.95 C
2116 ATOM 1643 NZ LYS A 211 41.722 -21.833 0.641 1.00 42.46 N
2117 ATOM 1644 N GLU A 212 42.537 -20.773 6.526 1.00 28.21 N
2118 ATOM 1645 CA GLU A 212 43.942 -20.751 6.879 1.00 28.49 C
2119 ATOM 1646 C GLU A 212 44.720 -21.797 6.103 1.00 28.75 C
2120 ATOM 1647 O GLU A 212 44.278 -22.945 5.925 1.00 28.90 O
2121 ATOM 1648 CB GLU A 212 44.126 -20.916 8.389 1.00 28.83 C
2122 ATOM 1649 CG GLU A 212 45.576 -20.737 8.777 1.00 32.00 C
2123 ATOM 1650 CD GLU A 212 45.821 -20.798 10.269 1.00 36.29 C
2124 ATOM 1651 OE1 GLU A 212 44.870 -20.592 11.065 1.00 37.08 O
2125 ATOM 1652 OE2 GLU A 212 46.994 -21.050 10.619 1.00 38.37 O
2126 ATOM 1653 N VAL A 213 45.864 -21.398 5.575 1.00 28.37 N
2127 ATOM 1654 CA VAL A 213 46.685 -22.329 4.853 1.00 30.34 C
2128 ATOM 1655 C VAL A 213 47.507 -23.074 5.893 1.00 32.13 C
2129 ATOM 1656 O VAL A 213 48.186 -22.459 6.715 1.00 32.70 O
2130 ATOM 1657 CB VAL A 213 47.612 -21.610 3.876 1.00 29.56 C
2131 ATOM 1658 CG1 VAL A 213 48.610 -22.595 3.292 1.00 31.34 C
2132 ATOM 1659 CG2 VAL A 213 46.773 -20.946 2.765 1.00 27.94 C
2133 ATOM 1660 N GLU A 214 47.425 -24.396 5.888 1.00 34.34 N
2134 ATOM 1661 CA GLU A 214 48.167 -25.166 6.890 1.00 36.09 C
2135 ATOM 1662 C GLU A 214 49.322 -25.926 6.250 1.00 37.21 C
2136 ATOM 1663 O GLU A 214 50.269 -25.321 5.741 1.00 39.17 O
2137 ATOM 1664 CB GLU A 214 47.235 -26.118 7.659 1.00 36.52 C
2138 TER 1665 GLU A 214
2139 HETATM 1692 O HOH A2001 33.747 10.121 4.457 1.00 32.57 O
2140 HETATM 1693 O HOH A2002 33.709 14.705 5.205 1.00 49.78 O
2141 HETATM 1694 O HOH A2003 33.271 8.020 7.785 1.00 58.21 O
2142 HETATM 1695 O HOH A2004 27.559 13.039 1.851 1.00 20.69 O
2143 HETATM 1696 O HOH A2005 31.138 7.178 5.627 1.00 21.41 O
2144 HETATM 1697 O HOH A2006 28.574 13.706 9.058 1.00 46.07 O
2145 HETATM 1698 O HOH A2007 28.546 8.223 7.731 1.00 47.90 O
2146 HETATM 1699 O HOH A2008 27.013 8.881 9.642 1.00 55.69 O
2147 HETATM 1700 O HOH A2009 19.244 16.751 3.298 1.00 47.51 O
2148 HETATM 1701 O HOH A2010 23.223 17.640 -0.465 1.00 46.37 O
2149 HETATM 1702 O HOH A2011 24.682 12.764 1.192 1.00 20.03 O
2150 HETATM 1703 O HOH A2012 20.694 17.297 -0.738 1.00 45.18 O
2151 HETATM 1704 O HOH A2013 15.432 15.295 7.785 1.00 58.87 O
2152 HETATM 1705 O HOH A2014 21.025 16.212 7.526 1.00 30.86 O
2153 HETATM 1706 O HOH A2015 23.312 14.391 9.095 1.00 41.06 O
