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comparison test-data/1L83.pdb @ 3:4cc9d85c3bae draft default tip

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"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/fpocket/ commit 06eccf2513b3394e79606f320e019be4793386b9"
author bgruening
date Fri, 10 Sep 2021 08:20:08 +0000
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2:4fb73be7f4cb 3:4cc9d85c3bae
1 HEADER HYDROLASE(O-GLYCOSYL) 21-JAN-92 1L83
2 TITLE A CAVITY-CONTAINING MUTANT OF T4 LYSOZYME IS STABILIZED BY BURIED
3 TITLE 2 BENZENE
4 COMPND MOL_ID: 1;
5 COMPND 2 MOLECULE: T4 LYSOZYME;
6 COMPND 3 CHAIN: A;
7 COMPND 4 EC: 3.2.1.17;
8 COMPND 5 ENGINEERED: YES
9 SOURCE MOL_ID: 1;
10 SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4;
11 SOURCE 3 ORGANISM_TAXID: 10665;
12 SOURCE 4 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
13 SOURCE 5 EXPRESSION_SYSTEM_PLASMID: M13
14 KEYWDS HYDROLASE(O-GLYCOSYL)
15 EXPDTA X-RAY DIFFRACTION
16 AUTHOR A.E.ERIKSSON,B.W.MATTHEWS
17 REVDAT 3 29-NOV-17 1L83 1 HELIX
18 REVDAT 2 24-FEB-09 1L83 1 VERSN
19 REVDAT 1 31-OCT-93 1L83 0
20 JRNL AUTH A.E.ERIKSSON,W.A.BAASE,J.A.WOZNIAK,B.W.MATTHEWS
21 JRNL TITL A CAVITY-CONTAINING MUTANT OF T4 LYSOZYME IS STABILIZED BY
22 JRNL TITL 2 BURIED BENZENE.
23 JRNL REF NATURE V. 355 371 1992
24 JRNL REFN ISSN 0028-0836
25 JRNL PMID 1731252
26 JRNL DOI 10.1038/355371A0
27 REMARK 2
28 REMARK 2 RESOLUTION. 1.70 ANGSTROMS.
29 REMARK 3
30 REMARK 3 REFINEMENT.
31 REMARK 3 PROGRAM : TNT
32 REMARK 3 AUTHORS : TRONRUD,TEN EYCK,MATTHEWS
33 REMARK 3
34 REMARK 3 DATA USED IN REFINEMENT.
35 REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.70
36 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : NULL
37 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL
38 REMARK 3 COMPLETENESS FOR RANGE (%) : NULL
39 REMARK 3 NUMBER OF REFLECTIONS : NULL
40 REMARK 3
41 REMARK 3 USING DATA ABOVE SIGMA CUTOFF.
42 REMARK 3 CROSS-VALIDATION METHOD : NULL
43 REMARK 3 FREE R VALUE TEST SET SELECTION : NULL
44 REMARK 3 R VALUE (WORKING + TEST SET) : 0.152
45 REMARK 3 R VALUE (WORKING SET) : NULL
46 REMARK 3 FREE R VALUE : NULL
47 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL
48 REMARK 3 FREE R VALUE TEST SET COUNT : NULL
49 REMARK 3
50 REMARK 3 USING ALL DATA, NO SIGMA CUTOFF.
51 REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : NULL
52 REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL
53 REMARK 3 FREE R VALUE (NO CUTOFF) : NULL
54 REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL
55 REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL
56 REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : NULL
57 REMARK 3
58 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
59 REMARK 3 PROTEIN ATOMS : 1289
60 REMARK 3 NUCLEIC ACID ATOMS : 0
61 REMARK 3 HETEROGEN ATOMS : 16
62 REMARK 3 SOLVENT ATOMS : 142
63 REMARK 3
64 REMARK 3 WILSON B VALUE (FROM FCALC, A**2) : NULL
65 REMARK 3
66 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. RMS WEIGHT COUNT
67 REMARK 3 BOND LENGTHS (A) : 0.014 ; NULL ; NULL
68 REMARK 3 BOND ANGLES (DEGREES) : 1.900 ; NULL ; NULL
69 REMARK 3 TORSION ANGLES (DEGREES) : NULL ; NULL ; NULL
70 REMARK 3 PSEUDOROTATION ANGLES (DEGREES) : NULL ; NULL ; NULL
71 REMARK 3 TRIGONAL CARBON PLANES (A) : NULL ; NULL ; NULL
72 REMARK 3 GENERAL PLANES (A) : NULL ; NULL ; NULL
73 REMARK 3 ISOTROPIC THERMAL FACTORS (A**2) : NULL ; NULL ; NULL
74 REMARK 3 NON-BONDED CONTACTS (A) : NULL ; NULL ; NULL
75 REMARK 3
76 REMARK 3 INCORRECT CHIRAL-CENTERS (COUNT) : NULL
77 REMARK 3
78 REMARK 3 BULK SOLVENT MODELING.
79 REMARK 3 METHOD USED : NULL
80 REMARK 3 KSOL : NULL
81 REMARK 3 BSOL : NULL
82 REMARK 3
83 REMARK 3 RESTRAINT LIBRARIES.
84 REMARK 3 STEREOCHEMISTRY : NULL
85 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS : NULL
86 REMARK 3
87 REMARK 3 OTHER REFINEMENT REMARKS:
88 REMARK 3 RESIDUES 162 - 164 IN WILD-TYPE AND ALL MUTANT LYSOZYMES
89 REMARK 3 ARE EXTREMELY MOBILE. THUS THE COORDINATES FOR THESE
90 REMARK 3 RESIDUES ARE VERY UNRELIABLE. THIS ENTRY DOES NOT INCLUDE
91 REMARK 3 RESIDUES 163 AND 164.
92 REMARK 4
93 REMARK 4 1L83 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
94 REMARK 100
95 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
96 REMARK 100 THE DEPOSITION ID IS D_1000174609.
97 REMARK 200
98 REMARK 200 EXPERIMENTAL DETAILS
99 REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
100 REMARK 200 DATE OF DATA COLLECTION : NULL
101 REMARK 200 TEMPERATURE (KELVIN) : NULL
102 REMARK 200 PH : NULL
103 REMARK 200 NUMBER OF CRYSTALS USED : NULL
104 REMARK 200
105 REMARK 200 SYNCHROTRON (Y/N) : NULL
106 REMARK 200 RADIATION SOURCE : NULL
107 REMARK 200 BEAMLINE : NULL
108 REMARK 200 X-RAY GENERATOR MODEL : NULL
109 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL
110 REMARK 200 WAVELENGTH OR RANGE (A) : NULL
111 REMARK 200 MONOCHROMATOR : NULL
112 REMARK 200 OPTICS : NULL
113 REMARK 200
114 REMARK 200 DETECTOR TYPE : NULL
115 REMARK 200 DETECTOR MANUFACTURER : NULL
116 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL
117 REMARK 200 DATA SCALING SOFTWARE : NULL
118 REMARK 200
119 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : NULL
120 REMARK 200 RESOLUTION RANGE HIGH (A) : NULL
121 REMARK 200 RESOLUTION RANGE LOW (A) : NULL
122 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
123 REMARK 200
124 REMARK 200 OVERALL.
125 REMARK 200 COMPLETENESS FOR RANGE (%) : NULL
126 REMARK 200 DATA REDUNDANCY : NULL
127 REMARK 200 R MERGE (I) : NULL
128 REMARK 200 R SYM (I) : NULL
129 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL
130 REMARK 200
131 REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
132 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL
133 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL
134 REMARK 200 COMPLETENESS FOR SHELL (%) : NULL
135 REMARK 200 DATA REDUNDANCY IN SHELL : NULL
136 REMARK 200 R MERGE FOR SHELL (I) : NULL
137 REMARK 200 R SYM FOR SHELL (I) : NULL
138 REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL
139 REMARK 200
140 REMARK 200 DIFFRACTION PROTOCOL: NULL
141 REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL
142 REMARK 200 SOFTWARE USED: NULL
143 REMARK 200 STARTING MODEL: NULL
144 REMARK 200
145 REMARK 200 REMARK: NULL
146 REMARK 280
147 REMARK 280 CRYSTAL
148 REMARK 280 SOLVENT CONTENT, VS (%): 55.92
149 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.79
150 REMARK 280
151 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL
152 REMARK 290
153 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
154 REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 32 2 1
155 REMARK 290
156 REMARK 290 SYMOP SYMMETRY
157 REMARK 290 NNNMMM OPERATOR
158 REMARK 290 1555 X,Y,Z
159 REMARK 290 2555 -Y,X-Y,Z+2/3
160 REMARK 290 3555 -X+Y,-X,Z+1/3
161 REMARK 290 4555 Y,X,-Z
162 REMARK 290 5555 X-Y,-Y,-Z+1/3
163 REMARK 290 6555 -X,-X+Y,-Z+2/3
164 REMARK 290
165 REMARK 290 WHERE NNN -> OPERATOR NUMBER
166 REMARK 290 MMM -> TRANSLATION VECTOR
167 REMARK 290
168 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
169 REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
170 REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
171 REMARK 290 RELATED MOLECULES.
172 REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
173 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
174 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
175 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000
176 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000
177 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 64.60000
178 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000
179 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000
180 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 32.30000
181 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000
182 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000
183 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000
184 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000
185 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000
186 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 32.30000
187 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000
188 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000
189 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 64.60000
190 REMARK 290
191 REMARK 290 REMARK: NULL
192 REMARK 300
193 REMARK 300 BIOMOLECULE: 1
194 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
195 REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
196 REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
197 REMARK 300 BURIED SURFACE AREA.
198 REMARK 350
199 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
200 REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
201 REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
202 REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
203 REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
204 REMARK 350
205 REMARK 350 BIOMOLECULE: 1
206 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
207 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
208 REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
209 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
210 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
211 REMARK 465
212 REMARK 465 MISSING RESIDUES
213 REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
214 REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
215 REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
216 REMARK 465
217 REMARK 465 M RES C SSSEQI
218 REMARK 465 ASN A 163
219 REMARK 465 LEU A 164
220 REMARK 500
221 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
222 REMARK 500 SUBTOPIC: CLOSE CONTACTS
223 REMARK 500
224 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC
225 REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15
226 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A
227 REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375
228 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE
229 REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS.
230 REMARK 500
231 REMARK 500 DISTANCE CUTOFF:
232 REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS
233 REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS
234 REMARK 500
235 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE
236 REMARK 500 O1 BME A 901 O1 BME A 901 5555 2.06
237 REMARK 500
238 REMARK 500 REMARK: NULL
239 REMARK 500
240 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
241 REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
242 REMARK 500
243 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
244 REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
245 REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
246 REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
247 REMARK 500
248 REMARK 500 STANDARD TABLE:
249 REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
250 REMARK 500
251 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
252 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
253 REMARK 500
254 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
255 REMARK 500 ARG A 8 NE - CZ - NH1 ANGL. DEV. = 3.1 DEGREES
256 REMARK 500 ASP A 10 CB - CG - OD2 ANGL. DEV. = -5.7 DEGREES
257 REMARK 500 ARG A 14 NE - CZ - NH1 ANGL. DEV. = 3.0 DEGREES
258 REMARK 500 ASP A 20 CB - CG - OD2 ANGL. DEV. = 5.5 DEGREES
259 REMARK 500 ASP A 47 CB - CG - OD1 ANGL. DEV. = 6.8 DEGREES
260 REMARK 500 ASP A 47 CB - CG - OD2 ANGL. DEV. = -8.2 DEGREES
261 REMARK 500 ASP A 70 CB - CG - OD1 ANGL. DEV. = 6.2 DEGREES
262 REMARK 500 ASP A 70 CB - CG - OD2 ANGL. DEV. = -6.0 DEGREES
263 REMARK 500 ASP A 72 CB - CG - OD1 ANGL. DEV. = -5.6 DEGREES
264 REMARK 500 ASP A 72 CB - CG - OD2 ANGL. DEV. = 5.4 DEGREES
265 REMARK 500 ASP A 92 CB - CG - OD1 ANGL. DEV. = -6.6 DEGREES
266 REMARK 500 ASP A 92 CB - CG - OD2 ANGL. DEV. = 5.7 DEGREES
267 REMARK 500 ARG A 137 NE - CZ - NH1 ANGL. DEV. = 3.1 DEGREES
268 REMARK 500
269 REMARK 500 REMARK: NULL
270 REMARK 500
271 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
272 REMARK 500 SUBTOPIC: TORSION ANGLES
273 REMARK 500
274 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
275 REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
276 REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
277 REMARK 500
278 REMARK 500 STANDARD TABLE:
279 REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
280 REMARK 500
281 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
282 REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
283 REMARK 500
284 REMARK 500 M RES CSSEQI PSI PHI
285 REMARK 500 ILE A 29 69.37 -100.38
286 REMARK 500 PHE A 114 43.04 -84.23
287 REMARK 500
288 REMARK 500 REMARK: NULL
289 REMARK 700
290 REMARK 700 SHEET
291 REMARK 700 THERE ARE SEVERAL SUBTLE ASPECTS OF THE SECONDARY STRUCTURE
292 REMARK 700 OF THIS MOLECULE WHICH CANNOT CONVENIENTLY BE REPRESENTED
293 REMARK 700 IN HELIX AND SHEET RECORDS BELOW. THESE ASPECTS INFLUENCE
294 REMARK 700 THE REPRESENTATION OF HELIX 6 AND STRAND 3 OF SHEET *S1*.
295 REMARK 700 THE PAPER J.MOL.BIOL., V. 118, P. 81, 1978 SHOULD BE
296 REMARK 700 CONSULTED FOR THESE SUBTLETIES.
297 REMARK 800
298 REMARK 800 SITE
299 REMARK 800 SITE_IDENTIFIER: AC1
300 REMARK 800 EVIDENCE_CODE: SOFTWARE
301 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A 173
302 REMARK 800
303 REMARK 800 SITE_IDENTIFIER: AC2
304 REMARK 800 EVIDENCE_CODE: SOFTWARE
305 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CL A 178
306 REMARK 800
307 REMARK 800 SITE_IDENTIFIER: AC3
308 REMARK 800 EVIDENCE_CODE: SOFTWARE
309 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BME A 901
310 REMARK 800
311 REMARK 800 SITE_IDENTIFIER: AC4
312 REMARK 800 EVIDENCE_CODE: SOFTWARE
313 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BME A 902
314 REMARK 800
315 REMARK 800 SITE_IDENTIFIER: AC5
316 REMARK 800 EVIDENCE_CODE: SOFTWARE
317 REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BNZ A 400
318 DBREF 1L83 A 1 164 UNP P00720 LYCV_BPT4 1 164
319 SEQADV 1L83 THR A 54 UNP P00720 CYS 54 CONFLICT
320 SEQADV 1L83 ALA A 97 UNP P00720 CYS 97 CONFLICT
321 SEQADV 1L83 ALA A 99 UNP P00720 LEU 99 CONFLICT
322 SEQRES 1 A 164 MET ASN ILE PHE GLU MET LEU ARG ILE ASP GLU GLY LEU
323 SEQRES 2 A 164 ARG LEU LYS ILE TYR LYS ASP THR GLU GLY TYR TYR THR
324 SEQRES 3 A 164 ILE GLY ILE GLY HIS LEU LEU THR LYS SER PRO SER LEU
325 SEQRES 4 A 164 ASN ALA ALA LYS SER GLU LEU ASP LYS ALA ILE GLY ARG
326 SEQRES 5 A 164 ASN THR ASN GLY VAL ILE THR LYS ASP GLU ALA GLU LYS
327 SEQRES 6 A 164 LEU PHE ASN GLN ASP VAL ASP ALA ALA VAL ARG GLY ILE
328 SEQRES 7 A 164 LEU ARG ASN ALA LYS LEU LYS PRO VAL TYR ASP SER LEU
329 SEQRES 8 A 164 ASP ALA VAL ARG ARG ALA ALA ALA ILE ASN MET VAL PHE
330 SEQRES 9 A 164 GLN MET GLY GLU THR GLY VAL ALA GLY PHE THR ASN SER
331 SEQRES 10 A 164 LEU ARG MET LEU GLN GLN LYS ARG TRP ASP GLU ALA ALA
332 SEQRES 11 A 164 VAL ASN LEU ALA LYS SER ARG TRP TYR ASN GLN THR PRO
333 SEQRES 12 A 164 ASN ARG ALA LYS ARG VAL ILE THR THR PHE ARG THR GLY
334 SEQRES 13 A 164 THR TRP ASP ALA TYR LYS ASN LEU
335 HET CL A 173 1
336 HET CL A 178 1
337 HET BME A 901 4
338 HET BME A 902 4
339 HET BNZ A 400 6
340 HETNAM CL CHLORIDE ION
341 HETNAM BME BETA-MERCAPTOETHANOL
342 HETNAM BNZ BENZENE
343 FORMUL 2 CL 2(CL 1-)
344 FORMUL 4 BME 2(C2 H6 O S)
345 FORMUL 6 BNZ C6 H6
346 HELIX 1 H1 ILE A 3 GLU A 11 1 9
347 HELIX 2 H2 LEU A 39 ILE A 50 1 12
348 HELIX 3 H3 LYS A 60 ARG A 80 1 21
349 HELIX 4 H4 ALA A 82 SER A 90 1 9
350 HELIX 5 H5 ALA A 93 MET A 106 1 14
351 HELIX 6 H6 GLU A 108 GLY A 113 1 6
352 HELIX 7 H7 THR A 115 GLN A 123 1 9
353 HELIX 8 H8 TRP A 126 ALA A 134 1 9
354 HELIX 9 H9 ARG A 137 GLN A 141 1 5
355 HELIX 10 H10 PRO A 143 THR A 155 1 13
356 SHEET 1 S1 4 GLY A 56 ILE A 58 0
357 SHEET 2 S1 4 ARG A 14 ASP A 20 -1 O LEU A 15 N ILE A 58
358 SHEET 3 S1 4 TYR A 24 ILE A 27 -1 O TYR A 24 N ASP A 20
359 SHEET 4 S1 4 HIS A 31 LEU A 33 -1 N HIS A 31 O ILE A 27
360 LINK S2 BME A 901 S2 BME A 902 1555 1555 2.06
361 SITE 1 AC1 6 LYS A 124 THR A 142 ASN A 144 ARG A 145
362 SITE 1 AC3 2 ASP A 72 BME A 902
363 SITE 1 AC5 5 LEU A 84 VAL A 87 ALA A 99 VAL A 111
364 SITE 2 AC5 5 LEU A 118
365 CRYST1 60.900 60.900 96.900 90.00 90.00 120.00 P 32 2 1 6
366 ORIGX1 1.000000 0.000000 0.000000 0.00000
367 ORIGX2 0.000000 1.000000 0.000000 0.00000
368 ORIGX3 0.000000 0.000000 1.000000 0.00000
369 SCALE1 0.016420 0.009480 0.000000 0.00000
370 SCALE2 0.000000 0.018961 0.000000 0.00000
371 SCALE3 0.000000 0.000000 0.010320 0.00000
372 ATOM 1 N MET A 1 44.033 -3.278 9.175 1.00 26.05 N
373 ATOM 2 CA MET A 1 43.538 -1.920 9.169 1.00 22.30 C
374 ATOM 3 C MET A 1 42.107 -1.960 9.644 1.00 23.28 C
375 ATOM 4 O MET A 1 41.428 -2.961 9.437 1.00 24.03 O
376 ATOM 5 CB MET A 1 43.681 -1.347 7.748 1.00 17.20 C
377 ATOM 6 CG MET A 1 42.992 -0.041 7.560 1.00 36.83 C
378 ATOM 7 SD MET A 1 44.054 1.325 8.014 1.00 38.78 S
379 ATOM 8 CE MET A 1 45.547 0.862 7.131 1.00 38.29 C
380 ATOM 9 N ASN A 2 41.675 -0.920 10.337 1.00 19.45 N
381 ATOM 10 CA ASN A 2 40.322 -0.843 10.858 1.00 11.71 C
382 ATOM 11 C ASN A 2 39.927 0.639 10.887 1.00 16.21 C
383 ATOM 12 O ASN A 2 40.814 1.466 10.651 1.00 14.56 O
384 ATOM 13 CB ASN A 2 40.218 -1.520 12.262 1.00 12.56 C
385 ATOM 14 CG ASN A 2 41.172 -0.925 13.276 1.00 20.46 C
386 ATOM 15 OD1 ASN A 2 41.087 0.279 13.565 1.00 18.36 O
387 ATOM 16 ND2 ASN A 2 42.093 -1.737 13.785 1.00 16.84 N
388 ATOM 17 N ILE A 3 38.646 0.957 11.221 1.00 13.15 N
389 ATOM 18 CA ILE A 3 38.130 2.334 11.279 1.00 18.81 C
390 ATOM 19 C ILE A 3 39.008 3.332 12.112 1.00 19.56 C
391 ATOM 20 O ILE A 3 39.257 4.495 11.744 1.00 15.88 O
392 ATOM 21 CB ILE A 3 36.622 2.346 11.600 1.00 20.83 C
393 ATOM 22 CG1 ILE A 3 36.056 3.775 11.532 1.00 13.36 C
394 ATOM 23 CG2 ILE A 3 36.359 1.673 12.957 1.00 8.64 C
395 ATOM 24 CD1 ILE A 3 36.296 4.495 10.184 1.00 7.04 C
396 ATOM 25 N PHE A 4 39.523 2.842 13.250 1.00 12.76 N
397 ATOM 26 CA PHE A 4 40.367 3.618 14.148 1.00 8.29 C
398 ATOM 27 C PHE A 4 41.692 4.017 13.543 1.00 21.97 C
399 ATOM 28 O PHE A 4 42.072 5.186 13.578 1.00 13.97 O
400 ATOM 29 CB PHE A 4 40.567 2.924 15.486 1.00 13.10 C
401 ATOM 30 CG PHE A 4 39.295 2.878 16.291 1.00 17.55 C
402 ATOM 31 CD1 PHE A 4 38.936 3.937 17.123 1.00 18.17 C
403 ATOM 32 CD2 PHE A 4 38.488 1.739 16.283 1.00 16.43 C
404 ATOM 33 CE1 PHE A 4 37.778 3.895 17.904 1.00 25.19 C
405 ATOM 34 CE2 PHE A 4 37.322 1.684 17.047 1.00 19.84 C
406 ATOM 35 CZ PHE A 4 36.975 2.757 17.870 1.00 20.91 C
407 ATOM 36 N GLU A 5 42.394 3.049 12.989 1.00 13.96 N
408 ATOM 37 CA GLU A 5 43.640 3.322 12.336 1.00 14.95 C
409 ATOM 38 C GLU A 5 43.402 4.180 11.111 1.00 19.25 C
410 ATOM 39 O GLU A 5 44.211 5.005 10.786 1.00 17.03 O
411 ATOM 40 CB GLU A 5 44.341 2.036 11.886 1.00 12.37 C
412 ATOM 41 CG GLU A 5 44.649 1.082 13.052 1.00 21.73 C
413 ATOM 42 CD GLU A 5 45.212 -0.251 12.624 1.00 40.63 C
414 ATOM 43 OE1 GLU A 5 45.445 -0.560 11.464 1.00 46.12 O
415 ATOM 44 OE2 GLU A 5 45.443 -1.043 13.646 1.00 87.76 O
416 ATOM 45 N MET A 6 42.290 3.956 10.416 1.00 16.52 N
417 ATOM 46 CA MET A 6 41.960 4.735 9.235 1.00 13.40 C
418 ATOM 47 C MET A 6 41.786 6.230 9.559 1.00 23.32 C
419 ATOM 48 O MET A 6 42.364 7.115 8.896 1.00 14.81 O
420 ATOM 49 CB MET A 6 40.638 4.204 8.644 1.00 14.48 C
421 ATOM 50 CG MET A 6 40.306 4.807 7.282 1.00 9.35 C
422 ATOM 51 SD MET A 6 38.530 4.556 6.883 1.00 13.92 S
423 ATOM 52 CE MET A 6 38.416 4.595 5.066 1.00 15.20 C
424 ATOM 53 N LEU A 7 40.930 6.512 10.566 1.00 14.53 N
425 ATOM 54 CA LEU A 7 40.678 7.905 10.962 1.00 21.29 C
426 ATOM 55 C LEU A 7 41.911 8.573 11.600 1.00 18.43 C
427 ATOM 56 O LEU A 7 42.139 9.788 11.493 1.00 15.56 O
428 ATOM 57 CB LEU A 7 39.461 7.978 11.870 1.00 18.54 C
429 ATOM 58 CG LEU A 7 38.189 7.924 11.063 1.00 16.53 C
430 ATOM 59 CD1 LEU A 7 37.014 7.560 11.971 1.00 17.49 C
431 ATOM 60 CD2 LEU A 7 37.986 9.269 10.370 1.00 15.12 C
432 ATOM 61 N ARG A 8 42.708 7.762 12.273 1.00 14.16 N
433 ATOM 62 CA ARG A 8 43.917 8.261 12.880 1.00 19.61 C
434 ATOM 63 C ARG A 8 44.865 8.781 11.808 1.00 26.30 C
435 ATOM 64 O ARG A 8 45.528 9.774 12.024 1.00 21.88 O
436 ATOM 65 CB ARG A 8 44.586 7.325 13.869 1.00 20.56 C
437 ATOM 66 CG ARG A 8 46.027 7.718 14.184 1.00 37.82 C
438 ATOM 67 CD ARG A 8 46.170 8.712 15.353 1.00 42.77 C
439 ATOM 68 NE ARG A 8 47.524 9.293 15.530 1.00 46.83 N
440 ATOM 69 CZ ARG A 8 48.229 9.972 14.607 1.00 99.19 C
441 ATOM 70 NH1 ARG A 8 47.777 10.221 13.368 1.00 32.80 N
442 ATOM 71 NH2 ARG A 8 49.430 10.433 14.949 1.00 91.26 N
443 ATOM 72 N ILE A 9 44.882 8.142 10.640 1.00 16.92 N
444 ATOM 73 CA ILE A 9 45.673 8.563 9.496 1.00 16.35 C
445 ATOM 74 C ILE A 9 45.072 9.813 8.829 1.00 27.38 C
446 ATOM 75 O ILE A 9 45.743 10.755 8.446 1.00 18.28 O
447 ATOM 76 CB ILE A 9 45.825 7.439 8.446 1.00 20.31 C
448 ATOM 77 CG1 ILE A 9 46.883 6.436 8.859 1.00 13.36 C
449 ATOM 78 CG2 ILE A 9 46.135 7.977 7.034 1.00 17.06 C
450 ATOM 79 CD1 ILE A 9 46.565 5.036 8.332 1.00 14.58 C
451 ATOM 80 N ASP A 10 43.782 9.852 8.693 1.00 15.81 N
452 ATOM 81 CA ASP A 10 43.153 11.003 8.063 1.00 15.50 C
453 ATOM 82 C ASP A 10 43.093 12.295 8.910 1.00 21.63 C
454 ATOM 83 O ASP A 10 43.130 13.406 8.391 1.00 17.28 O
455 ATOM 84 CB ASP A 10 41.730 10.592 7.624 1.00 16.10 C
456 ATOM 85 CG ASP A 10 41.760 9.803 6.377 1.00 13.23 C
457 ATOM 86 OD1 ASP A 10 42.695 9.816 5.611 1.00 20.55 O
458 ATOM 87 OD2 ASP A 10 40.712 9.060 6.233 1.00 17.18 O
459 ATOM 88 N GLU A 11 42.945 12.153 10.224 1.00 15.81 N
460 ATOM 89 CA GLU A 11 42.797 13.289 11.103 1.00 19.29 C
461 ATOM 90 C GLU A 11 44.052 13.749 11.841 1.00 20.40 C
462 ATOM 91 O GLU A 11 44.089 14.894 12.260 1.00 23.72 O
463 ATOM 92 CB GLU A 11 41.697 12.982 12.133 1.00 14.01 C
464 ATOM 93 CG GLU A 11 40.376 12.667 11.443 1.00 17.34 C
465 ATOM 94 CD GLU A 11 39.697 13.912 10.945 1.00 27.44 C
466 ATOM 95 OE1 GLU A 11 40.323 15.018 11.244 1.00 21.14 O
467 ATOM 96 OE2 GLU A 11 38.656 13.904 10.343 1.00 20.55 O
468 ATOM 97 N GLY A 12 45.035 12.858 12.032 1.00 14.20 N
469 ATOM 98 CA GLY A 12 46.232 13.131 12.806 1.00 18.37 C
470 ATOM 99 C GLY A 12 45.899 13.169 14.304 1.00 20.59 C
471 ATOM 100 O GLY A 12 44.810 12.854 14.722 1.00 21.58 O
472 ATOM 101 N LEU A 13 46.836 13.559 15.141 1.00 19.85 N
473 ATOM 102 CA LEU A 13 46.609 13.677 16.565 1.00 22.44 C
474 ATOM 103 C LEU A 13 47.261 14.972 17.039 1.00 44.17 C
475 ATOM 104 O LEU A 13 48.431 15.186 16.806 1.00 26.20 O
476 ATOM 105 CB LEU A 13 47.176 12.474 17.338 1.00 38.90 C
477 ATOM 106 CG LEU A 13 47.507 12.775 18.806 1.00 40.07 C
478 ATOM 107 CD1 LEU A 13 46.230 12.764 19.641 1.00 28.57 C
479 ATOM 108 CD2 LEU A 13 48.473 11.727 19.353 1.00 46.54 C
480 ATOM 109 N ARG A 14 46.519 15.861 17.664 1.00 27.36 N
481 ATOM 110 CA ARG A 14 47.072 17.111 18.151 1.00 21.86 C
482 ATOM 111 C ARG A 14 46.637 17.313 19.543 1.00 18.77 C
483 ATOM 112 O ARG A 14 45.464 17.155 19.839 1.00 17.64 O
484 ATOM 113 CB ARG A 14 46.786 18.278 17.235 1.00 21.80 C
485 ATOM 114 CG ARG A 14 47.611 18.057 15.960 1.00 32.36 C
486 ATOM 115 CD ARG A 14 47.523 19.146 14.885 1.00 38.76 C
487 ATOM 116 NE ARG A 14 48.169 20.392 15.285 1.00 68.59 N
488 ATOM 117 CZ ARG A 14 48.045 21.562 14.644 1.00 68.57 C
489 ATOM 118 NH1 ARG A 14 47.305 21.721 13.545 1.00 57.76 N
490 ATOM 119 NH2 ARG A 14 48.693 22.618 15.121 1.00 67.84 N
491 ATOM 120 N LEU A 15 47.595 17.574 20.411 1.00 16.44 N
492 ATOM 121 CA LEU A 15 47.275 17.692 21.801 1.00 23.28 C
493 ATOM 122 C LEU A 15 46.977 19.081 22.288 1.00 30.07 C
494 ATOM 123 O LEU A 15 46.694 19.236 23.471 1.00 29.20 O
495 ATOM 124 CB LEU A 15 48.326 17.033 22.690 1.00 24.37 C
496 ATOM 125 CG LEU A 15 48.476 15.536 22.446 1.00 26.92 C