2154 HETATM 1707 O HOH A2016 9.815 12.964 14.033 1.00 44.20 O
2155 HETATM 1708 O HOH A2017 13.186 13.501 5.450 1.00 30.26 O
2156 HETATM 1709 O HOH A2018 9.626 10.848 4.388 1.00 43.10 O
2157 HETATM 1710 O HOH A2019 7.195 -5.599 18.415 1.00 29.96 O
2158 HETATM 1711 O HOH A2020 4.979 -2.964 18.647 1.00 43.44 O
2159 HETATM 1712 O HOH A2021 7.820 10.702 7.609 1.00 52.23 O
2160 HETATM 1713 O HOH A2022 9.742 7.666 10.456 1.00 32.28 O
2161 HETATM 1714 O HOH A2023 34.096 -7.584 -21.398 1.00 50.17 O
2162 HETATM 1715 O HOH A2024 5.386 9.408 7.348 1.00 29.55 O
2163 HETATM 1716 O HOH A2025 16.816 -21.086 12.638 1.00 44.99 O
2164 HETATM 1717 O HOH A2026 -0.724 3.653 8.584 1.00 40.42 O
2165 HETATM 1718 O HOH A2027 1.970 7.976 7.998 1.00 48.15 O
2166 HETATM 1719 O HOH A2028 10.724 -19.006 -0.420 1.00 44.13 O
2167 HETATM 1720 O HOH A2029 0.985 6.010 12.113 1.00 24.51 O
2168 HETATM 1721 O HOH A2030 0.022 1.730 10.264 1.00 39.49 O
2169 HETATM 1722 O HOH A2031 4.293 5.768 13.068 1.00 21.25 O
2170 HETATM 1723 O HOH A2032 -0.683 3.969 12.617 1.00 28.82 O
2171 HETATM 1724 O HOH A2033 14.080 -9.374 -17.331 1.00 50.80 O
2172 HETATM 1725 O HOH A2034 10.771 -10.592 -11.300 1.00 50.97 O
2173 HETATM 1726 O HOH A2035 11.590 -0.678 18.374 1.00 54.51 O
2174 HETATM 1727 O HOH A2036 7.359 -3.326 17.547 1.00 28.45 O
2175 HETATM 1728 O HOH A2037 15.774 2.096 -13.401 1.00 53.74 O
2176 HETATM 1729 O HOH A2038 34.291 3.925 7.869 1.00 35.99 O
2177 HETATM 1730 O HOH A2039 7.691 -7.873 16.784 1.00 29.87 O
2178 HETATM 1731 O HOH A2040 23.338 -9.568 -20.564 1.00 43.52 O
2179 HETATM 1732 O HOH A2041 13.676 -10.496 14.803 1.00 19.74 O
2180 HETATM 1733 O HOH A2042 10.247 -9.320 21.199 1.00 46.54 O
2181 HETATM 1734 O HOH A2043 29.672 -7.656 -21.175 1.00 33.76 O
2182 HETATM 1735 O HOH A2044 33.311 -4.878 -21.320 1.00 33.21 O
2183 HETATM 1736 O HOH A2045 14.148 -12.319 18.248 1.00 46.87 O
2184 HETATM 1737 O HOH A2046 5.842 -9.807 16.214 1.00 53.42 O
2185 HETATM 1738 O HOH A2047 26.047 -9.925 -20.577 1.00 44.12 O
2186 HETATM 1739 O HOH A2048 28.205 -11.828 -19.169 1.00 51.59 O
2187 HETATM 1740 O HOH A2049 7.018 -11.690 18.103 1.00 32.69 O
2188 HETATM 1741 O HOH A2050 13.171 -16.808 18.103 1.00 50.75 O
2189 HETATM 1742 O HOH A2051 7.630 -18.652 15.001 1.00 35.22 O