497 ATOM 126 CD1 LEU A 15 49.575 15.021 23.360 1.00 27.01 C
498 ATOM 127 CD2 LEU A 15 47.167 14.818 22.759 1.00 29.93 C
499 ATOM 128 N LYS A 16 47.056 20.075 21.411 1.00 19.85 N
500 ATOM 129 CA LYS A 16 46.764 21.473 21.775 1.00 23.72 C
501 ATOM 130 C LYS A 16 45.688 21.980 20.817 1.00 18.66 C
502 ATOM 131 O LYS A 16 45.665 21.488 19.685 1.00 24.77 O
503 ATOM 132 CB LYS A 16 48.073 22.289 21.769 1.00 37.57 C
504 ATOM 133 CG LYS A 16 47.898 23.782 21.584 1.00 68.90 C
505 ATOM 134 CD LYS A 16 48.159 24.572 22.857 1.00100.00 C
506 ATOM 135 CE LYS A 16 46.870 25.038 23.522 1.00100.00 C
507 ATOM 136 NZ LYS A 16 47.076 26.091 24.527 1.00100.00 N
508 ATOM 137 N ILE A 17 44.753 22.868 21.267 1.00 27.43 N
509 ATOM 138 CA ILE A 17 43.668 23.352 20.390 1.00 20.38 C
510 ATOM 139 C ILE A 17 44.264 23.817 19.092 1.00 33.54 C
511 ATOM 140 O ILE A 17 45.327 24.439 19.129 1.00 27.11 O
512 ATOM 141 CB ILE A 17 42.804 24.480 20.999 1.00 21.16 C
513 ATOM 142 CG1 ILE A 17 42.050 23.954 22.217 1.00 19.36 C
514 ATOM 143 CG2 ILE A 17 41.805 25.048 19.979 1.00 21.16 C
515 ATOM 144 CD1 ILE A 17 41.188 25.006 22.919 1.00 21.11 C
516 ATOM 145 N TYR A 18 43.631 23.474 17.976 1.00 16.03 N
517 ATOM 146 CA TYR A 18 44.131 23.896 16.669 1.00 16.10 C
518 ATOM 147 C TYR A 18 42.943 24.190 15.804 1.00 18.60 C
519 ATOM 148 O TYR A 18 41.802 23.883 16.180 1.00 28.74 O
520 ATOM 149 CB TYR A 18 45.094 22.873 15.992 1.00 17.30 C
521 ATOM 150 CG TYR A 18 44.395 21.599 15.575 1.00 27.30 C
522 ATOM 151 CD1 TYR A 18 44.162 20.601 16.524 1.00 26.74 C
523 ATOM 152 CD2 TYR A 18 43.961 21.397 14.259 1.00 27.82 C
524 ATOM 153 CE1 TYR A 18 43.497 19.427 16.168 1.00 24.56 C
525 ATOM 154 CE2 TYR A 18 43.306 20.221 13.880 1.00 27.86 C
526 ATOM 155 CZ TYR A 18 43.072 19.247 14.848 1.00 25.77 C
527 ATOM 156 OH TYR A 18 42.449 18.088 14.524 1.00 34.81 O
528 ATOM 157 N LYS A 19 43.196 24.787 14.651 1.00 16.02 N
529 ATOM 158 CA LYS A 19 42.123 25.055 13.726 1.00 19.97 C
530 ATOM 159 C LYS A 19 42.144 23.993 12.657 1.00 41.21 C
531 ATOM 160 O LYS A 19 43.208 23.603 12.144 1.00 21.68 O
532 ATOM 161 CB LYS A 19 42.204 26.414 13.073 1.00 26.17 C
533 ATOM 162 CG LYS A 19 41.924 27.503 14.055 1.00 14.96 C
534 ATOM 163 CD LYS A 19 41.482 28.762 13.372 1.00 41.38 C
535 ATOM 164 CE LYS A 19 41.859 29.995 14.164 1.00 31.10 C
536 ATOM 165 NZ LYS A 19 41.486 31.253 13.499 1.00 42.09 N
537 ATOM 166 N ASP A 20 40.955 23.521 12.332 1.00 21.89 N
538 ATOM 167 CA ASP A 20 40.827 22.500 11.327 1.00 18.05 C
539 ATOM 168 C ASP A 20 40.911 23.061 9.895 1.00 36.54 C
540 ATOM 169 O ASP A 20 41.183 24.237 9.687 1.00 23.32 O
541 ATOM 170 CB ASP A 20 39.632 21.586 11.634 1.00 13.31 C
542 ATOM 171 CG ASP A 20 38.276 22.082 11.210 1.00 22.98 C
543 ATOM 172 OD1 ASP A 20 38.276 23.288 10.764 1.00 25.53 O
544 ATOM 173 OD2 ASP A 20 37.265 21.414 11.265 1.00 20.96 O
545 ATOM 174 N THR A 21 40.656 22.251 8.882 1.00 23.37 N
546 ATOM 175 CA THR A 21 40.782 22.770 7.531 1.00 26.35 C
547 ATOM 176 C THR A 21 39.794 23.823 7.214 1.00 35.10 C
548 ATOM 177 O THR A 21 39.999 24.562 6.252 1.00 31.67 O
549 ATOM 178 CB THR A 21 40.690 21.709 6.445 1.00 36.99 C
550 ATOM 179 OG1 THR A 21 39.336 21.335 6.363 1.00 37.89 O
551 ATOM 180 CG2 THR A 21 41.530 20.490 6.832 1.00 42.61 C
552 ATOM 181 N GLU A 22 38.710 23.856 7.990 1.00 31.70 N
553 ATOM 182 CA GLU A 22 37.649 24.842 7.753 1.00 19.87 C
554 ATOM 183 C GLU A 22 37.825 26.080 8.612 1.00 22.50 C
555 ATOM 184 O GLU A 22 37.067 27.002 8.502 1.00 26.62 O
556 ATOM 185 CB GLU A 22 36.283 24.223 8.011 1.00 19.62 C
557 ATOM 186 CG GLU A 22 35.903 23.121 6.995 1.00 34.66 C
558 ATOM 187 CD GLU A 22 35.610 23.596 5.592 1.00 31.12 C
559 ATOM 188 OE1 GLU A 22 35.076 24.777 5.527 1.00 59.86 O
560 ATOM 189 OE2 GLU A 22 35.803 22.921 4.608 1.00 66.24 O
561 ATOM 190 N GLY A 23 38.849 26.031 9.477 1.00 25.75 N
562 ATOM 191 CA GLY A 23 39.162 27.087 10.404 1.00 16.27 C
563 ATOM 192 C GLY A 23 38.504 26.915 11.753 1.00 44.57 C
564 ATOM 193 O GLY A 23 38.463 27.875 12.501 1.00 24.37 O
565 ATOM 194 N TYR A 24 38.000 25.711 12.094 1.00 23.88 N
566 ATOM 195 CA TYR A 24 37.353 25.542 13.416 1.00 24.79 C
567 ATOM 196 C TYR A 24 38.236 24.943 14.466 1.00 27.90 C
568 ATOM 197 O TYR A 24 39.039 24.055 14.173 1.00 25.68 O
569 ATOM 198 CB TYR A 24 36.094 24.687 13.394 1.00 32.22 C
570 ATOM 199 CG TYR A 24 35.092 25.183 12.417 1.00 28.12 C
571 ATOM 200 CD1 TYR A 24 34.705 26.520 12.413 1.00 53.02 C
572 ATOM 201 CD2 TYR A 24 34.506 24.302 11.513 1.00 19.21 C
573 ATOM 202 CE1 TYR A 24 33.739 26.986 11.524 1.00 45.84 C
574 ATOM 203 CE2 TYR A 24 33.562 24.760 10.595 1.00 36.61 C
575 ATOM 204 CZ TYR A 24 33.180 26.101 10.604 1.00 56.05 C
576 ATOM 205 OH TYR A 24 32.245 26.551 9.714 1.00 45.11 O
577 ATOM 206 N TYR A 25 38.007 25.431 15.692 1.00 15.99 N
578 ATOM 207 CA TYR A 25 38.703 24.984 16.895 1.00 11.94 C
579 ATOM 208 C TYR A 25 38.439 23.499 17.105 1.00 11.94 C
580 ATOM 209 O TYR A 25 37.268 23.099 17.238 1.00 15.34 O
581 ATOM 210 CB TYR A 25 38.307 25.855 18.115 1.00 18.43 C
582 ATOM 211 CG TYR A 25 38.894 27.242 18.016 1.00 34.03 C
583 ATOM 212 CD1 TYR A 25 40.271 27.382 17.848 1.00 27.65 C
584 ATOM 213 CD2 TYR A 25 38.097 28.388 18.057 1.00 33.45 C
585 ATOM 214 CE1 TYR A 25 40.840 28.650 17.734 1.00 39.06 C
586 ATOM 215 CE2 TYR A 25 38.645 29.669 17.931 1.00 23.19 C
587 ATOM 216 CZ TYR A 25 40.027 29.783 17.801 1.00 44.81 C
588 ATOM 217 OH TYR A 25 40.583 31.024 17.670 1.00 49.20 O
589 ATOM 218 N THR A 26 39.533 22.714 17.039 1.00 15.96 N
590 ATOM 219 CA THR A 26 39.531 21.254 17.150 1.00 21.07 C
591 ATOM 220 C THR A 26 40.640 20.872 18.122 1.00 20.51 C
592 ATOM 221 O THR A 26 41.491 21.681 18.416 1.00 25.42 O
593 ATOM 222 CB THR A 26 39.836 20.698 15.707 1.00 24.86 C
594 ATOM 223 OG1 THR A 26 38.890 21.162 14.781 1.00 19.65 O
595 ATOM 224 CG2 THR A 26 39.977 19.183 15.536 1.00 13.83 C
596 ATOM 225 N ILE A 27 40.637 19.640 18.613 1.00 18.89 N
597 ATOM 226 CA ILE A 27 41.690 19.092 19.464 1.00 21.14 C
598 ATOM 227 C ILE A 27 41.718 17.566 19.220 1.00 18.55 C
599 ATOM 228 O ILE A 27 40.750 16.979 18.711 1.00 16.35 O
600 ATOM 229 CB ILE A 27 41.518 19.451 20.950 1.00 24.61 C
601 ATOM 230 CG1 ILE A 27 42.785 19.176 21.766 1.00 25.32 C
602 ATOM 231 CG2 ILE A 27 40.327 18.678 21.501 1.00 23.83 C
603 ATOM 232 CD1 ILE A 27 43.111 20.273 22.751 1.00 23.15 C
604 ATOM 233 N GLY A 28 42.808 16.918 19.577 1.00 13.69 N
605 ATOM 234 CA GLY A 28 42.921 15.459 19.503 1.00 18.65 C
606 ATOM 235 C GLY A 28 42.891 14.893 18.093 1.00 32.78 C
607 ATOM 236 O GLY A 28 43.631 15.346 17.226 1.00 17.03 O
608 ATOM 237 N ILE A 29 42.049 13.872 17.914 1.00 19.09 N
609 ATOM 238 CA ILE A 29 41.904 13.202 16.642 1.00 20.08 C
610 ATOM 239 C ILE A 29 40.667 13.689 15.912 1.00 18.24 C
611 ATOM 240 O ILE A 29 39.682 12.961 15.756 1.00 16.35 O
612 ATOM 241 CB ILE A 29 41.937 11.654 16.737 1.00 24.69 C
613 ATOM 242 CG1 ILE A 29 43.233 11.195 17.408 1.00 26.50 C
614 ATOM 243 CG2 ILE A 29 41.887 11.056 15.327 1.00 21.90 C
615 ATOM 244 CD1 ILE A 29 43.058 10.008 18.337 1.00 20.13 C
616 ATOM 245 N GLY A 30 40.712 14.938 15.460 1.00 14.79 N
617 ATOM 246 CA GLY A 30 39.581 15.472 14.732 1.00 12.92 C
618 ATOM 247 C GLY A 30 38.334 15.746 15.582 1.00 15.37 C
619 ATOM 248 O GLY A 30 37.205 15.716 15.097 1.00 20.15 O
620 ATOM 249 N HIS A 31 38.500 16.048 16.856 1.00 14.09 N
621 ATOM 250 CA HIS A 31 37.325 16.340 17.664 1.00 10.03 C
622 ATOM 251 C HIS A 31 36.956 17.811 17.550 1.00 17.19 C
623 ATOM 252 O HIS A 31 37.635 18.676 18.149 1.00 17.35 O
624 ATOM 253 CB HIS A 31 37.580 15.965 19.155 1.00 9.72 C
625 ATOM 254 CG HIS A 31 36.362 16.220 19.988 1.00 16.25 C
626 ATOM 255 ND1 HIS A 31 35.281 15.352 19.953 1.00 22.15 N
627 ATOM 256 CD2 HIS A 31 36.036 17.264 20.821 1.00 23.02 C
628 ATOM 257 CE1 HIS A 31 34.335 15.868 20.745 1.00 18.36 C
629 ATOM 258 NE2 HIS A 31 34.752 17.022 21.283 1.00 20.39 N
630 ATOM 259 N LEU A 32 35.888 18.123 16.786 1.00 19.89 N
631 ATOM 260 CA LEU A 32 35.434 19.506 16.649 1.00 22.81 C
632 ATOM 261 C LEU A 32 34.989 20.052 18.006 1.00 21.28 C
633 ATOM 262 O LEU A 32 34.230 19.452 18.772 1.00 18.93 O
634 ATOM 263 CB LEU A 32 34.317 19.631 15.603 1.00 28.12 C
635 ATOM 264 CG LEU A 32 33.757 21.065 15.455 1.00 40.81 C
636 ATOM 265 CD1 LEU A 32 34.829 22.054 15.001 1.00 27.79 C
637 ATOM 266 CD2 LEU A 32 32.642 21.081 14.421 1.00 41.16 C
638 ATOM 267 N LEU A 33 35.475 21.192 18.349 1.00 21.56 N
639 ATOM 268 CA LEU A 33 35.078 21.729 19.619 1.00 19.83 C
640 ATOM 269 C LEU A 33 33.908 22.714 19.478 1.00 29.31 C
641 ATOM 270 O LEU A 33 32.944 22.651 20.239 1.00 22.70 O
642 ATOM 271 CB LEU A 33 36.262 22.444 20.297 1.00 22.07 C
643 ATOM 272 CG LEU A 33 37.287 21.510 20.900 1.00 26.04 C
644 ATOM 273 CD1 LEU A 33 38.456 22.373 21.319 1.00 19.93 C
645 ATOM 274 CD2 LEU A 33 36.692 20.792 22.117 1.00 13.61 C
646 ATOM 275 N THR A 34 34.030 23.648 18.517 1.00 17.91 N
647 ATOM 276 CA THR A 34 33.040 24.694 18.281 1.00 36.94 C
648 ATOM 277 C THR A 34 33.277 25.379 16.960 1.00 38.95 C
649 ATOM 278 O THR A 34 34.439 25.521 16.556 1.00 26.47 O
650 ATOM 279 CB THR A 34 33.109 25.828 19.362 1.00 38.53 C
651 ATOM 280 OG1 THR A 34 32.139 26.835 19.135 1.00 32.13 O
652 ATOM 281 CG2 THR A 34 34.479 26.487 19.449 1.00 25.22 C
653 ATOM 282 N LYS A 35 32.178 25.840 16.329 1.00 21.03 N
654 ATOM 283 CA LYS A 35 32.312 26.618 15.115 1.00 42.71 C
655 ATOM 284 C LYS A 35 32.464 28.109 15.399 1.00 49.58 C
656 ATOM 285 O LYS A 35 32.635 28.890 14.480 1.00 44.84 O
657 ATOM 286 CB LYS A 35 31.247 26.369 14.100 1.00 27.30 C
658 ATOM 287 CG LYS A 35 31.270 24.915 13.693 1.00 38.85 C
659 ATOM 288 CD LYS A 35 30.196 24.606 12.682 1.00 33.63 C
660 ATOM 289 CE LYS A 35 30.044 23.119 12.477 1.00 44.83 C
661 ATOM 290 NZ LYS A 35 29.871 22.743 11.072 1.00 99.38 N
662 ATOM 291 N SER A 36 32.423 28.491 16.673 1.00 47.90 N
663 ATOM 292 CA SER A 36 32.586 29.877 17.098 1.00 50.36 C
664 ATOM 293 C SER A 36 34.039 30.342 16.961 1.00 48.50 C
665 ATOM 294 O SER A 36 34.984 29.576 17.201 1.00 29.10 O
666 ATOM 295 CB SER A 36 32.103 30.099 18.525 1.00 46.16 C
667 ATOM 296 OG SER A 36 33.055 30.878 19.233 1.00 86.49 O
668 ATOM 297 N PRO A 37 34.228 31.625 16.606 1.00 52.43 N
669 ATOM 298 CA PRO A 37 35.561 32.190 16.409 1.00 37.83 C
670 ATOM 299 C PRO A 37 36.364 32.379 17.683 1.00 37.68 C
671 ATOM 300 O PRO A 37 37.572 32.627 17.658 1.00 68.51 O
672 ATOM 301 CB PRO A 37 35.334 33.516 15.704 1.00 45.72 C
673 ATOM 302 CG PRO A 37 33.953 33.444 15.089 1.00 54.11 C
674 ATOM 303 CD PRO A 37 33.194 32.404 15.886 1.00 29.50 C
675 ATOM 304 N SER A 38 35.682 32.213 18.804 1.00 50.22 N
676 ATOM 305 CA SER A 38 36.277 32.436 20.095 1.00 33.09 C
677 ATOM 306 C SER A 38 37.081 31.302 20.652 1.00 31.69 C
678 ATOM 307 O SER A 38 36.573 30.200 20.873 1.00 33.48 O
679 ATOM 308 CB SER A 38 35.270 32.944 21.124 1.00 36.81 C
680 ATOM 309 OG SER A 38 35.885 33.091 22.394 1.00 38.78 O
681 ATOM 310 N LEU A 39 38.329 31.628 20.942 1.00 25.77 N
682 ATOM 311 CA LEU A 39 39.195 30.653 21.518 1.00 25.84 C
683 ATOM 312 C LEU A 39 38.731 30.365 22.925 1.00 37.88 C
684 ATOM 313 O LEU A 39 38.994 29.321 23.525 1.00 27.95 O
685 ATOM 314 CB LEU A 39 40.692 31.019 21.415 1.00 29.02 C
686 ATOM 315 CG LEU A 39 41.546 30.011 22.155 1.00 51.86 C
687 ATOM 316 CD1 LEU A 39 41.522 28.669 21.431 1.00 26.75 C
688 ATOM 317 CD2 LEU A 39 42.957 30.533 22.241 1.00 30.96 C
689 ATOM 318 N ASN A 40 37.971 31.285 23.453 1.00 32.37 N
690 ATOM 319 CA ASN A 40 37.485 31.045 24.785 1.00 34.00 C
691 ATOM 320 C ASN A 40 36.283 30.156 24.761 1.00 20.82 C
692 ATOM 321 O ASN A 40 36.131 29.335 25.647 1.00 25.78 O
693 ATOM 322 CB ASN A 40 37.231 32.319 25.582 1.00 58.62 C
694 ATOM 323 CG ASN A 40 38.480 33.154 25.624 1.00 97.93 C
695 ATOM 324 OD1 ASN A 40 39.393 32.885 26.418 1.00 63.93 O
696 ATOM 325 ND2 ASN A 40 38.531 34.143 24.736 1.00100.00 N
697 ATOM 326 N ALA A 41 35.412 30.331 23.766 1.00 22.83 N
698 ATOM 327 CA ALA A 41 34.272 29.446 23.669 1.00 28.43 C
699 ATOM 328 C ALA A 41 34.800 28.004 23.476 1.00 89.67 C
700 ATOM 329 O ALA A 41 34.274 27.058 24.044 1.00 26.13 O
701 ATOM 330 CB ALA A 41 33.282 29.886 22.599 1.00 20.01 C
702 ATOM 331 N ALA A 42 35.910 27.861 22.712 1.00 21.80 N
703 ATOM 332 CA ALA A 42 36.626 26.587 22.450 1.00 25.69 C
704 ATOM 333 C ALA A 42 37.225 26.018 23.713 1.00 21.72 C
705 ATOM 334 O ALA A 42 37.108 24.814 23.991 1.00 26.66 O
706 ATOM 335 CB ALA A 42 37.766 26.725 21.451 1.00 26.28 C
707 ATOM 336 N LYS A 43 37.876 26.873 24.488 1.00 20.78 N
708 ATOM 337 CA LYS A 43 38.448 26.396 25.745 1.00 26.55 C
709 ATOM 338 C LYS A 43 37.367 25.885 26.725 1.00 18.43 C
710 ATOM 339 O LYS A 43 37.536 24.888 27.418 1.00 22.57 O
711 ATOM 340 CB LYS A 43 39.358 27.415 26.401 1.00 29.30 C
712 ATOM 341 CG LYS A 43 40.817 27.310 25.975 1.00 32.53 C
713 ATOM 342 CD LYS A 43 41.658 28.449 26.537 1.00 39.07 C
714 ATOM 343 CE LYS A 43 43.132 28.368 26.191 1.00 70.19 C
715 ATOM 344 NZ LYS A 43 43.999 28.709 27.328 1.00100.00 N
716 ATOM 345 N SER A 44 36.232 26.573 26.760 1.00 25.21 N
717 ATOM 346 CA SER A 44 35.084 26.220 27.588 1.00 40.39 C
718 ATOM 347 C SER A 44 34.493 24.831 27.227 1.00 25.10 C
719 ATOM 348 O SER A 44 34.221 24.015 28.094 1.00 25.06 O
720 ATOM 349 CB SER A 44 34.020 27.309 27.465 1.00 24.69 C
721 ATOM 350 OG SER A 44 33.580 27.696 28.747 1.00 55.07 O
722 ATOM 351 N GLU A 45 34.276 24.599 25.934 1.00 20.29 N
723 ATOM 352 CA GLU A 45 33.776 23.354 25.398 1.00 20.75 C
724 ATOM 353 C GLU A 45 34.770 22.253 25.727 1.00 21.77 C
725 ATOM 354 O GLU A 45 34.390 21.147 26.109 1.00 25.55 O
726 ATOM 355 CB GLU A 45 33.651 23.425 23.864 1.00 17.93 C
727 ATOM 356 CG GLU A 45 32.470 24.292 23.431 1.00 20.42 C
728 ATOM 357 CD GLU A 45 31.171 23.690 23.915 1.00 25.25 C
729 ATOM 358 OE1 GLU A 45 30.924 22.504 23.847 1.00 33.86 O
730 ATOM 359 OE2 GLU A 45 30.325 24.557 24.405 1.00 34.26 O
731 ATOM 360 N LEU A 46 36.055 22.574 25.586 1.00 18.51 N
732 ATOM 361 CA LEU A 46 37.090 21.624 25.898 1.00 23.52 C
733 ATOM 362 C LEU A 46 37.029 21.097 27.350 1.00 27.76 C
734 ATOM 363 O LEU A 46 37.085 19.895 27.625 1.00 24.47 O
735 ATOM 364 CB LEU A 46 38.510 22.141 25.543 1.00 21.42 C
736 ATOM 365 CG LEU A 46 39.572 21.072 25.814 1.00 20.93 C
737 ATOM 366 CD1 LEU A 46 39.228 19.800 25.053 1.00 20.95 C
738 ATOM 367 CD2 LEU A 46 40.957 21.569 25.406 1.00 20.18 C
739 ATOM 368 N ASP A 47 36.932 22.015 28.302 1.00 29.27 N
740 ATOM 369 CA ASP A 47 36.889 21.663 29.720 1.00 22.28 C
741 ATOM 370 C ASP A 47 35.665 20.848 30.051 1.00 24.61 C
742 ATOM 371 O ASP A 47 35.710 19.943 30.884 1.00 24.60 O
743 ATOM 372 CB ASP A 47 36.925 22.908 30.620 1.00 27.92 C
744 ATOM 373 CG ASP A 47 38.241 23.645 30.611 1.00 28.35 C
745 ATOM 374 OD1 ASP A 47 39.335 23.146 30.311 1.00 29.37 O
746 ATOM 375 OD2 ASP A 47 38.067 24.873 30.998 1.00 31.50 O
747 ATOM 376 N LYS A 48 34.576 21.227 29.395 1.00 15.93 N
748 ATOM 377 CA LYS A 48 33.285 20.550 29.520 1.00 22.70 C
749 ATOM 378 C LYS A 48 33.396 19.088 29.003 1.00 14.56 C
750 ATOM 379 O LYS A 48 32.939 18.139 29.617 1.00 19.71 O
751 ATOM 380 CB LYS A 48 32.239 21.340 28.733 1.00 12.69 C
752 ATOM 381 CG LYS A 48 30.892 20.660 28.585 1.00 24.55 C
753 ATOM 382 CD LYS A 48 29.732 21.615 28.309 1.00 24.51 C
754 ATOM 383 CE LYS A 48 29.749 22.290 26.959 1.00 15.73 C
755 ATOM 384 NZ LYS A 48 29.317 21.472 25.854 1.00 18.48 N
756 ATOM 385 N ALA A 49 34.054 18.913 27.864 1.00 27.07 N
757 ATOM 386 CA ALA A 49 34.248 17.605 27.284 1.00 31.80 C
758 ATOM 387 C ALA A 49 35.126 16.664 28.136 1.00 20.96 C
759 ATOM 388 O ALA A 49 34.794 15.500 28.287 1.00 21.01 O
760 ATOM 389 CB ALA A 49 34.713 17.723 25.838 1.00 19.52 C
761 ATOM 390 N ILE A 50 36.227 17.190 28.685 1.00 21.91 N
762 ATOM 391 CA ILE A 50 37.199 16.469 29.513 1.00 19.70 C
763 ATOM 392 C ILE A 50 36.819 16.340 31.004 1.00 19.90 C
764 ATOM 393 O ILE A 50 37.227 15.393 31.705 1.00 26.50 O
765 ATOM 394 CB ILE A 50 38.600 17.109 29.351 1.00 35.09 C
766 ATOM 395 CG1 ILE A 50 38.955 17.207 27.868 1.00 46.51 C
767 ATOM 396 CG2 ILE A 50 39.718 16.391 30.133 1.00 19.09 C
768 ATOM 397 CD1 ILE A 50 38.855 15.866 27.138 1.00 35.36 C
769 ATOM 398 N GLY A 51 36.053 17.287 31.510 1.00 20.52 N
770 ATOM 399 CA GLY A 51 35.695 17.205 32.915 1.00 21.28 C
771 ATOM 400 C GLY A 51 36.795 17.770 33.821 1.00 33.03 C
772 ATOM 401 O GLY A 51 36.936 17.396 34.980 1.00 32.95 O
773 ATOM 402 N ARG A 52 37.587 18.690 33.271 1.00 33.13 N
774 ATOM 403 CA ARG A 52 38.636 19.347 34.024 1.00 25.82 C
775 ATOM 404 C ARG A 52 39.076 20.636 33.358 1.00 51.55 C
776 ATOM 405 O ARG A 52 38.734 20.916 32.204 1.00 31.97 O
777 ATOM 406 CB ARG A 52 39.814 18.431 34.334 1.00 28.82 C
778 ATOM 407 CG ARG A 52 40.896 18.459 33.274 1.00 26.94 C
779 ATOM 408 CD ARG A 52 41.748 17.227 33.345 1.00 29.29 C
780 ATOM 409 NE ARG A 52 42.691 17.129 32.250 1.00 32.97 N
781 ATOM 410 CZ ARG A 52 43.556 18.061 31.914 1.00 29.41 C
782 ATOM 411 NH1 ARG A 52 43.638 19.216 32.571 1.00 38.68 N
783 ATOM 412 NH2 ARG A 52 44.355 17.819 30.883 1.00 31.58 N
784 ATOM 413 N ASN A 53 39.804 21.421 34.128 1.00 31.25 N
785 ATOM 414 CA ASN A 53 40.349 22.665 33.671 1.00 37.47 C
786 ATOM 415 C ASN A 53 41.596 22.340 32.886 1.00 22.22 C
787 ATOM 416 O ASN A 53 42.597 21.903 33.433 1.00 35.57 O
788 ATOM 417 CB ASN A 53 40.617 23.582 34.865 1.00 41.62 C
789 ATOM 418 CG ASN A 53 39.833 24.843 34.640 1.00100.00 C
790 ATOM 419 OD1 ASN A 53 38.642 24.918 34.983 1.00100.00 O
791 ATOM 420 ND2 ASN A 53 40.473 25.794 33.958 1.00 48.69 N
792 ATOM 421 N THR A 54 41.530 22.450 31.581 1.00 30.66 N
793 ATOM 422 CA THR A 54 42.673 21.993 30.811 1.00 25.09 C
794 ATOM 423 C THR A 54 43.569 23.059 30.256 1.00 42.51 C
795 ATOM 424 O THR A 54 44.620 22.722 29.726 1.00 44.03 O
796 ATOM 425 CB THR A 54 42.194 21.203 29.582 1.00 36.19 C
797 ATOM 426 OG1 THR A 54 41.544 22.104 28.694 1.00 31.34 O
798 ATOM 427 CG2 THR A 54 41.248 20.076 29.976 1.00 30.92 C
799 ATOM 428 N ASN A 55 43.132 24.318 30.282 1.00 29.82 N
800 ATOM 429 CA ASN A 55 43.930 25.369 29.703 1.00 53.27 C
801 ATOM 430 C ASN A 55 44.266 25.125 28.211 1.00 44.53 C
802 ATOM 431 O ASN A 55 45.277 25.624 27.717 1.00 52.95 O
803 ATOM 432 CB ASN A 55 45.198 25.710 30.548 1.00 38.01 C
804 ATOM 433 CG ASN A 55 45.640 27.168 30.429 1.00 81.69 C
805 ATOM 434 OD1 ASN A 55 44.880 28.050 29.972 1.00 47.75 O
806 ATOM 435 ND2 ASN A 55 46.881 27.425 30.834 1.00 85.41 N
807 ATOM 436 N GLY A 56 43.444 24.368 27.476 1.00 25.34 N
808 ATOM 437 CA GLY A 56 43.688 24.140 26.043 1.00 20.76 C
809 ATOM 438 C GLY A 56 44.608 22.979 25.690 1.00 20.63 C
810 ATOM 439 O GLY A 56 44.972 22.760 24.530 1.00 32.68 O
811 ATOM 440 N VAL A 57 44.985 22.200 26.675 1.00 28.75 N
812 ATOM 441 CA VAL A 57 45.865 21.085 26.397 1.00 15.36 C
813 ATOM 442 C VAL A 57 45.385 19.792 27.066 1.00 20.87 C
814 ATOM 443 O VAL A 57 44.961 19.806 28.208 1.00 25.39 O
815 ATOM 444 CB VAL A 57 47.206 21.444 26.951 1.00 37.48 C
816 ATOM 445 CG1 VAL A 57 48.165 20.279 26.722 1.00 23.75 C
817 ATOM 446 CG2 VAL A 57 47.664 22.721 26.263 1.00 46.99 C
818 ATOM 447 N ILE A 58 45.460 18.674 26.351 1.00 27.01 N
819 ATOM 448 CA ILE A 58 45.013 17.386 26.861 1.00 19.99 C
820 ATOM 449 C ILE A 58 46.117 16.352 26.671 1.00 32.03 C
821 ATOM 450 O ILE A 58 47.082 16.572 25.940 1.00 25.57 O
822 ATOM 451 CB ILE A 58 43.731 16.917 26.122 1.00 21.33 C
823 ATOM 452 CG1 ILE A 58 44.013 16.726 24.625 1.00 21.96 C
824 ATOM 453 CG2 ILE A 58 42.550 17.893 26.282 1.00 21.95 C
825 ATOM 454 CD1 ILE A 58 42.897 15.960 23.911 1.00 20.38 C
826 ATOM 455 N THR A 59 45.971 15.204 27.318 1.00 19.66 N
827 ATOM 456 CA THR A 59 46.924 14.139 27.175 1.00 18.15 C
828 ATOM 457 C THR A 59 46.426 13.207 26.070 1.00 25.44 C
829 ATOM 458 O THR A 59 45.252 13.275 25.695 1.00 24.72 O
830 ATOM 459 CB THR A 59 46.935 13.303 28.468 1.00 41.91 C
831 ATOM 460 OG1 THR A 59 45.683 12.658 28.549 1.00 26.38 O
832 ATOM 461 CG2 THR A 59 47.140 14.178 29.698 1.00 32.89 C
833 ATOM 462 N LYS A 60 47.312 12.304 25.627 1.00 31.20 N
834 ATOM 463 CA LYS A 60 47.044 11.279 24.624 1.00 21.91 C
835 ATOM 464 C LYS A 60 45.853 10.413 24.985 1.00 22.33 C
836 ATOM 465 O LYS A 60 45.000 10.126 24.149 1.00 22.87 O
837 ATOM 466 CB LYS A 60 48.264 10.375 24.418 1.00 25.17 C
838 ATOM 467 CG LYS A 60 48.134 9.381 23.263 1.00 61.96 C
839 ATOM 468 CD LYS A 60 49.373 9.367 22.372 1.00 56.89 C
840 ATOM 469 CE LYS A 60 49.392 8.286 21.299 1.00100.00 C
841 ATOM 470 NZ LYS A 60 50.302 8.600 20.186 1.00 89.03 N
842 ATOM 471 N ASP A 61 45.798 9.985 26.257 1.00 22.94 N
843 ATOM 472 CA ASP A 61 44.692 9.162 26.739 1.00 22.71 C
844 ATOM 473 C ASP A 61 43.351 9.879 26.573 1.00 19.66 C
845 ATOM 474 O ASP A 61 42.364 9.257 26.170 1.00 17.33 O
846 ATOM 475 CB ASP A 61 44.860 8.772 28.218 1.00 23.74 C
847 ATOM 476 CG ASP A 61 46.010 7.850 28.507 1.00 64.79 C
848 ATOM 477 OD1 ASP A 61 46.549 7.332 27.429 1.00 82.49 O
849 ATOM 478 OD2 ASP A 61 46.395 7.611 29.640 1.00100.00 O
850 ATOM 479 N GLU A 62 43.329 11.180 26.959 1.00 22.30 N
851 ATOM 480 CA GLU A 62 42.158 12.046 26.850 1.00 14.66 C
852 ATOM 481 C GLU A 62 41.762 12.172 25.401 1.00 20.02 C
853 ATOM 482 O GLU A 62 40.598 12.098 25.053 1.00 22.69 O
854 ATOM 483 CB GLU A 62 42.462 13.410 27.433 1.00 14.95 C
855 ATOM 484 CG GLU A 62 42.434 13.304 28.964 1.00 16.28 C
856 ATOM 485 CD GLU A 62 42.845 14.575 29.635 1.00 25.29 C
857 ATOM 486 OE1 GLU A 62 43.515 15.428 29.091 1.00 24.53 O
858 ATOM 487 OE2 GLU A 62 42.401 14.664 30.851 1.00 25.80 O
859 ATOM 488 N ALA A 63 42.773 12.281 24.542 1.00 19.88 N
860 ATOM 489 CA ALA A 63 42.526 12.356 23.118 1.00 20.78 C
861 ATOM 490 C ALA A 63 41.857 11.089 22.591 1.00 19.02 C
862 ATOM 491 O ALA A 63 40.894 11.136 21.789 1.00 20.98 O
863 ATOM 492 CB ALA A 63 43.825 12.623 22.372 1.00 19.53 C
864 ATOM 493 N GLU A 64 42.398 9.951 23.037 1.00 15.76 N
865 ATOM 494 CA GLU A 64 41.887 8.665 22.632 1.00 11.48 C
866 ATOM 495 C GLU A 64 40.507 8.411 23.140 1.00 14.74 C
867 ATOM 496 O GLU A 64 39.676 7.792 22.457 1.00 17.41 O
868 ATOM 497 CB GLU A 64 42.872 7.539 22.941 1.00 21.49 C
869 ATOM 498 CG GLU A 64 43.980 7.577 21.875 1.00 27.26 C
870 ATOM 499 CD GLU A 64 45.236 6.865 22.272 1.00 33.61 C
871 ATOM 500 OE1 GLU A 64 45.352 6.259 23.329 1.00 89.79 O
872 ATOM 501 OE2 GLU A 64 46.181 6.972 21.361 1.00 71.20 O
873 ATOM 502 N LYS A 65 40.257 8.925 24.335 1.00 15.72 N
874 ATOM 503 CA LYS A 65 38.937 8.763 24.887 1.00 19.29 C
875 ATOM 504 C LYS A 65 37.887 9.505 24.061 1.00 17.36 C
876 ATOM 505 O LYS A 65 36.848 8.931 23.711 1.00 19.52 O
877 ATOM 506 CB LYS A 65 38.853 9.156 26.322 1.00 21.86 C
878 ATOM 507 CG LYS A 65 37.511 8.710 26.824 1.00 40.49 C
879 ATOM 508 CD LYS A 65 37.406 8.658 28.318 1.00 81.41 C
880 ATOM 509 CE LYS A 65 35.980 8.342 28.699 1.00 98.24 C
881 ATOM 510 NZ LYS A 65 35.774 8.349 30.144 1.00 56.20 N
882 ATOM 511 N LEU A 66 38.187 10.777 23.709 1.00 25.06 N
883 ATOM 512 CA LEU A 66 37.290 11.565 22.859 1.00 11.34 C
884 ATOM 513 C LEU A 66 37.071 10.830 21.542 1.00 13.54 C
885 ATOM 514 O LEU A 66 35.946 10.688 21.066 1.00 13.64 O
886 ATOM 515 CB LEU A 66 37.774 13.021 22.537 1.00 11.67 C
887 ATOM 516 CG LEU A 66 37.863 13.971 23.732 1.00 23.23 C
888 ATOM 517 CD1 LEU A 66 38.558 15.272 23.302 1.00 14.38 C
889 ATOM 518 CD2 LEU A 66 36.472 14.255 24.300 1.00 20.69 C
890 ATOM 519 N PHE A 67 38.183 10.336 20.980 1.00 15.25 N
891 ATOM 520 CA PHE A 67 38.165 9.593 19.743 1.00 12.89 C
892 ATOM 521 C PHE A 67 37.243 8.383 19.848 1.00 14.63 C
893 ATOM 522 O PHE A 67 36.429 8.189 18.968 1.00 15.21 O
894 ATOM 523 CB PHE A 67 39.584 9.194 19.348 1.00 14.91 C
895 ATOM 524 CG PHE A 67 39.746 8.556 17.973 1.00 21.80 C
896 ATOM 525 CD1 PHE A 67 39.008 9.013 16.880 1.00 18.34 C
897 ATOM 526 CD2 PHE A 67 40.678 7.536 17.777 1.00 12.01 C