2190 HETATM 1743 O HOH A2052 36.591 -10.836 -1.292 1.00 25.85 O
2191 HETATM 1744 O HOH A2053 34.404 -0.608 6.743 1.00 35.57 O
2192 HETATM 1745 O HOH A2054 9.515 -19.777 6.620 1.00 44.50 O
2193 HETATM 1746 O HOH A2055 36.848 -10.426 6.341 1.00 47.63 O
2194 HETATM 1747 O HOH A2056 32.564 -3.096 10.771 1.00 35.13 O
2195 HETATM 1748 O HOH A2057 12.855 -13.652 14.741 1.00 52.07 O
2196 HETATM 1749 O HOH A2058 16.136 -11.184 17.442 1.00 28.92 O
2197 HETATM 1750 O HOH A2059 36.362 -8.361 1.620 1.00 47.82 O
2198 HETATM 1751 O HOH A2060 16.315 -17.988 2.804 1.00 22.44 O
2199 HETATM 1752 O HOH A2061 15.822 -20.072 10.246 1.00 27.61 O
2200 HETATM 1753 O HOH A2062 20.234 11.327 -9.762 1.00 40.85 O
2201 HETATM 1754 O HOH A2063 19.148 13.296 -3.775 1.00 29.51 O
2202 HETATM 1755 O HOH A2064 16.311 13.256 -3.672 1.00 36.26 O
2203 HETATM 1756 O HOH A2065 11.448 -16.597 0.466 1.00 44.29 O
2204 HETATM 1757 O HOH A2066 9.304 -13.992 -1.223 1.00 31.93 O
2205 HETATM 1758 O HOH A2067 12.407 -9.516 -1.443 1.00 23.52 O
2206 HETATM 1759 O HOH A2068 10.668 -12.597 -2.734 1.00 44.75 O
2207 HETATM 1760 O HOH A2069 12.596 -9.431 -5.073 1.00 27.46 O
2208 HETATM 1761 O HOH A2070 1.608 -8.482 14.147 1.00 48.32 O
2209 HETATM 1762 O HOH A2071 17.201 -15.025 -11.499 1.00 20.13 O
2210 HETATM 1763 O HOH A2072 13.549 -11.769 -8.192 1.00 39.83 O
2211 HETATM 1764 O HOH A2073 2.818 -18.261 3.819 1.00 31.04 O
2212 HETATM 1765 O HOH A2074 5.425 -14.277 14.059 1.00 48.07 O
2213 HETATM 1766 O HOH A2075 4.521 -19.472 2.688 1.00 51.72 O
2214 HETATM 1767 O HOH A2076 15.026 -11.956 -10.804 1.00 18.48 O
2215 HETATM 1768 O HOH A2077 16.542 -9.061 -17.872 1.00 24.53 O
2216 HETATM 1769 O HOH A2078 16.235 -13.882 -13.814 1.00 21.51 O
2217 HETATM 1770 O HOH A2079 12.907 -9.092 -12.533 1.00 32.28 O
2218 HETATM 1771 O HOH A2080 13.357 -13.438 -13.316 1.00 48.14 O
2219 HETATM 1772 O HOH A2081 6.007 -7.233 -5.401 1.00 38.88 O
2220 HETATM 1773 O HOH A2082 11.234 -4.797 -9.620 1.00 47.29 O
2221 HETATM 1774 O HOH A2083 12.365 -7.094 -14.089 1.00 39.72 O
2222 HETATM 1775 O HOH A2084 19.449 -10.326 -21.937 1.00 52.16 O
2223 HETATM 1776 O HOH A2085 16.931 -8.955 -20.507 1.00 32.52 O
2224 HETATM 1777 O HOH A2086 16.367 -1.783 -22.987 1.00 22.01 O
2225 HETATM 1778 O HOH A2087 9.857 -6.265 -22.362 1.00 44.47 O
2226 HETATM 1779 O HOH A2088 18.605 -2.743 18.020 1.00 42.52 O
2227 HETATM 1780 O HOH A2089 22.018 -0.385 16.840 1.00 52.01 O
2228 HETATM 1781 O HOH A2090 16.817 2.096 -16.069 1.00 44.15 O
2229 HETATM 1782 O HOH A2091 29.783 4.756 6.489 1.00 18.04 O
2230 HETATM 1783 O HOH A2092 32.753 1.754 6.853 1.00 30.74 O
2231 HETATM 1784 O HOH A2093 21.789 -7.514 -22.245 1.00 51.11 O
2232 HETATM 1785 O HOH A2094 17.713 -3.402 -28.791 1.00 23.17 O
2233 HETATM 1786 O HOH A2095 22.207 3.437 -26.628 1.00 34.75 O
2234 HETATM 1787 O HOH A2096 23.300 13.407 -9.476 1.00 49.06 O
2235 HETATM 1788 O HOH A2097 28.267 10.558 -11.801 1.00 47.12 O
2236 HETATM 1789 O HOH A2098 20.470 13.539 -6.157 1.00 31.00 O
2237 HETATM 1790 O HOH A2099 25.764 4.447 -22.312 1.00 50.74 O
2238 HETATM 1791 O HOH A2100 19.813 4.548 -22.413 1.00 34.72 O
2239 HETATM 1792 O HOH A2101 22.812 6.159 -22.746 1.00 43.07 O
2240 HETATM 1793 O HOH A2102 23.354 14.605 -5.862 1.00 41.52 O
2241 HETATM 1794 O HOH A2103 28.797 -4.073 -23.133 1.00 29.42 O
2242 HETATM 1795 O HOH A2104 29.444 2.561 -19.078 1.00 35.85 O
2243 HETATM 1796 O HOH A2105 25.471 1.632 -25.393 1.00 27.02 O
2244 HETATM 1797 O HOH A2106 10.464 2.869 16.169 1.00 36.03 O
2245 HETATM 1798 O HOH A2107 10.777 5.099 16.104 1.00 46.51 O
2246 HETATM 1799 O HOH A2108 24.228 7.807 12.189 1.00 37.70 O
2247 HETATM 1800 O HOH A2109 30.221 -2.262 -24.752 1.00 45.61 O
2248 HETATM 1801 O HOH A2110 34.608 -3.096 -19.352 1.00 31.03 O
2249 HETATM 1802 O HOH A2111 30.425 -4.992 -21.167 1.00 30.57 O
2250 HETATM 1803 O HOH A2112 38.033 7.670 6.586 1.00 45.05 O
2251 HETATM 1804 O HOH A2113 33.943 0.434 -13.436 1.00 30.07 O
2252 HETATM 1805 O HOH A2114 34.408 -7.884 -13.954 1.00 41.24 O
2253 HETATM 1806 O HOH A2115 34.588 -7.647 -10.005 1.00 49.62 O
2254 HETATM 1807 O HOH A2116 31.065 -4.292 -10.048 1.00 36.54 O
2255 HETATM 1808 O HOH A2117 34.993 -3.603 -12.266 1.00 61.19 O
2256 HETATM 1809 O HOH A2118 28.396 -8.597 -19.692 1.00 37.12 O
2257 HETATM 1810 O HOH A2119 35.488 -12.494 -15.453 1.00 49.36 O
2258 HETATM 1811 O HOH A2120 28.573 -12.382 -16.500 1.00 26.20 O
2259 HETATM 1812 O HOH A2121 28.107 -14.228 -14.841 1.00 34.66 O
2260 HETATM 1813 O HOH A2122 33.791 -8.680 -3.550 1.00 26.24 O
2261 HETATM 1814 O HOH A2123 33.175 -12.259 -11.103 1.00 49.68 O
2262 HETATM 1815 O HOH A2124 34.219 -9.996 -10.662 1.00 49.08 O