898 ATOM 527 CE1 PHE A 67 39.171 8.487 15.598 1.00 18.08 C
899 ATOM 528 CE2 PHE A 67 40.888 7.026 16.501 1.00 18.96 C
900 ATOM 529 CZ PHE A 67 40.128 7.488 15.421 1.00 13.66 C
901 ATOM 530 N ASN A 68 37.361 7.582 20.926 1.00 16.35 N
902 ATOM 531 CA ASN A 68 36.483 6.427 21.106 1.00 15.02 C
903 ATOM 532 C ASN A 68 35.012 6.838 21.128 1.00 20.87 C
904 ATOM 533 O ASN A 68 34.126 6.202 20.557 1.00 24.21 O
905 ATOM 534 CB ASN A 68 36.785 5.659 22.406 1.00 23.46 C
906 ATOM 535 CG ASN A 68 37.962 4.718 22.241 1.00 49.91 C
907 ATOM 536 OD1 ASN A 68 38.084 4.050 21.221 1.00 32.79 O
908 ATOM 537 ND2 ASN A 68 38.856 4.690 23.219 1.00 29.67 N
909 ATOM 538 N GLN A 69 34.721 7.915 21.821 1.00 12.87 N
910 ATOM 539 CA GLN A 69 33.342 8.387 21.871 1.00 12.55 C
911 ATOM 540 C GLN A 69 32.809 8.834 20.532 1.00 13.93 C
912 ATOM 541 O GLN A 69 31.649 8.630 20.209 1.00 17.87 O
913 ATOM 542 CB GLN A 69 33.238 9.591 22.791 1.00 17.30 C
914 ATOM 543 CG GLN A 69 33.541 9.156 24.227 1.00 19.29 C
915 ATOM 544 CD GLN A 69 33.663 10.323 25.198 1.00 43.25 C
916 ATOM 545 OE1 GLN A 69 33.856 10.111 26.382 1.00 23.56 O
917 ATOM 546 NE2 GLN A 69 33.547 11.563 24.722 1.00 16.75 N
918 ATOM 547 N ASP A 70 33.660 9.531 19.773 1.00 15.39 N
919 ATOM 548 CA ASP A 70 33.254 10.071 18.486 1.00 17.43 C
920 ATOM 549 C ASP A 70 32.976 9.019 17.419 1.00 18.58 C
921 ATOM 550 O ASP A 70 32.090 9.204 16.582 1.00 14.46 O
922 ATOM 551 CB ASP A 70 34.256 11.127 17.963 1.00 11.74 C
923 ATOM 552 CG ASP A 70 34.279 12.393 18.777 1.00 15.89 C
924 ATOM 553 OD1 ASP A 70 33.414 12.722 19.558 1.00 20.66 O
925 ATOM 554 OD2 ASP A 70 35.346 13.093 18.566 1.00 15.16 O
926 ATOM 555 N VAL A 71 33.751 7.920 17.421 1.00 18.50 N
927 ATOM 556 CA VAL A 71 33.559 6.842 16.433 1.00 19.24 C
928 ATOM 557 C VAL A 71 32.224 6.183 16.721 1.00 14.55 C
929 ATOM 558 O VAL A 71 31.362 6.030 15.854 1.00 17.79 O
930 ATOM 559 CB VAL A 71 34.693 5.816 16.417 1.00 16.55 C
931 ATOM 560 CG1 VAL A 71 34.277 4.599 15.608 1.00 17.29 C
932 ATOM 561 CG2 VAL A 71 35.963 6.413 15.825 1.00 12.89 C
933 ATOM 562 N ASP A 72 32.038 5.885 17.991 1.00 14.93 N
934 ATOM 563 CA ASP A 72 30.796 5.316 18.498 1.00 18.54 C
935 ATOM 564 C ASP A 72 29.565 6.156 18.133 1.00 21.72 C
936 ATOM 565 O ASP A 72 28.571 5.695 17.570 1.00 19.49 O
937 ATOM 566 CB ASP A 72 30.913 5.172 20.012 1.00 14.19 C
938 ATOM 567 CG ASP A 72 29.947 4.152 20.527 1.00 38.77 C
939 ATOM 568 OD1 ASP A 72 29.894 3.090 19.780 1.00 74.99 O
940 ATOM 569 OD2 ASP A 72 29.276 4.307 21.509 1.00 33.41 O
941 ATOM 570 N ALA A 73 29.641 7.425 18.452 1.00 22.32 N
942 ATOM 571 CA ALA A 73 28.584 8.341 18.127 1.00 25.72 C
943 ATOM 572 C ALA A 73 28.370 8.335 16.622 1.00 27.29 C
944 ATOM 573 O ALA A 73 27.235 8.395 16.159 1.00 25.78 O
945 ATOM 574 CB ALA A 73 28.968 9.741 18.570 1.00 25.35 C
946 ATOM 575 N ALA A 74 29.466 8.279 15.840 1.00 19.35 N
947 ATOM 576 CA ALA A 74 29.320 8.267 14.373 1.00 21.41 C
948 ATOM 577 C ALA A 74 28.511 7.049 13.908 1.00 26.71 C
949 ATOM 578 O ALA A 74 27.567 7.147 13.138 1.00 17.66 O
950 ATOM 579 CB ALA A 74 30.648 8.345 13.644 1.00 15.18 C
951 ATOM 580 N VAL A 75 28.875 5.879 14.397 1.00 18.52 N
952 ATOM 581 CA VAL A 75 28.157 4.662 14.048 1.00 34.76 C
953 ATOM 582 C VAL A 75 26.642 4.742 14.399 1.00 29.52 C
954 ATOM 583 O VAL A 75 25.753 4.466 13.557 1.00 26.22 O
955 ATOM 584 CB VAL A 75 28.842 3.395 14.609 1.00 26.57 C
956 ATOM 585 CG1 VAL A 75 28.074 2.140 14.153 1.00 23.01 C
957 ATOM 586 CG2 VAL A 75 30.289 3.328 14.116 1.00 22.48 C
958 ATOM 587 N ARG A 76 26.365 5.158 15.646 1.00 26.93 N
959 ATOM 588 CA ARG A 76 25.011 5.300 16.159 1.00 31.57 C
960 ATOM 589 C ARG A 76 24.175 6.325 15.344 1.00 29.12 C
961 ATOM 590 O ARG A 76 22.994 6.130 15.042 1.00 37.88 O
962 ATOM 591 CB ARG A 76 25.003 5.395 17.697 1.00 13.21 C
963 ATOM 592 CG ARG A 76 25.368 4.057 18.370 1.00 34.02 C
964 ATOM 593 CD ARG A 76 25.426 4.092 19.916 1.00 45.67 C
965 ATOM 594 NE ARG A 76 26.562 4.843 20.421 1.00 88.90 N
966 ATOM 595 CZ ARG A 76 26.507 6.136 20.730 1.00100.00 C
967 ATOM 596 NH1 ARG A 76 25.382 6.837 20.600 1.00100.00 N
968 ATOM 597 NH2 ARG A 76 27.603 6.761 21.166 1.00 50.79 N
969 ATOM 598 N GLY A 77 24.813 7.402 14.883 1.00 18.81 N
970 ATOM 599 CA GLY A 77 24.114 8.359 14.038 1.00 25.66 C
971 ATOM 600 C GLY A 77 23.700 7.699 12.730 1.00 28.70 C
972 ATOM 601 O GLY A 77 22.611 7.888 12.241 1.00 27.63 O
973 ATOM 602 N ILE A 78 24.592 6.919 12.149 1.00 16.26 N
974 ATOM 603 CA ILE A 78 24.247 6.208 10.952 1.00 30.27 C
975 ATOM 604 C ILE A 78 23.085 5.254 11.256 1.00 24.09 C
976 ATOM 605 O ILE A 78 22.062 5.220 10.571 1.00 23.09 O
977 ATOM 606 CB ILE A 78 25.441 5.385 10.408 1.00 21.68 C
978 ATOM 607 CG1 ILE A 78 26.455 6.266 9.661 1.00 17.75 C
979 ATOM 608 CG2 ILE A 78 24.933 4.298 9.454 1.00 22.48 C
980 ATOM 609 CD1 ILE A 78 27.809 5.544 9.534 1.00 21.24 C
981 ATOM 610 N LEU A 79 23.220 4.441 12.301 1.00 22.22 N
982 ATOM 611 CA LEU A 79 22.162 3.484 12.575 1.00 21.10 C
983 ATOM 612 C LEU A 79 20.792 4.068 12.870 1.00 35.05 C
984 ATOM 613 O LEU A 79 19.785 3.395 12.682 1.00 36.92 O
985 ATOM 614 CB LEU A 79 22.555 2.376 13.548 1.00 17.23 C
986 ATOM 615 CG LEU A 79 23.788 1.620 13.111 1.00 22.97 C
987 ATOM 616 CD1 LEU A 79 24.184 0.732 14.271 1.00 19.01 C
988 ATOM 617 CD2 LEU A 79 23.490 0.783 11.875 1.00 27.41 C
989 ATOM 618 N ARG A 80 20.764 5.317 13.340 1.00 28.53 N
990 ATOM 619 CA ARG A 80 19.538 6.046 13.698 1.00 24.66 C
991 ATOM 620 C ARG A 80 18.939 6.796 12.543 1.00 42.44 C
992 ATOM 621 O ARG A 80 17.824 7.289 12.623 1.00 35.45 O
993 ATOM 622 CB ARG A 80 19.870 7.145 14.687 1.00 37.22 C
994 ATOM 623 CG ARG A 80 19.987 6.650 16.096 1.00 54.10 C
995 ATOM 624 CD ARG A 80 19.717 7.757 17.104 1.00100.00 C
996 ATOM 625 NE ARG A 80 20.938 8.140 17.785 1.00100.00 N
997 ATOM 626 CZ ARG A 80 21.699 9.171 17.425 1.00100.00 C
998 ATOM 627 NH1 ARG A 80 21.397 9.975 16.394 1.00 42.83 N
999 ATOM 628 NH2 ARG A 80 22.801 9.385 18.120 1.00 48.12 N
1000 ATOM 629 N ASN A 81 19.730 6.971 11.508 1.00 19.85 N
1001 ATOM 630 CA ASN A 81 19.289 7.729 10.380 1.00 17.42 C
1002 ATOM 631 C ASN A 81 18.554 6.892 9.329 1.00 56.20 C
1003 ATOM 632 O ASN A 81 19.086 5.941 8.766 1.00 40.51 O
1004 ATOM 633 CB ASN A 81 20.473 8.493 9.816 1.00 21.30 C
1005 ATOM 634 CG ASN A 81 20.025 9.486 8.788 1.00 39.12 C
1006 ATOM 635 OD1 ASN A 81 19.372 9.114 7.815 1.00 41.85 O
1007 ATOM 636 ND2 ASN A 81 20.334 10.753 9.015 1.00 33.71 N
1008 ATOM 637 N ALA A 82 17.299 7.239 9.068 1.00 27.37 N
1009 ATOM 638 CA ALA A 82 16.503 6.468 8.115 1.00 29.47 C
1010 ATOM 639 C ALA A 82 17.049 6.437 6.704 1.00 26.20 C
1011 ATOM 640 O ALA A 82 16.814 5.493 5.975 1.00 35.59 O
1012 ATOM 641 CB ALA A 82 15.034 6.840 8.143 1.00 25.93 C
1013 ATOM 642 N LYS A 83 17.777 7.465 6.303 1.00 26.55 N
1014 ATOM 643 CA LYS A 83 18.366 7.504 4.970 1.00 31.67 C
1015 ATOM 644 C LYS A 83 19.706 6.788 4.898 1.00 24.49 C
1016 ATOM 645 O LYS A 83 20.104 6.301 3.845 1.00 30.19 O
1017 ATOM 646 CB LYS A 83 18.630 8.925 4.509 1.00 42.58 C
1018 ATOM 647 CG LYS A 83 17.483 9.553 3.754 1.00 72.46 C
1019 ATOM 648 CD LYS A 83 16.532 10.265 4.697 1.00100.00 C
1020 ATOM 649 CE LYS A 83 15.575 11.195 3.968 1.00100.00 C
1021 ATOM 650 NZ LYS A 83 15.547 10.980 2.507 1.00100.00 N
1022 ATOM 651 N LEU A 84 20.444 6.781 6.002 1.00 28.42 N
1023 ATOM 652 CA LEU A 84 21.778 6.189 6.000 1.00 32.20 C
1024 ATOM 653 C LEU A 84 21.808 4.678 6.305 1.00 15.82 C
1025 ATOM 654 O LEU A 84 22.561 3.919 5.712 1.00 24.82 O
1026 ATOM 655 CB LEU A 84 22.736 6.946 6.960 1.00 17.77 C
1027 ATOM 656 CG LEU A 84 22.937 8.420 6.623 1.00 26.26 C
1028 ATOM 657 CD1 LEU A 84 23.885 9.039 7.652 1.00 20.83 C
1029 ATOM 658 CD2 LEU A 84 23.552 8.536 5.237 1.00 22.71 C
1030 ATOM 659 N LYS A 85 21.000 4.276 7.273 1.00 18.53 N
1031 ATOM 660 CA LYS A 85 20.943 2.915 7.721 1.00 16.88 C
1032 ATOM 661 C LYS A 85 20.847 1.816 6.660 1.00 16.55 C
1033 ATOM 662 O LYS A 85 21.587 0.818 6.695 1.00 16.90 O
1034 ATOM 663 CB LYS A 85 19.945 2.741 8.841 1.00 22.73 C
1035 ATOM 664 CG LYS A 85 20.019 1.315 9.349 1.00 22.44 C
1036 ATOM 665 CD LYS A 85 19.281 1.081 10.646 1.00 26.97 C
1037 ATOM 666 CE LYS A 85 19.231 -0.393 10.967 1.00 28.52 C
1038 ATOM 667 NZ LYS A 85 18.413 -1.099 9.986 1.00 51.85 N
1039 ATOM 668 N PRO A 86 19.907 1.954 5.740 1.00 20.80 N
1040 ATOM 669 CA PRO A 86 19.709 0.969 4.681 1.00 44.79 C
1041 ATOM 670 C PRO A 86 20.944 0.846 3.802 1.00 21.99 C
1042 ATOM 671 O PRO A 86 21.346 -0.250 3.443 1.00 19.98 O
1043 ATOM 672 CB PRO A 86 18.498 1.426 3.856 1.00 30.45 C
1044 ATOM 673 CG PRO A 86 17.882 2.611 4.606 1.00 40.06 C
1045 ATOM 674 CD PRO A 86 18.851 2.997 5.724 1.00 23.35 C
1046 ATOM 675 N VAL A 87 21.559 1.984 3.477 1.00 16.40 N
1047 ATOM 676 CA VAL A 87 22.779 1.970 2.685 1.00 21.58 C
1048 ATOM 677 C VAL A 87 23.918 1.259 3.429 1.00 15.70 C
1049 ATOM 678 O VAL A 87 24.570 0.348 2.941 1.00 18.50 O
1050 ATOM 679 CB VAL A 87 23.218 3.377 2.261 1.00 26.61 C
1051 ATOM 680 CG1 VAL A 87 24.347 3.243 1.235 1.00 17.57 C
1052 ATOM 681 CG2 VAL A 87 22.034 4.168 1.691 1.00 19.39 C
1053 ATOM 682 N TYR A 88 24.139 1.675 4.660 1.00 11.72 N
1054 ATOM 683 CA TYR A 88 25.151 1.117 5.524 1.00 17.40 C
1055 ATOM 684 C TYR A 88 25.037 -0.417 5.685 1.00 27.45 C
1056 ATOM 685 O TYR A 88 26.044 -1.148 5.632 1.00 22.16 O
1057 ATOM 686 CB TYR A 88 25.041 1.855 6.891 1.00 13.28 C
1058 ATOM 687 CG TYR A 88 26.129 1.464 7.843 1.00 21.29 C
1059 ATOM 688 CD1 TYR A 88 27.389 2.057 7.778 1.00 17.25 C
1060 ATOM 689 CD2 TYR A 88 25.917 0.475 8.804 1.00 22.51 C
1061 ATOM 690 CE1 TYR A 88 28.408 1.697 8.660 1.00 20.79 C
1062 ATOM 691 CE2 TYR A 88 26.922 0.110 9.700 1.00 43.16 C
1063 ATOM 692 CZ TYR A 88 28.171 0.729 9.638 1.00 23.05 C
1064 ATOM 693 OH TYR A 88 29.176 0.343 10.506 1.00 27.73 O
1065 ATOM 694 N ASP A 89 23.782 -0.882 5.893 1.00 21.82 N
1066 ATOM 695 CA ASP A 89 23.466 -2.311 6.083 1.00 13.88 C
1067 ATOM 696 C ASP A 89 23.774 -3.073 4.843 1.00 18.43 C
1068 ATOM 697 O ASP A 89 24.144 -4.220 4.905 1.00 17.43 O
1069 ATOM 698 CB ASP A 89 21.984 -2.545 6.424 1.00 25.60 C
1070 ATOM 699 CG ASP A 89 21.714 -2.291 7.869 1.00 24.51 C
1071 ATOM 700 OD1 ASP A 89 22.790 -2.075 8.562 1.00 23.23 O
1072 ATOM 701 OD2 ASP A 89 20.615 -2.281 8.329 1.00 28.70 O
1073 ATOM 702 N SER A 90 23.623 -2.418 3.708 1.00 13.20 N
1074 ATOM 703 CA SER A 90 23.911 -3.101 2.471 1.00 12.12 C
1075 ATOM 704 C SER A 90 25.388 -3.315 2.208 1.00 15.48 C
1076 ATOM 705 O SER A 90 25.780 -4.113 1.337 1.00 16.42 O
1077 ATOM 706 CB SER A 90 23.274 -2.399 1.263 1.00 18.74 C
1078 ATOM 707 OG SER A 90 24.033 -1.257 0.848 1.00 16.30 O
1079 ATOM 708 N LEU A 91 26.234 -2.558 2.896 1.00 11.51 N
1080 ATOM 709 CA LEU A 91 27.684 -2.597 2.589 1.00 14.46 C
1081 ATOM 710 C LEU A 91 28.479 -3.692 3.236 1.00 21.75 C
1082 ATOM 711 O LEU A 91 28.106 -4.174 4.306 1.00 16.67 O
1083 ATOM 712 CB LEU A 91 28.358 -1.282 3.046 1.00 10.52 C
1084 ATOM 713 CG LEU A 91 27.800 -0.013 2.373 1.00 18.70 C
1085 ATOM 714 CD1 LEU A 91 28.394 1.233 3.034 1.00 20.68 C
1086 ATOM 715 CD2 LEU A 91 28.225 -0.036 0.901 1.00 15.07 C
1087 ATOM 716 N ASP A 92 29.638 -4.001 2.637 1.00 14.50 N
1088 ATOM 717 CA ASP A 92 30.570 -4.929 3.263 1.00 9.63 C
1089 ATOM 718 C ASP A 92 31.375 -4.180 4.365 1.00 20.30 C
1090 ATOM 719 O ASP A 92 31.286 -2.973 4.519 1.00 14.77 O
1091 ATOM 720 CB ASP A 92 31.570 -5.521 2.292 1.00 12.00 C
1092 ATOM 721 CG ASP A 92 32.340 -4.436 1.614 1.00 25.31 C
1093 ATOM 722 OD1 ASP A 92 31.669 -3.914 0.623 1.00 17.16 O
1094 ATOM 723 OD2 ASP A 92 33.435 -4.058 1.970 1.00 15.88 O
1095 ATOM 724 N ALA A 93 32.181 -4.898 5.124 1.00 16.69 N
1096 ATOM 725 CA ALA A 93 32.938 -4.332 6.233 1.00 16.60 C
1097 ATOM 726 C ALA A 93 33.950 -3.221 5.930 1.00 20.46 C
1098 ATOM 727 O ALA A 93 34.065 -2.294 6.709 1.00 19.11 O
1099 ATOM 728 CB ALA A 93 33.398 -5.361 7.267 1.00 25.58 C
1100 ATOM 729 N VAL A 94 34.677 -3.316 4.827 1.00 14.58 N