2263 HETATM 1816 O HOH A2125 33.931 -9.770 -1.084 1.00 18.44 O
2264 HETATM 1817 O HOH A2126 29.983 -10.073 -1.046 1.00 14.41 O
2265 HETATM 1818 O HOH A2127 34.283 -3.691 6.312 1.00 52.73 O
2266 HETATM 1819 O HOH A2128 35.538 -4.454 2.209 1.00 29.62 O
2267 HETATM 1820 O HOH A2129 36.664 -10.541 9.177 1.00 36.49 O
2268 HETATM 1821 O HOH A2130 31.256 -4.198 13.063 1.00 35.53 O
2269 HETATM 1822 O HOH A2131 27.222 -6.911 13.866 1.00 26.99 O
2270 HETATM 1823 O HOH A2132 37.101 -15.593 7.746 1.00 52.39 O
2271 HETATM 1824 O HOH A2133 30.500 -7.410 -0.778 1.00 13.69 O
2272 HETATM 1825 O HOH A2134 34.160 -7.429 0.825 1.00 33.98 O
2273 HETATM 1826 O HOH A2135 35.782 -6.720 -6.273 1.00 66.89 O
2274 HETATM 1827 O HOH A2136 29.267 -5.097 -7.639 1.00 29.60 O
2275 HETATM 1828 O HOH A2137 22.165 -3.147 -7.735 1.00 13.85 O
2276 HETATM 1829 O HOH A2138 22.769 -7.431 -3.061 1.00 13.68 O
2277 HETATM 1830 O HOH A2139 18.488 9.150 -9.990 1.00 25.35 O
2278 HETATM 1831 O HOH A2140 19.606 15.343 -1.375 1.00 52.39 O
2279 HETATM 1832 O HOH A2141 14.725 10.862 -3.931 1.00 31.08 O
2280 HETATM 1833 O HOH A2142 14.612 5.821 -10.892 1.00 55.31 O
2281 HETATM 1834 O HOH A2143 12.200 -1.654 -2.241 1.00 51.73 O
2282 HETATM 1835 O HOH A2144 10.959 2.029 0.664 1.00 25.94 O
2283 HETATM 1836 O HOH A2145 13.506 5.467 -7.080 1.00 29.28 O
2284 HETATM 1837 O HOH A2146 15.169 2.395 -8.938 1.00 31.22 O
2285 HETATM 1838 O HOH A2147 4.033 3.054 -1.673 1.00 34.89 O
2286 HETATM 1839 O HOH A2148 5.131 1.970 -4.088 1.00 56.69 O
2287 HETATM 1840 O HOH A2149 0.961 0.694 2.756 1.00 53.48 O
2288 HETATM 1841 O HOH A2150 0.208 -0.805 0.182 1.00 63.56 O
2289 HETATM 1842 O HOH A2151 4.955 -0.340 -1.556 1.00 27.21 O
2290 HETATM 1843 O HOH A2152 3.379 -1.312 -3.190 1.00 58.54 O
2291 HETATM 1844 O HOH A2153 -1.034 -1.615 1.915 1.00 51.43 O
2292 HETATM 1845 O HOH A2154 -3.224 -6.840 3.824 1.00 25.45 O
2293 HETATM 1846 O HOH A2155 1.254 -6.272 12.544 1.00 31.09 O
2294 HETATM 1847 O HOH A2156 -5.168 -5.239 4.613 1.00 37.32 O
2295 HETATM 1848 O HOH A2157 -0.546 -12.464 14.572 1.00 50.75 O
2296 HETATM 1849 O HOH A2158 -7.125 -13.907 11.515 1.00 27.06 O
2297 HETATM 1850 O HOH A2159 1.579 -13.312 11.846 1.00 24.93 O
2298 HETATM 1851 O HOH A2160 0.857 -17.223 5.449 1.00 21.33 O
2299 HETATM 1852 O HOH A2161 4.676 -15.628 11.148 1.00 25.06 O
2300 HETATM 1853 O HOH A2162 7.007 -14.064 0.040 1.00 31.41 O
2301 HETATM 1854 O HOH A2163 6.080 -17.938 1.677 1.00 39.12 O
2302 HETATM 1855 O HOH A2164 10.457 -15.572 2.671 1.00 33.56 O
2303 HETATM 1856 O HOH A2165 10.159 -10.251 -4.187 1.00 48.00 O
2304 HETATM 1857 O HOH A2166 9.429 -7.796 -4.315 1.00 37.01 O
2305 HETATM 1858 O HOH A2167 4.814 -2.958 -2.288 1.00 46.44 O
2306 HETATM 1859 O HOH A2168 11.047 -2.826 -0.349 1.00 34.82 O
2307 HETATM 1860 O HOH A2169 8.941 -3.737 -4.283 1.00 40.05 O
2308 HETATM 1861 O HOH A2170 10.451 -7.658 -1.890 1.00 19.13 O
2309 HETATM 1862 O HOH A2171 12.188 -5.430 -0.981 1.00 15.91 O
2310 HETATM 1863 O HOH A2172 19.161 -1.397 15.886 1.00 23.93 O
2311 HETATM 1864 O HOH A2173 26.999 -2.330 14.962 1.00 39.70 O
2312 HETATM 1865 O HOH A2174 23.099 3.514 12.298 1.00 37.26 O
2313 HETATM 1866 O HOH A2175 31.131 0.957 8.906 1.00 40.05 O
2314 HETATM 1867 O HOH A2176 30.373 2.342 5.102 1.00 15.11 O
2315 HETATM 1868 O HOH A2177 30.596 3.985 9.020 1.00 38.44 O
2316 HETATM 1869 O HOH A2178 31.666 4.877 -13.133 1.00 41.68 O
2317 HETATM 1870 O HOH A2179 30.494 6.983 -12.624 1.00 40.29 O
2318 HETATM 1871 O HOH A2180 20.451 3.128 -11.055 1.00 22.03 O
2319 HETATM 1872 O HOH A2181 29.108 5.672 -15.226 1.00 34.41 O
2320 HETATM 1873 O HOH A2182 28.703 2.516 -12.265 1.00 17.07 O
2321 HETATM 1874 O HOH A2183 23.535 1.628 -13.576 1.00 17.83 O
2322 HETATM 1875 O HOH A2184 21.273 5.907 -17.738 1.00 50.87 O
2323 HETATM 1876 O HOH A2185 21.984 3.072 -15.303 1.00 26.93 O
2324 HETATM 1877 O HOH A2186 22.711 11.305 -10.623 1.00 34.98 O
2325 HETATM 1878 O HOH A2187 20.971 11.101 -7.254 1.00 19.37 O
2326 HETATM 1879 O HOH A2188 26.666 12.423 -10.187 1.00 37.43 O
2327 HETATM 1880 O HOH A2189 24.958 5.597 -7.357 1.00 12.07 O
2328 HETATM 1881 O HOH A2190 31.900 7.765 -6.287 1.00 25.46 O
2329 HETATM 1882 O HOH A2191 32.348 3.335 -7.443 1.00 21.78 O
2330 HETATM 1883 O HOH A2192 25.775 12.889 -6.393 1.00 29.40 O
2331 HETATM 1884 O HOH A2193 25.495 14.528 -2.207 1.00 31.63 O
2332 HETATM 1885 O HOH A2194 27.071 5.432 6.808 1.00 21.07 O
2333 HETATM 1886 O HOH A2195 28.234 4.586 10.557 1.00 38.13 O
2334 HETATM 1887 O HOH A2196 21.641 4.911 11.307 1.00 40.19 O
2335 HETATM 1888 O HOH A2197 16.950 3.681 10.690 1.00 18.82 O
2336 HETATM 1889 O HOH A2198 11.383 1.203 14.010 1.00 27.48 O