1101 ATOM 730 CA VAL A 94 35.621 -2.285 4.450 1.00 20.35 C
1102 ATOM 731 C VAL A 94 34.865 -0.986 4.084 1.00 16.44 C
1103 ATOM 732 O VAL A 94 35.141 0.098 4.592 1.00 18.04 O
1104 ATOM 733 CB VAL A 94 36.591 -2.786 3.360 1.00 20.00 C
1105 ATOM 734 CG1 VAL A 94 37.584 -1.694 2.890 1.00 12.72 C
1106 ATOM 735 CG2 VAL A 94 37.391 -3.957 3.955 1.00 17.29 C
1107 ATOM 736 N ARG A 95 33.877 -1.112 3.205 1.00 16.13 N
1108 ATOM 737 CA ARG A 95 33.057 0.003 2.766 1.00 18.34 C
1109 ATOM 738 C ARG A 95 32.322 0.629 3.917 1.00 16.69 C
1110 ATOM 739 O ARG A 95 32.102 1.840 3.947 1.00 19.31 O
1111 ATOM 740 CB ARG A 95 32.123 -0.360 1.611 1.00 10.71 C
1112 ATOM 741 CG ARG A 95 32.908 -0.706 0.358 1.00 9.17 C
1113 ATOM 742 CD ARG A 95 31.974 -1.064 -0.781 1.00 13.72 C
1114 ATOM 743 NE ARG A 95 32.654 -1.163 -2.056 1.00 15.21 N
1115 ATOM 744 CZ ARG A 95 33.124 -2.305 -2.552 1.00 15.67 C
1116 ATOM 745 NH1 ARG A 95 33.001 -3.467 -1.884 1.00 17.38 N
1117 ATOM 746 NH2 ARG A 95 33.754 -2.273 -3.733 1.00 16.81 N
1118 ATOM 747 N ARG A 96 31.948 -0.180 4.899 1.00 15.75 N
1119 ATOM 748 CA ARG A 96 31.299 0.408 6.066 1.00 17.82 C
1120 ATOM 749 C ARG A 96 32.250 1.391 6.778 1.00 17.29 C
1121 ATOM 750 O ARG A 96 31.824 2.415 7.297 1.00 16.30 O
1122 ATOM 751 CB ARG A 96 30.787 -0.623 7.049 1.00 15.00 C
1123 ATOM 752 CG ARG A 96 29.587 -1.370 6.531 1.00 15.25 C
1124 ATOM 753 CD ARG A 96 29.034 -2.348 7.568 1.00 19.44 C
1125 ATOM 754 NE ARG A 96 27.897 -3.095 7.023 1.00 24.12 N
1126 ATOM 755 CZ ARG A 96 27.236 -4.058 7.634 1.00 36.07 C
1127 ATOM 756 NH1 ARG A 96 27.551 -4.415 8.855 1.00 27.73 N
1128 ATOM 757 NH2 ARG A 96 26.223 -4.669 7.000 1.00 19.51 N
1129 ATOM 758 N ALA A 97 33.545 1.081 6.794 1.00 12.09 N
1130 ATOM 759 CA ALA A 97 34.514 1.963 7.426 1.00 12.23 C
1131 ATOM 760 C ALA A 97 34.568 3.295 6.640 1.00 10.15 C
1132 ATOM 761 O ALA A 97 34.682 4.376 7.229 1.00 16.72 O
1133 ATOM 762 CB ALA A 97 35.891 1.282 7.469 1.00 9.70 C
1134 ATOM 763 N ALA A 98 34.470 3.211 5.299 1.00 12.70 N
1135 ATOM 764 CA ALA A 98 34.469 4.430 4.496 1.00 11.80 C
1136 ATOM 765 C ALA A 98 33.248 5.294 4.842 1.00 19.49 C
1137 ATOM 766 O ALA A 98 33.316 6.531 4.864 1.00 16.39 O
1138 ATOM 767 CB ALA A 98 34.543 4.153 2.990 1.00 10.43 C
1139 ATOM 768 N ALA A 99 32.116 4.653 5.086 1.00 10.22 N
1140 ATOM 769 CA ALA A 99 30.915 5.386 5.412 1.00 10.61 C
1141 ATOM 770 C ALA A 99 31.067 6.087 6.733 1.00 11.60 C
1142 ATOM 771 O ALA A 99 30.606 7.206 6.887 1.00 16.32 O
1143 ATOM 772 CB ALA A 99 29.678 4.452 5.471 1.00 13.70 C
1144 ATOM 773 N ILE A 100 31.671 5.403 7.686 1.00 12.58 N
1145 ATOM 774 CA ILE A 100 31.858 5.948 9.025 1.00 10.80 C
1146 ATOM 775 C ILE A 100 32.767 7.177 8.951 1.00 19.53 C
1147 ATOM 776 O ILE A 100 32.554 8.215 9.608 1.00 18.59 O
1148 ATOM 777 CB ILE A 100 32.380 4.905 10.032 1.00 15.60 C
1149 ATOM 778 CG1 ILE A 100 31.350 3.779 10.288 1.00 10.92 C
1150 ATOM 779 CG2 ILE A 100 32.754 5.593 11.335 1.00 13.67 C
1151 ATOM 780 CD1 ILE A 100 31.886 2.561 11.067 1.00 11.84 C
1152 ATOM 781 N ASN A 101 33.778 7.051 8.100 1.00 14.84 N
1153 ATOM 782 CA ASN A 101 34.745 8.113 7.898 1.00 11.62 C
1154 ATOM 783 C ASN A 101 34.044 9.385 7.418 1.00 19.79 C
1155 ATOM 784 O ASN A 101 34.222 10.458 7.973 1.00 18.73 O
1156 ATOM 785 CB ASN A 101 35.823 7.605 6.927 1.00 10.84 C
1157 ATOM 786 CG ASN A 101 37.050 8.474 6.866 1.00 15.63 C
1158 ATOM 787 OD1 ASN A 101 36.928 9.678 6.759 1.00 18.55 O
1159 ATOM 788 ND2 ASN A 101 38.217 7.871 6.845 1.00 12.12 N
1160 ATOM 789 N MET A 102 33.207 9.269 6.408 1.00 11.67 N
1161 ATOM 790 CA MET A 102 32.482 10.437 5.912 1.00 15.76 C
1162 ATOM 791 C MET A 102 31.652 11.107 7.007 1.00 16.45 C
1163 ATOM 792 O MET A 102 31.627 12.325 7.138 1.00 15.82 O
1164 ATOM 793 CB MET A 102 31.493 10.044 4.783 1.00 20.97 C
1165 ATOM 794 CG MET A 102 32.186 9.795 3.473 1.00 21.80 C
1166 ATOM 795 SD MET A 102 31.029 9.536 2.114 1.00 24.03 S
1167 ATOM 796 CE MET A 102 30.616 11.266 1.757 1.00 20.46 C
1168 ATOM 797 N VAL A 103 30.911 10.279 7.770 1.00 15.38 N
1169 ATOM 798 CA VAL A 103 30.050 10.805 8.834 1.00 20.09 C
1170 ATOM 799 C VAL A 103 30.876 11.490 9.905 1.00 25.46 C
1171 ATOM 800 O VAL A 103 30.508 12.554 10.361 1.00 27.04 O
1172 ATOM 801 CB VAL A 103 29.070 9.786 9.420 1.00 14.00 C
1173 ATOM 802 CG1 VAL A 103 28.325 10.369 10.616 1.00 25.01 C
1174 ATOM 803 CG2 VAL A 103 28.034 9.392 8.379 1.00 20.89 C
1175 ATOM 804 N PHE A 104 32.005 10.889 10.293 1.00 19.14 N
1176 ATOM 805 CA PHE A 104 32.872 11.476 11.299 1.00 13.21 C
1177 ATOM 806 C PHE A 104 33.356 12.874 10.889 1.00 26.63 C
1178 ATOM 807 O PHE A 104 33.492 13.782 11.692 1.00 22.02 O
1179 ATOM 808 CB PHE A 104 34.093 10.567 11.468 1.00 18.09 C
1180 ATOM 809 CG PHE A 104 35.038 10.997 12.563 1.00 14.36 C
1181 ATOM 810 CD1 PHE A 104 36.003 11.977 12.336 1.00 14.41 C
1182 ATOM 811 CD2 PHE A 104 34.999 10.364 13.810 1.00 14.69 C
1183 ATOM 812 CE1 PHE A 104 36.871 12.333 13.368 1.00 17.24 C
1184 ATOM 813 CE2 PHE A 104 35.882 10.692 14.841 1.00 16.70 C
1185 ATOM 814 CZ PHE A 104 36.822 11.695 14.609 1.00 18.66 C
1186 ATOM 815 N GLN A 105 33.650 13.023 9.610 1.00 19.39 N
1187 ATOM 816 CA GLN A 105 34.162 14.256 9.042 1.00 23.77 C
1188 ATOM 817 C GLN A 105 33.095 15.272 8.780 1.00 23.01 C
1189 ATOM 818 O GLN A 105 33.281 16.440 9.018 1.00 20.36 O
1190 ATOM 819 CB GLN A 105 34.935 14.033 7.691 1.00 14.69 C
1191 ATOM 820 CG GLN A 105 35.501 15.346 7.065 1.00 18.90 C
1192 ATOM 821 CD GLN A 105 36.141 15.205 5.687 1.00 21.15 C
1193 ATOM 822 OE1 GLN A 105 36.077 14.150 5.074 1.00 24.98 O
1194 ATOM 823 NE2 GLN A 105 36.790 16.266 5.191 1.00 20.42 N
1195 ATOM 824 N MET A 106 32.010 14.863 8.196 1.00 20.44 N
1196 ATOM 825 CA MET A 106 31.069 15.847 7.804 1.00 15.04 C
1197 ATOM 826 C MET A 106 29.721 15.865 8.437 1.00 27.88 C
1198 ATOM 827 O MET A 106 28.908 16.705 8.099 1.00 25.88 O
1199 ATOM 828 CB MET A 106 31.086 16.037 6.273 1.00 19.27 C
1200 ATOM 829 CG MET A 106 30.357 15.016 5.452 1.00 27.03 C
1201 ATOM 830 SD MET A 106 30.843 15.240 3.731 1.00 46.54 S
1202 ATOM 831 CE MET A 106 32.340 14.236 3.744 1.00 50.12 C
1203 ATOM 832 N GLY A 107 29.518 14.974 9.370 1.00 20.92 N
1204 ATOM 833 CA GLY A 107 28.281 14.924 10.075 1.00 19.11 C
1205 ATOM 834 C GLY A 107 27.226 14.213 9.275 1.00 15.72 C
1206 ATOM 835 O GLY A 107 27.304 14.071 8.054 1.00 26.01 O
1207 ATOM 836 N GLU A 108 26.228 13.791 10.004 1.00 26.59 N
1208 ATOM 837 CA GLU A 108 25.158 13.030 9.436 1.00 35.89 C
1209 ATOM 838 C GLU A 108 24.253 13.778 8.467 1.00 39.35 C
1210 ATOM 839 O GLU A 108 23.744 13.200 7.509 1.00 32.42 O
1211 ATOM 840 CB GLU A 108 24.468 12.224 10.535 1.00 39.28 C
1212 ATOM 841 CG GLU A 108 23.001 12.550 10.767 1.00 61.51 C
1213 ATOM 842 CD GLU A 108 22.374 11.330 11.347 1.00 96.62 C
1214 ATOM 843 OE1 GLU A 108 23.242 10.349 11.437 1.00100.00 O
1215 ATOM 844 OE2 GLU A 108 21.201 11.247 11.660 1.00 84.48 O
1216 ATOM 845 N THR A 109 24.075 15.072 8.692 1.00 25.62 N
1217 ATOM 846 CA THR A 109 23.259 15.859 7.805 1.00 45.56 C
1218 ATOM 847 C THR A 109 23.964 15.971 6.476 1.00 48.67 C
1219 ATOM 848 O THR A 109 23.389 15.638 5.431 1.00 61.56 O
1220 ATOM 849 CB THR A 109 22.894 17.229 8.412 1.00 51.76 C
1221 ATOM 850 OG1 THR A 109 22.213 16.993 9.617 1.00 43.74 O
1222 ATOM 851 CG2 THR A 109 21.995 18.016 7.466 1.00 61.31 C
1223 ATOM 852 N GLY A 110 25.238 16.385 6.561 1.00 33.86 N
1224 ATOM 853 CA GLY A 110 26.111 16.517 5.408 1.00 55.47 C
1225 ATOM 854 C GLY A 110 25.994 15.316 4.475 1.00 36.88 C
1226 ATOM 855 O GLY A 110 25.535 15.453 3.347 1.00 43.16 O
1227 ATOM 856 N VAL A 111 26.355 14.128 4.981 1.00 40.30 N
1228 ATOM 857 CA VAL A 111 26.317 12.895 4.191 1.00 28.62 C
1229 ATOM 858 C VAL A 111 24.957 12.636 3.600 1.00 46.29 C
1230 ATOM 859 O VAL A 111 24.826 12.299 2.414 1.00 25.02 O
1231 ATOM 860 CB VAL A 111 26.731 11.704 5.034 1.00 25.41 C
1232 ATOM 861 CG1 VAL A 111 26.796 10.466 4.155 1.00 36.74 C
1233 ATOM 862 CG2 VAL A 111 28.130 11.955 5.548 1.00 28.84 C
1234 ATOM 863 N ALA A 112 23.976 12.774 4.495 1.00 42.64 N
1235 ATOM 864 CA ALA A 112 22.595 12.570 4.172 1.00 47.51 C
1236 ATOM 865 C ALA A 112 22.202 13.334 2.904 1.00100.00 C
1237 ATOM 866 O ALA A 112 21.379 12.863 2.115 1.00 55.37 O
1238 ATOM 867 CB ALA A 112 21.672 12.729 5.385 1.00 49.99 C
1239 ATOM 868 N GLY A 113 22.837 14.484 2.657 1.00 29.32 N
1240 ATOM 869 CA GLY A 113 22.543 15.217 1.431 1.00 53.98 C
1241 ATOM 870 C GLY A 113 23.127 14.606 0.127 1.00100.00 C
1242 ATOM 871 O GLY A 113 22.789 15.057 -0.964 1.00 55.73 O
1243 ATOM 872 N PHE A 114 23.995 13.596 0.218 1.00 38.08 N
1244 ATOM 873 CA PHE A 114 24.592 12.938 -0.946 1.00 20.64 C
1245 ATOM 874 C PHE A 114 23.669 11.855 -1.495 1.00 29.87 C
1246 ATOM 875 O PHE A 114 24.096 10.752 -1.801 1.00 24.83 O
1247 ATOM 876 CB PHE A 114 25.879 12.223 -0.533 1.00 18.14 C
1248 ATOM 877 CG PHE A 114 27.088 13.123 -0.412 1.00 31.89 C
1249 ATOM 878 CD1 PHE A 114 27.080 14.206 0.467 1.00 43.75 C
1250 ATOM 879 CD2 PHE A 114 28.224 12.890 -1.190 1.00 38.12 C
1251 ATOM 880 CE1 PHE A 114 28.186 15.047 0.571 1.00 29.74 C
1252 ATOM 881 CE2 PHE A 114 29.334 13.734 -1.112 1.00 28.63 C
1253 ATOM 882 CZ PHE A 114 29.315 14.801 -0.209 1.00 25.59 C
1254 ATOM 883 N THR A 115 22.407 12.167 -1.570 1.00 19.39 N
1255 ATOM 884 CA THR A 115 21.353 11.294 -2.035 1.00 17.42 C
1256 ATOM 885 C THR A 115 21.696 10.412 -3.188 1.00 29.53 C
1257 ATOM 886 O THR A 115 21.531 9.202 -3.096 1.00 21.55 O
1258 ATOM 887 CB THR A 115 20.169 12.161 -2.460 1.00 31.28 C
1259 ATOM 888 OG1 THR A 115 19.826 12.996 -1.386 1.00 43.21 O
1260 ATOM 889 CG2 THR A 115 19.009 11.268 -2.853 1.00 29.68 C
1261 ATOM 890 N ASN A 116 22.102 11.020 -4.293 1.00 20.83 N
1262 ATOM 891 CA ASN A 116 22.476 10.251 -5.512 1.00 23.34 C
1263 ATOM 892 C ASN A 116 23.616 9.208 -5.351 1.00 20.98 C
1264 ATOM 893 O ASN A 116 23.521 8.072 -5.847 1.00 17.39 O
1265 ATOM 894 CB ASN A 116 22.644 11.153 -6.773 1.00 21.56 C
1266 ATOM 895 CG ASN A 116 21.467 12.130 -6.953 1.00 28.62 C
1267 ATOM 896 OD1 ASN A 116 20.297 11.803 -6.700 1.00 49.06 O
1268 ATOM 897 ND2 ASN A 116 21.766 13.348 -7.368 1.00 22.96 N
1269 ATOM 898 N SER A 117 24.709 9.598 -4.676 1.00 18.36 N
1270 ATOM 899 CA SER A 117 25.830 8.698 -4.422 1.00 15.59 C
1271 ATOM 900 C SER A 117 25.350 7.542 -3.527 1.00 17.44 C
1272 ATOM 901 O SER A 117 25.763 6.411 -3.695 1.00 19.29 O
1273 ATOM 902 CB SER A 117 26.972 9.400 -3.670 1.00 15.80 C
1274 ATOM 903 OG SER A 117 27.352 10.631 -4.265 1.00 23.33 O
1275 ATOM 904 N LEU A 118 24.501 7.881 -2.536 1.00 21.74 N
1276 ATOM 905 CA LEU A 118 23.950 6.915 -1.595 1.00 23.84 C
1277 ATOM 906 C LEU A 118 23.189 5.836 -2.340 1.00 20.18 C
1278 ATOM 907 O LEU A 118 23.337 4.646 -2.087 1.00 19.59 O
1279 ATOM 908 CB LEU A 118 23.046 7.532 -0.493 1.00 21.21 C
1280 ATOM 909 CG LEU A 118 23.766 8.446 0.527 1.00 40.05 C
1281 ATOM 910 CD1 LEU A 118 22.774 9.060 1.516 1.00 27.80 C
1282 ATOM 911 CD2 LEU A 118 24.869 7.712 1.291 1.00 17.17 C
1283 ATOM 912 N ARG A 119 22.376 6.263 -3.264 1.00 17.40 N
1284 ATOM 913 CA ARG A 119 21.604 5.357 -4.096 1.00 27.08 C
1285 ATOM 914 C ARG A 119 22.542 4.481 -4.900 1.00 28.08 C
1286 ATOM 915 O ARG A 119 22.323 3.274 -5.031 1.00 19.46 O
1287 ATOM 916 CB ARG A 119 20.681 6.129 -5.026 1.00 20.78 C
1288 ATOM 917 CG ARG A 119 19.707 5.246 -5.799 1.00 41.04 C
1289 ATOM 918 CD ARG A 119 18.817 6.070 -6.730 1.00100.00 C
1290 ATOM 919 NE ARG A 119 19.473 6.359 -8.004 1.00100.00 N
1291 ATOM 920 CZ ARG A 119 20.127 7.491 -8.287 1.00100.00 C
1292 ATOM 921 NH1 ARG A 119 20.232 8.498 -7.409 1.00100.00 N
1293 ATOM 922 NH2 ARG A 119 20.693 7.606 -9.489 1.00100.00 N
1294 ATOM 923 N MET A 120 23.613 5.083 -5.427 1.00 19.07 N
1295 ATOM 924 CA MET A 120 24.554 4.280 -6.192 1.00 21.09 C
1296 ATOM 925 C MET A 120 25.305 3.257 -5.338 1.00 12.69 C
1297 ATOM 926 O MET A 120 25.561 2.120 -5.725 1.00 19.29 O
1298 ATOM 927 CB MET A 120 25.509 5.083 -7.086 1.00 21.77 C