2337 HETATM 1890 O HOH A2199 13.510 6.173 15.897 1.00 33.83 O
2338 HETATM 1891 O HOH A2200 17.171 5.986 13.164 1.00 26.84 O
2339 HETATM 1892 O HOH A2201 24.847 6.843 9.729 1.00 27.95 O
2340 HETATM 1893 O HOH A2202 25.207 7.006 5.386 1.00 13.78 O
2341 HETATM 1894 O HOH A2203 32.208 8.176 3.262 1.00 17.45 O
2342 HETATM 1895 O HOH A2204 31.820 8.099 -3.943 1.00 32.49 O
2343 HETATM 1896 O HOH A2205 38.053 8.694 3.624 1.00 24.83 O
2344 HETATM 1897 O HOH A2206 36.650 10.979 3.803 1.00 41.97 O
2345 HETATM 1898 O HOH A2207 32.772 -4.295 1.060 1.00 20.64 O
2346 HETATM 1899 O HOH A2208 32.714 -7.054 -2.270 1.00 24.05 O
2347 HETATM 1900 O HOH A2209 36.073 -7.326 -3.725 1.00 25.93 O
2348 HETATM 1901 O HOH A2210 34.655 -1.987 1.654 1.00 17.99 O
2349 HETATM 1902 O HOH A2211 38.523 -0.287 -4.324 1.00 20.07 O
2350 HETATM 1903 O HOH A2212 35.289 -4.075 -5.505 1.00 40.56 O
2351 HETATM 1904 O HOH A2213 33.693 5.876 -6.818 1.00 31.65 O
2352 HETATM 1905 O HOH A2214 32.365 2.462 -11.884 1.00 26.27 O
2353 HETATM 1906 O HOH A2215 34.595 -3.437 -8.655 1.00 46.95 O
2354 HETATM 1907 O HOH A2216 25.837 -5.742 15.288 1.00 48.15 O
2355 HETATM 1908 O HOH A2217 22.773 -8.138 19.038 1.00 35.22 O
2356 HETATM 1909 O HOH A2218 25.248 -16.127 17.483 1.00 27.88 O
2357 HETATM 1910 O HOH A2219 26.127 -7.988 17.249 1.00 36.17 O
2358 HETATM 1911 O HOH A2220 27.294 -13.974 20.654 1.00 48.98 O
2359 HETATM 1912 O HOH A2221 18.464 -11.345 18.841 1.00 40.89 O
2360 HETATM 1913 O HOH A2222 20.977 -11.020 19.860 1.00 49.66 O
2361 HETATM 1914 O HOH A2223 19.611 -18.444 17.688 1.00 58.45 O
2362 HETATM 1915 O HOH A2224 23.269 -17.967 15.359 1.00 24.84 O
2363 HETATM 1916 O HOH A2225 18.323 -17.877 13.008 1.00 26.68 O
2364 HETATM 1917 O HOH A2226 17.437 -17.544 16.599 1.00 51.77 O
2365 HETATM 1918 O HOH A2227 29.751 -17.749 13.287 1.00 34.64 O
2366 HETATM 1919 O HOH A2228 19.338 -19.666 15.402 1.00 42.64 O
2367 HETATM 1920 O HOH A2229 19.113 -22.387 13.068 1.00 39.64 O
2368 HETATM 1921 O HOH A2230 32.993 -16.812 8.503 1.00 44.59 O
2369 HETATM 1922 O HOH A2231 32.860 -18.513 6.403 1.00 46.34 O
2370 HETATM 1923 O HOH A2232 36.492 -24.040 3.357 1.00 52.41 O
2371 HETATM 1924 O HOH A2233 34.602 -21.972 6.289 1.00 39.49 O
2372 HETATM 1925 O HOH A2234 32.888 -20.956 7.919 1.00 43.01 O
2373 HETATM 1926 O HOH A2235 35.270 -24.422 1.034 1.00 49.99 O
2374 HETATM 1927 O HOH A2236 31.033 -23.956 8.011 1.00 31.63 O
2375 HETATM 1928 O HOH A2237 25.695 -27.043 3.447 1.00 40.30 O
2376 HETATM 1929 O HOH A2238 19.988 -27.212 2.120 1.00 39.11 O
2377 HETATM 1930 O HOH A2239 18.327 -26.462 -5.000 1.00 63.36 O
2378 HETATM 1931 O HOH A2240 13.601 -21.438 5.691 1.00 74.16 O
2379 HETATM 1932 O HOH A2241 16.123 -16.122 -3.584 1.00 22.16 O
2380 HETATM 1933 O HOH A2242 18.009 -18.650 0.335 1.00 23.06 O
2381 HETATM 1934 O HOH A2243 19.825 -21.212 -7.504 1.00 45.98 O
2382 HETATM 1935 O HOH A2244 14.921 -16.420 -11.269 1.00 25.34 O
2383 HETATM 1936 O HOH A2245 15.055 -20.293 -6.721 1.00 52.72 O
2384 HETATM 1937 O HOH A2246 21.697 -19.022 -16.150 1.00 45.59 O
2385 HETATM 1938 O HOH A2247 24.798 -18.394 -14.646 1.00 43.45 O
2386 HETATM 1939 O HOH A2248 22.656 -19.813 -9.663 1.00 30.78 O
2387 HETATM 1940 O HOH A2249 31.014 -17.921 -10.745 1.00 42.17 O
2388 HETATM 1941 O HOH A2250 31.584 -13.848 -12.033 1.00 55.19 O
2389 HETATM 1942 O HOH A2251 34.869 -14.722 3.970 1.00 25.72 O
2390 HETATM 1943 O HOH A2252 35.003 -17.198 5.681 1.00 38.13 O
2391 HETATM 1944 O HOH A2253 37.393 -12.101 4.512 1.00 52.80 O
2392 HETATM 1945 O HOH A2254 39.159 -20.600 1.562 1.00 41.31 O
2393 HETATM 1946 O HOH A2255 48.702 -20.387 8.539 1.00 30.44 O
2394 HETATM 1947 O HOH A2256 45.978 -25.641 3.122 1.00 39.05 O
2395 HETATM 1948 O HOH A2257 47.493 -26.980 4.869 1.00 60.05 O
2396 HETATM 1949 O HOH A2258 20.380 -7.911 -1.824 1.00 15.88 O
2397 CONECT 1666 1667 1673
2398 CONECT 1667 1666 1668 1670
2399 CONECT 1668 1667 1686
2400 CONECT 1669 1670 1689
2401 CONECT 1670 1667 1669 1671
2402 CONECT 1671 1670 1672
2403 CONECT 1672 1671 1673
2404 CONECT 1673 1666 1672 1674
2405 CONECT 1674 1673 1675 1678
2406 CONECT 1675 1674 1676 1677
2407 CONECT 1676 1675
2408 CONECT 1677 1675 1679
2409 CONECT 1678 1674 1679 1680
2410 CONECT 1679 1677 1678
2411 CONECT 1680 1678 1681 1690
2412 CONECT 1681 1680 1682
2413 CONECT 1682 1681 1683 1685
2414 CONECT 1683 1682 1684
2415 CONECT 1684 1683
2416 CONECT 1685 1682 1687 1688
2417 CONECT 1686 1668 1689
2418 CONECT 1687 1685
2419 CONECT 1688 1685 1690
2420 CONECT 1689 1669 1686
2421 CONECT 1690 1680 1688 1691
2422 CONECT 1691 1690
2423 MASTER 390 0 1 10 8 0 4 6 1948 1 26 17
2424 END