1299 ATOM 928 CG MET A 120 24.833 5.864 -8.195 1.00 24.00 C
1300 ATOM 929 SD MET A 120 25.999 7.103 -8.814 1.00 28.61 S
1301 ATOM 930 CE MET A 120 24.889 8.421 -9.326 1.00 23.36 C
1302 ATOM 931 N LEU A 121 25.676 3.649 -4.150 1.00 19.43 N
1303 ATOM 932 CA LEU A 121 26.370 2.717 -3.311 1.00 23.03 C
1304 ATOM 933 C LEU A 121 25.443 1.514 -2.997 1.00 16.95 C
1305 ATOM 934 O LEU A 121 25.838 0.354 -3.072 1.00 18.39 O
1306 ATOM 935 CB LEU A 121 26.876 3.420 -2.033 1.00 18.77 C
1307 ATOM 936 CG LEU A 121 28.054 4.403 -2.265 1.00 18.13 C
1308 ATOM 937 CD1 LEU A 121 28.221 5.245 -0.994 1.00 15.21 C
1309 ATOM 938 CD2 LEU A 121 29.352 3.634 -2.542 1.00 16.85 C
1310 ATOM 939 N GLN A 122 24.188 1.810 -2.636 1.00 15.66 N
1311 ATOM 940 CA GLN A 122 23.240 0.771 -2.288 1.00 24.95 C
1312 ATOM 941 C GLN A 122 23.049 -0.244 -3.417 1.00 32.45 C
1313 ATOM 942 O GLN A 122 22.833 -1.445 -3.192 1.00 24.38 O
1314 ATOM 943 CB GLN A 122 21.906 1.341 -1.760 1.00 14.11 C
1315 ATOM 944 CG GLN A 122 20.846 0.220 -1.553 1.00 22.59 C
1316 ATOM 945 CD GLN A 122 19.769 0.572 -0.558 1.00100.00 C
1317 ATOM 946 OE1 GLN A 122 19.436 1.755 -0.384 1.00 44.87 O
1318 ATOM 947 NE2 GLN A 122 19.211 -0.458 0.081 1.00100.00 N
1319 ATOM 948 N GLN A 123 23.147 0.259 -4.646 1.00 19.90 N
1320 ATOM 949 CA GLN A 123 22.983 -0.575 -5.814 1.00 17.56 C
1321 ATOM 950 C GLN A 123 24.268 -1.218 -6.171 1.00 27.29 C
1322 ATOM 951 O GLN A 123 24.272 -1.958 -7.136 1.00 25.77 O
1323 ATOM 952 CB GLN A 123 22.542 0.219 -7.041 1.00 17.43 C
1324 ATOM 953 CG GLN A 123 21.159 0.868 -6.874 1.00 23.32 C
1325 ATOM 954 CD GLN A 123 20.730 1.622 -8.137 1.00 42.21 C
1326 ATOM 955 OE1 GLN A 123 20.420 1.021 -9.169 1.00 61.53 O
1327 ATOM 956 NE2 GLN A 123 20.703 2.946 -8.063 1.00 64.54 N
1328 ATOM 957 N LYS A 124 25.351 -0.897 -5.432 1.00 14.68 N
1329 ATOM 958 CA LYS A 124 26.660 -1.469 -5.726 1.00 12.66 C
1330 ATOM 959 C LYS A 124 27.241 -1.116 -7.074 1.00 13.52 C
1331 ATOM 960 O LYS A 124 28.011 -1.893 -7.658 1.00 17.57 O
1332 ATOM 961 CB LYS A 124 26.793 -2.991 -5.505 1.00 28.07 C
1333 ATOM 962 CG LYS A 124 26.125 -3.456 -4.224 1.00 21.60 C
1334 ATOM 963 CD LYS A 124 26.652 -4.752 -3.624 1.00 17.75 C
1335 ATOM 964 CE LYS A 124 26.038 -4.986 -2.257 1.00 14.53 C
1336 ATOM 965 NZ LYS A 124 26.773 -4.327 -1.167 1.00 27.71 N
1337 ATOM 966 N ARG A 125 26.943 0.081 -7.531 1.00 17.33 N
1338 ATOM 967 CA ARG A 125 27.512 0.600 -8.762 1.00 19.48 C
1339 ATOM 968 C ARG A 125 28.750 1.424 -8.358 1.00 26.23 C
1340 ATOM 969 O ARG A 125 28.710 2.658 -8.241 1.00 15.71 O
1341 ATOM 970 CB ARG A 125 26.449 1.454 -9.439 1.00 21.29 C
1342 ATOM 971 CG ARG A 125 25.361 0.581 -10.051 1.00 27.26 C
1343 ATOM 972 CD ARG A 125 24.078 1.375 -10.264 1.00 31.44 C
1344 ATOM 973 NE ARG A 125 23.407 1.090 -11.528 1.00 70.52 N
1345 ATOM 974 CZ ARG A 125 22.439 0.167 -11.661 1.00100.00 C
1346 ATOM 975 NH1 ARG A 125 22.016 -0.598 -10.641 1.00100.00 N
1347 ATOM 976 NH2 ARG A 125 21.890 -0.010 -12.864 1.00 74.44 N
1348 ATOM 977 N TRP A 126 29.852 0.711 -8.086 1.00 19.37 N
1349 ATOM 978 CA TRP A 126 31.070 1.321 -7.554 1.00 28.09 C
1350 ATOM 979 C TRP A 126 31.767 2.407 -8.324 1.00 26.44 C
1351 ATOM 980 O TRP A 126 32.077 3.466 -7.773 1.00 22.81 O
1352 ATOM 981 CB TRP A 126 32.050 0.366 -6.882 1.00 17.00 C
1353 ATOM 982 CG TRP A 126 31.398 -0.796 -6.176 1.00 16.42 C
1354 ATOM 983 CD1 TRP A 126 31.539 -2.093 -6.534 1.00 18.91 C
1355 ATOM 984 CD2 TRP A 126 30.602 -0.781 -4.973 1.00 19.54 C
1356 ATOM 985 NE1 TRP A 126 30.893 -2.885 -5.648 1.00 17.31 N
1357 ATOM 986 CE2 TRP A 126 30.328 -2.121 -4.664 1.00 16.98 C
1358 ATOM 987 CE3 TRP A 126 30.151 0.221 -4.102 1.00 14.67 C
1359 ATOM 988 CZ2 TRP A 126 29.629 -2.483 -3.500 1.00 14.21 C
1360 ATOM 989 CZ3 TRP A 126 29.398 -0.130 -2.993 1.00 20.97 C
1361 ATOM 990 CH2 TRP A 126 29.133 -1.475 -2.691 1.00 18.60 C
1362 ATOM 991 N ASP A 127 32.068 2.131 -9.569 1.00 17.71 N
1363 ATOM 992 CA ASP A 127 32.711 3.148 -10.355 1.00 15.37 C
1364 ATOM 993 C ASP A 127 31.799 4.344 -10.474 1.00 15.93 C
1365 ATOM 994 O ASP A 127 32.250 5.452 -10.351 1.00 22.85 O
1366 ATOM 995 CB ASP A 127 33.036 2.630 -11.745 1.00 21.99 C
1367 ATOM 996 CG ASP A 127 34.251 1.734 -11.723 1.00 25.66 C
1368 ATOM 997 OD1 ASP A 127 34.623 1.136 -10.738 1.00 40.65 O
1369 ATOM 998 OD2 ASP A 127 34.879 1.675 -12.862 1.00 60.09 O
1370 ATOM 999 N GLU A 128 30.496 4.127 -10.669 1.00 15.66 N
1371 ATOM 1000 CA GLU A 128 29.579 5.251 -10.776 1.00 19.13 C
1372 ATOM 1001 C GLU A 128 29.504 6.119 -9.550 1.00 31.74 C
1373 ATOM 1002 O GLU A 128 29.472 7.344 -9.646 1.00 21.94 O
1374 ATOM 1003 CB GLU A 128 28.195 4.816 -11.241 1.00 29.43 C
1375 ATOM 1004 CG GLU A 128 28.390 4.106 -12.581 1.00 27.75 C
1376 ATOM 1005 CD GLU A 128 27.194 3.379 -13.086 1.00100.00 C
1377 ATOM 1006 OE1 GLU A 128 26.134 4.145 -13.137 1.00 66.11 O
1378 ATOM 1007 OE2 GLU A 128 27.219 2.207 -13.431 1.00100.00 O
1379 ATOM 1008 N ALA A 129 29.451 5.460 -8.397 1.00 18.29 N
1380 ATOM 1009 CA ALA A 129 29.389 6.174 -7.135 1.00 23.28 C
1381 ATOM 1010 C ALA A 129 30.648 7.013 -6.932 1.00 15.56 C
1382 ATOM 1011 O ALA A 129 30.551 8.145 -6.463 1.00 20.07 O
1383 ATOM 1012 CB ALA A 129 29.191 5.197 -5.979 1.00 16.34 C
1384 ATOM 1013 N ALA A 130 31.799 6.433 -7.302 1.00 16.31 N
1385 ATOM 1014 CA ALA A 130 33.109 7.081 -7.163 1.00 16.19 C
1386 ATOM 1015 C ALA A 130 33.146 8.399 -7.936 1.00 31.29 C
1387 ATOM 1016 O ALA A 130 33.599 9.419 -7.421 1.00 23.14 O
1388 ATOM 1017 CB ALA A 130 34.246 6.144 -7.591 1.00 15.25 C
1389 ATOM 1018 N VAL A 131 32.631 8.362 -9.170 1.00 19.10 N
1390 ATOM 1019 CA VAL A 131 32.568 9.535 -10.023 1.00 17.12 C
1391 ATOM 1020 C VAL A 131 31.632 10.591 -9.396 1.00 29.02 C
1392 ATOM 1021 O VAL A 131 32.022 11.734 -9.252 1.00 31.60 O
1393 ATOM 1022 CB VAL A 131 32.210 9.167 -11.499 1.00 15.74 C
1394 ATOM 1023 CG1 VAL A 131 31.808 10.378 -12.316 1.00 20.51 C
1395 ATOM 1024 CG2 VAL A 131 33.413 8.500 -12.143 1.00 21.87 C
1396 ATOM 1025 N ASN A 132 30.418 10.188 -8.972 1.00 17.76 N
1397 ATOM 1026 CA ASN A 132 29.448 11.090 -8.354 1.00 16.96 C
1398 ATOM 1027 C ASN A 132 29.944 11.689 -7.019 1.00 18.62 C
1399 ATOM 1028 O ASN A 132 29.734 12.831 -6.665 1.00 20.88 O
1400 ATOM 1029 CB ASN A 132 28.075 10.413 -8.174 1.00 16.54 C
1401 ATOM 1030 CG ASN A 132 26.994 11.363 -7.664 1.00 22.25 C
1402 ATOM 1031 OD1 ASN A 132 26.778 11.580 -6.440 1.00 21.94 O
1403 ATOM 1032 ND2 ASN A 132 26.356 12.008 -8.622 1.00 22.83 N
1404 ATOM 1033 N LEU A 133 30.611 10.894 -6.231 1.00 13.61 N
1405 ATOM 1034 CA LEU A 133 31.109 11.391 -4.955 1.00 24.15 C
1406 ATOM 1035 C LEU A 133 32.102 12.558 -5.141 1.00 20.24 C
1407 ATOM 1036 O LEU A 133 32.170 13.440 -4.293 1.00 25.53 O
1408 ATOM 1037 CB LEU A 133 31.802 10.260 -4.091 1.00 18.11 C
1409 ATOM 1038 CG LEU A 133 30.867 9.261 -3.345 1.00 17.47 C
1410 ATOM 1039 CD1 LEU A 133 31.656 8.042 -2.823 1.00 17.98 C
1411 ATOM 1040 CD2 LEU A 133 30.146 9.942 -2.181 1.00 20.27 C
1412 ATOM 1041 N ALA A 134 32.898 12.510 -6.219 1.00 18.47 N
1413 ATOM 1042 CA ALA A 134 33.940 13.506 -6.525 1.00 23.44 C
1414 ATOM 1043 C ALA A 134 33.390 14.902 -6.886 1.00 15.10 C
1415 ATOM 1044 O ALA A 134 34.065 15.949 -6.779 1.00 17.46 O
1416 ATOM 1045 CB ALA A 134 34.949 12.926 -7.535 1.00 17.08 C
1417 ATOM 1046 N LYS A 135 32.132 14.933 -7.301 1.00 13.56 N
1418 ATOM 1047 CA LYS A 135 31.445 16.186 -7.670 1.00 18.04 C
1419 ATOM 1048 C LYS A 135 30.870 16.812 -6.450 1.00 19.38 C
1420 ATOM 1049 O LYS A 135 29.663 16.859 -6.296 1.00 22.29 O
1421 ATOM 1050 CB LYS A 135 30.271 15.908 -8.591 1.00 17.00 C
1422 ATOM 1051 CG LYS A 135 30.801 15.218 -9.819 1.00 27.09 C
1423 ATOM 1052 CD LYS A 135 29.820 15.211 -10.945 1.00 32.11 C
1424 ATOM 1053 CE LYS A 135 30.435 14.584 -12.171 1.00 80.06 C
1425 ATOM 1054 NZ LYS A 135 29.509 13.693 -12.873 1.00 68.83 N
1426 ATOM 1055 N SER A 136 31.754 17.257 -5.586 1.00 14.00 N
1427 ATOM 1056 CA SER A 136 31.329 17.779 -4.323 1.00 18.42 C
1428 ATOM 1057 C SER A 136 32.320 18.800 -3.753 1.00 9.62 C
1429 ATOM 1058 O SER A 136 33.536 18.787 -4.028 1.00 20.41 O
1430 ATOM 1059 CB SER A 136 31.168 16.588 -3.341 1.00 9.05 C
1431 ATOM 1060 OG SER A 136 32.431 15.899 -3.177 1.00 15.05 O
1432 ATOM 1061 N ARG A 137 31.773 19.670 -2.927 1.00 12.96 N
1433 ATOM 1062 CA ARG A 137 32.596 20.620 -2.223 1.00 21.62 C
1434 ATOM 1063 C ARG A 137 33.671 19.854 -1.431 1.00 18.76 C
1435 ATOM 1064 O ARG A 137 34.837 20.228 -1.399 1.00 21.10 O
1436 ATOM 1065 CB ARG A 137 31.735 21.464 -1.262 1.00 24.44 C
1437 ATOM 1066 CG ARG A 137 32.643 22.248 -0.307 1.00 24.11 C
1438 ATOM 1067 CD ARG A 137 31.966 23.346 0.500 1.00 24.09 C
1439 ATOM 1068 NE ARG A 137 32.910 24.255 1.187 1.00 32.98 N
1440 ATOM 1069 CZ ARG A 137 33.679 23.995 2.271 1.00 44.78 C
1441 ATOM 1070 NH1 ARG A 137 33.713 22.814 2.877 1.00 40.48 N
1442 ATOM 1071 NH2 ARG A 137 34.460 24.961 2.747 1.00 51.06 N
1443 ATOM 1072 N TRP A 138 33.226 18.736 -0.780 1.00 20.48 N
1444 ATOM 1073 CA TRP A 138 34.050 17.821 0.043 1.00 17.62 C
1445 ATOM 1074 C TRP A 138 35.341 17.427 -0.665 1.00 13.22 C
1446 ATOM 1075 O TRP A 138 36.447 17.574 -0.161 1.00 16.77 O
1447 ATOM 1076 CB TRP A 138 33.223 16.538 0.326 1.00 24.49 C
1448 ATOM 1077 CG TRP A 138 33.986 15.405 0.956 1.00 21.87 C
1449 ATOM 1078 CD1 TRP A 138 34.690 15.447 2.120 1.00 16.74 C
1450 ATOM 1079 CD2 TRP A 138 34.007 14.038 0.518 1.00 19.75 C
1451 ATOM 1080 NE1 TRP A 138 35.211 14.192 2.407 1.00 19.08 N
1452 ATOM 1081 CE2 TRP A 138 34.788 13.309 1.443 1.00 16.75 C
1453 ATOM 1082 CE3 TRP A 138 33.449 13.395 -0.578 1.00 13.25 C
1454 ATOM 1083 CZ2 TRP A 138 34.973 11.922 1.323 1.00 16.33 C
1455 ATOM 1084 CZ3 TRP A 138 33.673 12.037 -0.717 1.00 22.22 C
1456 ATOM 1085 CH2 TRP A 138 34.434 11.317 0.216 1.00 18.81 C
1457 ATOM 1086 N TYR A 139 35.158 16.957 -1.886 1.00 12.78 N
1458 ATOM 1087 CA TYR A 139 36.249 16.549 -2.711 1.00 13.42 C
1459 ATOM 1088 C TYR A 139 37.101 17.719 -3.076 1.00 60.46 C
1460 ATOM 1089 O TYR A 139 38.303 17.612 -3.090 1.00 21.07 O
1461 ATOM 1090 CB TYR A 139 35.709 15.984 -4.012 1.00 13.74 C
1462 ATOM 1091 CG TYR A 139 36.801 15.465 -4.900 1.00 23.17 C
1463 ATOM 1092 CD1 TYR A 139 37.320 14.190 -4.669 1.00 23.11 C
1464 ATOM 1093 CD2 TYR A 139 37.255 16.212 -5.991 1.00 25.29 C
1465 ATOM 1094 CE1 TYR A 139 38.293 13.646 -5.500 1.00 23.43 C
1466 ATOM 1095 CE2 TYR A 139 38.226 15.679 -6.836 1.00 37.37 C
1467 ATOM 1096 CZ TYR A 139 38.733 14.400 -6.583 1.00 61.07 C
1468 ATOM 1097 OH TYR A 139 39.681 13.875 -7.394 1.00 53.26 O
1469 ATOM 1098 N ASN A 140 36.466 18.813 -3.446 1.00 20.91 N
1470 ATOM 1099 CA ASN A 140 37.233 19.994 -3.832 1.00 15.56 C
1471 ATOM 1100 C ASN A 140 38.053 20.620 -2.689 1.00 18.76 C
1472 ATOM 1101 O ASN A 140 39.167 21.066 -2.901 1.00 25.65 O
1473 ATOM 1102 CB ASN A 140 36.359 20.998 -4.610 1.00 30.93 C
1474 ATOM 1103 CG ASN A 140 36.071 20.429 -5.985 1.00 30.98 C
1475 ATOM 1104 OD1 ASN A 140 34.988 19.870 -6.257 1.00 26.20 O
1476 ATOM 1105 ND2 ASN A 140 37.086 20.474 -6.839 1.00 31.37 N
1477 ATOM 1106 N GLN A 141 37.536 20.587 -1.464 1.00 11.47 N
1478 ATOM 1107 CA GLN A 141 38.214 21.127 -0.303 1.00 23.02 C
1479 ATOM 1108 C GLN A 141 39.312 20.253 0.284 1.00 31.48 C
1480 ATOM 1109 O GLN A 141 40.375 20.774 0.671 1.00 23.79 O
1481 ATOM 1110 CB GLN A 141 37.253 21.591 0.825 1.00 13.12 C
1482 ATOM 1111 CG GLN A 141 36.267 22.680 0.343 1.00 26.12 C
1483 ATOM 1112 CD GLN A 141 36.936 23.887 -0.272 1.00 98.47 C
1484 ATOM 1113 OE1 GLN A 141 36.581 24.345 -1.370 1.00 23.95 O
1485 ATOM 1114 NE2 GLN A 141 37.898 24.424 0.454 1.00 21.78 N
1486 ATOM 1115 N THR A 142 39.034 18.943 0.415 1.00 22.03 N
1487 ATOM 1116 CA THR A 142 39.990 17.982 0.977 1.00 13.70 C
1488 ATOM 1117 C THR A 142 40.179 16.874 -0.003 1.00 21.93 C
1489 ATOM 1118 O THR A 142 39.793 15.741 0.248 1.00 15.62 O
1490 ATOM 1119 CB THR A 142 39.523 17.406 2.319 1.00 23.91 C
1491 ATOM 1120 OG1 THR A 142 38.158 16.919 2.193 1.00 19.29 O
1492 ATOM 1121 CG2 THR A 142 39.647 18.501 3.385 1.00 18.00 C
1493 ATOM 1122 N PRO A 143 40.755 17.216 -1.141 1.00 21.61 N
1494 ATOM 1123 CA PRO A 143 40.940 16.223 -2.194 1.00 20.14 C
1495 ATOM 1124 C PRO A 143 41.748 14.954 -1.830 1.00 25.97 C
1496 ATOM 1125 O PRO A 143 41.390 13.889 -2.264 1.00 18.86 O
1497 ATOM 1126 CB PRO A 143 41.600 16.958 -3.358 1.00 16.74 C
1498 ATOM 1127 CG PRO A 143 42.279 18.171 -2.740 1.00 13.31 C
1499 ATOM 1128 CD PRO A 143 41.522 18.469 -1.453 1.00 16.19 C
1500 ATOM 1129 N ASN A 144 42.850 15.031 -1.088 1.00 10.75 N
1501 ATOM 1130 CA ASN A 144 43.618 13.828 -0.796 1.00 18.51 C
1502 ATOM 1131 C ASN A 144 42.883 12.849 0.112 1.00 23.48 C
1503 ATOM 1132 O ASN A 144 42.922 11.640 -0.072 1.00 15.35 O
1504 ATOM 1133 CB ASN A 144 45.039 14.093 -0.246 1.00 16.07 C
1505 ATOM 1134 CG ASN A 144 45.959 14.849 -1.227 1.00 36.85 C
1506 ATOM 1135 OD1 ASN A 144 45.913 14.693 -2.455 1.00 31.78 O
1507 ATOM 1136 ND2 ASN A 144 46.805 15.707 -0.691 1.00 38.60 N
1508 ATOM 1137 N ARG A 145 42.233 13.383 1.124 1.00 13.10 N
1509 ATOM 1138 CA ARG A 145 41.475 12.559 1.993 1.00 15.40 C
1510 ATOM 1139 C ARG A 145 40.220 11.995 1.272 1.00 22.38 C
1511 ATOM 1140 O ARG A 145 39.851 10.824 1.407 1.00 20.88 O
1512 ATOM 1141 CB ARG A 145 41.024 13.350 3.184 1.00 14.57 C
1513 ATOM 1142 CG ARG A 145 40.007 12.502 3.939 1.00 20.85 C
1514 ATOM 1143 CD ARG A 145 39.556 13.178 5.183 1.00 27.20 C
1515 ATOM 1144 NE ARG A 145 38.862 12.291 6.067 1.00 18.87 N
1516 ATOM 1145 CZ ARG A 145 38.682 12.706 7.298 1.00 23.12 C
1517 ATOM 1146 NH1 ARG A 145 39.167 13.892 7.635 1.00 15.18 N
1518 ATOM 1147 NH2 ARG A 145 38.037 11.962 8.200 1.00 15.69 N
1519 ATOM 1148 N ALA A 146 39.511 12.859 0.532 1.00 15.21 N
1520 ATOM 1149 CA ALA A 146 38.350 12.426 -0.238 1.00 15.43 C
1521 ATOM 1150 C ALA A 146 38.717 11.241 -1.162 1.00 15.00 C
1522 ATOM 1151 O ALA A 146 38.018 10.242 -1.207 1.00 19.61 O
1523 ATOM 1152 CB ALA A 146 37.751 13.591 -1.052 1.00 15.57 C
1524 ATOM 1153 N LYS A 147 39.828 11.367 -1.917 1.00 15.58 N
1525 ATOM 1154 CA LYS A 147 40.311 10.348 -2.825 1.00 16.89 C
1526 ATOM 1155 C LYS A 147 40.521 9.036 -2.132 1.00 19.44 C
1527 ATOM 1156 O LYS A 147 40.253 7.965 -2.683 1.00 14.15 O
1528 ATOM 1157 CB LYS A 147 41.620 10.736 -3.448 1.00 19.07 C
1529 ATOM 1158 CG LYS A 147 41.439 11.506 -4.731 1.00 36.68 C
1530 ATOM 1159 CD LYS A 147 42.623 12.382 -5.097 1.00 42.79 C
1531 ATOM 1160 CE LYS A 147 42.166 13.604 -5.859 1.00 67.11 C
1532 ATOM 1161 NZ LYS A 147 43.241 14.573 -6.079 1.00100.00 N
1533 ATOM 1162 N ARG A 148 41.044 9.128 -0.924 1.00 13.10 N
1534 ATOM 1163 CA ARG A 148 41.311 7.897 -0.157 1.00 20.23 C
1535 ATOM 1164 C ARG A 148 40.026 7.155 0.185 1.00 27.72 C
1536 ATOM 1165 O ARG A 148 39.900 5.938 0.014 1.00 14.50 O
1537 ATOM 1166 CB ARG A 148 42.120 8.174 1.115 1.00 16.49 C
1538 ATOM 1167 CG ARG A 148 43.626 8.317 0.868 1.00 10.79 C
1539 ATOM 1168 CD ARG A 148 44.393 8.207 2.168 1.00 13.07 C
1540 ATOM 1169 NE ARG A 148 44.082 9.289 3.105 1.00 21.21 N
1541 ATOM 1170 CZ ARG A 148 44.668 10.513 3.086 1.00 30.16 C
1542 ATOM 1171 NH1 ARG A 148 45.566 10.864 2.162 1.00 17.96 N
1543 ATOM 1172 NH2 ARG A 148 44.360 11.423 3.962 1.00 17.29 N
1544 ATOM 1173 N VAL A 149 39.072 7.923 0.697 1.00 12.89 N
1545 ATOM 1174 CA VAL A 149 37.760 7.401 1.090 1.00 14.83 C
1546 ATOM 1175 C VAL A 149 37.006 6.834 -0.102 1.00 22.58 C
1547 ATOM 1176 O VAL A 149 36.389 5.760 -0.030 1.00 15.48 O
1548 ATOM 1177 CB VAL A 149 36.951 8.492 1.778 1.00 10.96 C
1549 ATOM 1178 CG1 VAL A 149 35.514 8.009 2.012 1.00 9.61 C
1550 ATOM 1179 CG2 VAL A 149 37.590 8.856 3.122 1.00 14.16 C
1551 ATOM 1180 N ILE A 150 37.066 7.584 -1.201 1.00 15.45 N
1552 ATOM 1181 CA ILE A 150 36.426 7.237 -2.457 1.00 15.47 C
1553 ATOM 1182 C ILE A 150 37.021 5.960 -3.048 1.00 21.83 C
1554 ATOM 1183 O ILE A 150 36.316 5.123 -3.627 1.00 21.32 O
1555 ATOM 1184 CB ILE A 150 36.427 8.407 -3.495 1.00 21.00 C
1556 ATOM 1185 CG1 ILE A 150 35.502 9.593 -3.091 1.00 20.10 C
1557 ATOM 1186 CG2 ILE A 150 36.038 7.886 -4.888 1.00 21.34 C
1558 ATOM 1187 CD1 ILE A 150 35.633 10.814 -4.006 1.00 11.57 C
1559 ATOM 1188 N THR A 151 38.340 5.806 -2.912 1.00 15.32 N
1560 ATOM 1189 CA THR A 151 38.992 4.617 -3.444 1.00 17.24 C
1561 ATOM 1190 C THR A 151 38.543 3.425 -2.659 1.00 17.84 C
1562 ATOM 1191 O THR A 151 38.386 2.341 -3.204 1.00 19.37 O
1563 ATOM 1192 CB THR A 151 40.520 4.720 -3.355 1.00 18.62 C
1564 ATOM 1193 OG1 THR A 151 40.918 5.592 -4.377 1.00 30.73 O
1565 ATOM 1194 CG2 THR A 151 41.145 3.336 -3.585 1.00 20.50 C
1566 ATOM 1195 N THR A 152 38.339 3.660 -1.356 1.00 11.98 N
1567 ATOM 1196 CA THR A 152 37.858 2.615 -0.485 1.00 19.87 C
1568 ATOM 1197 C THR A 152 36.452 2.169 -0.928 1.00 25.50 C
1569 ATOM 1198 O THR A 152 36.107 0.990 -0.893 1.00 13.12 O
1570 ATOM 1199 CB THR A 152 37.876 3.102 0.975 1.00 15.78 C
1571 ATOM 1200 OG1 THR A 152 39.197 3.481 1.276 1.00 16.89 O
1572 ATOM 1201 CG2 THR A 152 37.497 1.977 1.917 1.00 14.63 C
1573 ATOM 1202 N PHE A 153 35.624 3.123 -1.357 1.00 16.01 N
1574 ATOM 1203 CA PHE A 153 34.281 2.774 -1.774 1.00 12.51 C
1575 ATOM 1204 C PHE A 153 34.302 2.040 -3.107 1.00 26.87 C
1576 ATOM 1205 O PHE A 153 33.527 1.105 -3.371 1.00 18.43 O
1577 ATOM 1206 CB PHE A 153 33.322 3.995 -1.850 1.00 18.29 C
1578 ATOM 1207 CG PHE A 153 32.610 4.426 -0.574 1.00 24.10 C
1579 ATOM 1208 CD1 PHE A 153 31.746 3.592 0.145 1.00 22.84 C
1580 ATOM 1209 CD2 PHE A 153 32.760 5.732 -0.107 1.00 14.62 C
1581 ATOM 1210 CE1 PHE A 153 31.090 4.016 1.308 1.00 16.03 C
1582 ATOM 1211 CE2 PHE A 153 32.092 6.184 1.038 1.00 17.04 C
1583 ATOM 1212 CZ PHE A 153 31.262 5.326 1.762 1.00 12.69 C
1584 ATOM 1213 N ARG A 154 35.195 2.489 -3.972 1.00 14.36 N
1585 ATOM 1214 CA ARG A 154 35.341 1.907 -5.309 1.00 28.79 C
1586 ATOM 1215 C ARG A 154 35.829 0.472 -5.305 1.00 32.48 C
1587 ATOM 1216 O ARG A 154 35.281 -0.359 -6.027 1.00 34.08 O
1588 ATOM 1217 CB ARG A 154 36.250 2.730 -6.224 1.00 17.86 C
1589 ATOM 1218 CG ARG A 154 35.893 2.588 -7.709 1.00 28.51 C
1590 ATOM 1219 CD ARG A 154 36.852 3.306 -8.671 1.00 19.63 C
1591 ATOM 1220 NE ARG A 154 38.221 3.404 -8.168 1.00 48.68 N
1592 ATOM 1221 CZ ARG A 154 39.183 2.483 -8.298 1.00100.00 C
1593 ATOM 1222 NH1 ARG A 154 38.992 1.315 -8.924 1.00 59.68 N
1594 ATOM 1223 NH2 ARG A 154 40.379 2.752 -7.779 1.00 50.71 N
1595 ATOM 1224 N THR A 155 36.872 0.211 -4.495 1.00 22.51 N
1596 ATOM 1225 CA THR A 155 37.545 -1.074 -4.450 1.00 18.59 C
1597 ATOM 1226 C THR A 155 37.138 -2.005 -3.374 1.00 26.41 C
1598 ATOM 1227 O THR A 155 37.319 -3.191 -3.506 1.00 27.41 O
1599 ATOM 1228 CB THR A 155 39.076 -0.932 -4.326 1.00 26.06 C
1600 ATOM 1229 OG1 THR A 155 39.426 -0.402 -3.056 1.00 18.98 O
1601 ATOM 1230 CG2 THR A 155 39.607 -0.066 -5.453 1.00 16.15 C
1602 ATOM 1231 N GLY A 156 36.702 -1.502 -2.270 1.00 22.79 N
1603 ATOM 1232 CA GLY A 156 36.382 -2.418 -1.226 1.00 12.45 C
1604 ATOM 1233 C GLY A 156 37.621 -2.989 -0.527 1.00 29.19 C
1605 ATOM 1234 O GLY A 156 37.520 -3.953 0.201 1.00 22.18 O
1606 ATOM 1235 N THR A 157 38.788 -2.377 -0.707 1.00 20.81 N
1607 ATOM 1236 CA THR A 157 40.044 -2.786 -0.056 1.00 18.42 C
1608 ATOM 1237 C THR A 157 40.650 -1.581 0.663 1.00 21.69 C
1609 ATOM 1238 O THR A 157 40.226 -0.459 0.450 1.00 17.44 O
1610 ATOM 1239 CB THR A 157 41.062 -3.110 -1.151 1.00 16.72 C
1611 ATOM 1240 OG1 THR A 157 41.361 -1.879 -1.814 1.00 27.99 O
1612 ATOM 1241 CG2 THR A 157 40.444 -4.098 -2.138 1.00 30.15 C
1613 ATOM 1242 N TRP A 158 41.704 -1.798 1.426 1.00 19.78 N
1614 ATOM 1243 CA TRP A 158 42.374 -0.730 2.155 1.00 12.64 C
1615 ATOM 1244 C TRP A 158 43.588 -0.214 1.423 1.00 18.49 C
1616 ATOM 1245 O TRP A 158 44.490 0.384 2.010 1.00 25.85 O
1617 ATOM 1246 CB TRP A 158 42.885 -1.263 3.497 1.00 14.94 C
1618 ATOM 1247 CG TRP A 158 41.839 -1.720 4.451 1.00 18.75 C
1619 ATOM 1248 CD1 TRP A 158 41.612 -2.998 4.846 1.00 18.63 C
1620 ATOM 1249 CD2 TRP A 158 40.950 -0.892 5.209 1.00 18.89 C
1621 ATOM 1250 NE1 TRP A 158 40.608 -3.031 5.785 1.00 19.94 N
1622 ATOM 1251 CE2 TRP A 158 40.193 -1.748 6.042 1.00 17.65 C
1623 ATOM 1252 CE3 TRP A 158 40.760 0.485 5.290 1.00 16.70 C
1624 ATOM 1253 CZ2 TRP A 158 39.221 -1.258 6.918 1.00 29.56 C
1625 ATOM 1254 CZ3 TRP A 158 39.815 0.962 6.169 1.00 13.88 C
1626 ATOM 1255 CH2 TRP A 158 39.039 0.102 6.957 1.00 25.71 C
1627 ATOM 1256 N ASP A 159 43.625 -0.450 0.136 1.00 18.68 N
1628 ATOM 1257 CA ASP A 159 44.780 -0.054 -0.600 1.00 19.20 C
1629 ATOM 1258 C ASP A 159 45.192 1.407 -0.484 1.00 24.19 C
1630 ATOM 1259 O ASP A 159 46.376 1.693 -0.478 1.00 27.82 O
1631 ATOM 1260 CB ASP A 159 44.628 -0.435 -2.062 1.00 18.57 C
1632 ATOM 1261 CG ASP A 159 44.618 -1.915 -2.320 1.00 72.40 C
1633 ATOM 1262 OD1 ASP A 159 45.148 -2.640 -1.364 1.00 38.14 O
1634 ATOM 1263 OD2 ASP A 159 44.182 -2.378 -3.349 1.00 36.81 O
1635 ATOM 1264 N ALA A 160 44.244 2.330 -0.399 1.00 18.86 N
1636 ATOM 1265 CA ALA A 160 44.559 3.759 -0.349 1.00 12.88 C
1637 ATOM 1266 C ALA A 160 45.251 4.112 0.941 1.00 20.42 C
1638 ATOM 1267 O ALA A 160 45.841 5.171 1.092 1.00 24.68 O
1639 ATOM 1268 CB ALA A 160 43.288 4.622 -0.519 1.00 17.04 C
1640 ATOM 1269 N TYR A 161 45.131 3.210 1.890 1.00 21.01 N
1641 ATOM 1270 CA TYR A 161 45.686 3.447 3.184 1.00 16.44 C
1642 ATOM 1271 C TYR A 161 46.908 2.637 3.408 1.00 36.93 C
1643 ATOM 1272 O TYR A 161 47.469 2.688 4.496 1.00 31.38 O
1644 ATOM 1273 CB TYR A 161 44.711 3.184 4.346 1.00 19.49 C
1645 ATOM 1274 CG TYR A 161 43.666 4.258 4.401 1.00 20.08 C
1646 ATOM 1275 CD1 TYR A 161 42.570 4.167 3.539 1.00 14.73 C
1647 ATOM 1276 CD2 TYR A 161 43.793 5.361 5.247 1.00 12.95 C
1648 ATOM 1277 CE1 TYR A 161 41.564 5.135 3.529 1.00 15.18 C
1649 ATOM 1278 CE2 TYR A 161 42.799 6.349 5.243 1.00 14.08 C
1650 ATOM 1279 CZ TYR A 161 41.693 6.228 4.385 1.00 22.69 C
1651 ATOM 1280 OH TYR A 161 40.695 7.181 4.365 1.00 17.31 O
1652 ATOM 1281 N LYS A 162 47.309 1.888 2.400 1.00 44.48 N
1653 ATOM 1282 CA LYS A 162 48.526 1.128 2.555 1.00 55.19 C
1654 ATOM 1283 C LYS A 162 49.627 1.743 1.731 1.00 41.34 C
1655 ATOM 1284 O LYS A 162 50.630 2.186 2.281 1.00 72.96 O
1656 ATOM 1285 CB LYS A 162 48.381 -0.346 2.323 1.00 40.17 C
1657 ATOM 1286 CG LYS A 162 47.496 -0.965 3.387 1.00 41.10 C
1658 ATOM 1287 CD LYS A 162 46.714 -2.161 2.865 1.00100.00 C
1659 ATOM 1288 CE LYS A 162 46.774 -2.284 1.346 1.00100.00 C
1660 ATOM 1289 NZ LYS A 162 45.730 -3.169 0.796 1.00 75.54 N
1661 TER 1290 LYS A 162
1662 HETATM 1291 CL CL A 173 43.105 16.437 1.838 1.00 31.25 CL
1663 HETATM 1292 CL CL A 178 31.797 15.637 23.970 0.50 36.01 CL
1664 HETATM 1293 C1 BME A 901 31.762 -0.871 15.008 1.00 59.34 C
1665 HETATM 1294 C2 BME A 901 31.892 -0.606 13.524 1.00 42.69 C
1666 HETATM 1295 O1 BME A 901 33.090 -0.817 15.520 1.00 86.60 O
1667 HETATM 1296 S2 BME A 901 33.378 -1.464 12.974 1.00 66.76 S
1668 HETATM 1297 C1 BME A 902 34.058 -3.174 9.669 1.00 83.63 C
1669 HETATM 1298 C2 BME A 902 32.984 -2.119 10.002 1.00 42.57 C
1670 HETATM 1299 O1 BME A 902 35.190 -2.535 9.107 1.00 60.57 O
1671 HETATM 1300 S2 BME A 902 33.624 -0.782 11.042 1.00100.00 S
1672 HETATM 1301 C1 BNZ A 400 26.408 5.086 3.512 1.00 21.10 C
1673 HETATM 1302 C2 BNZ A 400 27.385 5.881 2.928 1.00 23.87 C
1674 HETATM 1303 C3 BNZ A 400 27.891 6.973 3.620 1.00 21.16 C
1675 HETATM 1304 C4 BNZ A 400 27.441 7.240 4.913 1.00 24.84 C
1676 HETATM 1305 C5 BNZ A 400 26.490 6.418 5.520 1.00 23.50 C
1677 HETATM 1306 C6 BNZ A 400 25.957 5.352 4.805 1.00 18.26 C
1678 CONECT 1293 1294 1295
1679 CONECT 1294 1293 1296
1680 CONECT 1295 1293
1681 CONECT 1296 1294 1300
1682 CONECT 1297 1298 1299
1683 CONECT 1298 1297 1300
1684 CONECT 1299 1297
1685 CONECT 1300 1296 1298
1686 CONECT 1301 1302 1306
1687 CONECT 1302 1301 1303
1688 CONECT 1303 1302 1304
1689 CONECT 1304 1303 1305
1690 CONECT 1305 1304 1306
1691 CONECT 1306 1301 1305
1692 MASTER 292 0 5 10 4 0 7 6 1447 1 14 13
1693 END