allpy
diff test/1jcc.pdb @ 86:d46c994fa101
merge
| author | boris <bnagaev@gmail.com> |
|---|---|
| date | Tue, 19 Oct 2010 17:56:10 +0400 |
| parents | |
| children |
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1.1 --- /dev/null Thu Jan 01 00:00:00 1970 +0000 1.2 +++ b/test/1jcc.pdb Tue Oct 19 17:56:10 2010 +0400 1.3 @@ -0,0 +1,1806 @@ 1.4 +HEADER MEMBRANE PROTEIN 08-JUN-01 1JCC 1.5 +TITLE CRYSTAL STRUCTURE OF A NOVEL ALANINE-ZIPPER TRIMER AT 1.7 A 1.6 +TITLE 2 RESOLUTION, V13A,L16A,V20A,L23A,V27A,M30A,V34A MUTATIONS 1.7 +COMPND MOL_ID: 1; 1.8 +COMPND 2 MOLECULE: MAJOR OUTER MEMBRANE LIPOPROTEIN; 1.9 +COMPND 3 CHAIN: A, B, C; 1.10 +COMPND 4 SYNONYM: MUREIN-LIPOPROTEIN; 1.11 +COMPND 5 ENGINEERED: YES; 1.12 +COMPND 6 MUTATION: YES 1.13 +SOURCE MOL_ID: 1; 1.14 +SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; 1.15 +SOURCE 3 ORGANISM_TAXID: 562; 1.16 +SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; 1.17 +SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; 1.18 +SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID 1.19 +KEYWDS LIPOPROTEIN, PROTEIN FOLDING, COILED COIL, HELIX CAPPING, 1.20 +KEYWDS 2 ALANINE-ZIPPER, MEMBRANE PROTEIN 1.21 +EXPDTA X-RAY DIFFRACTION 1.22 +AUTHOR J.LIU,J.DAI,M.LU 1.23 +REVDAT 2 24-FEB-09 1JCC 1 VERSN 1.24 +REVDAT 1 17-JUN-03 1JCC 0 1.25 +JRNL AUTH J.LIU,J.DAI,M.LU 1.26 +JRNL TITL ZINC-MEDIATED HELIX CAPPING IN A TRIPLE-HELICAL 1.27 +JRNL TITL 2 PROTEIN 1.28 +JRNL REF BIOCHEMISTRY V. 42 5657 2003 1.29 +JRNL REFN ISSN 0006-2960 1.30 +JRNL PMID 12741822 1.31 +JRNL DOI 10.1021/BI026828A 1.32 +REMARK 1 1.33 +REMARK 2 1.34 +REMARK 2 RESOLUTION. 1.70 ANGSTROMS. 1.35 +REMARK 3 1.36 +REMARK 3 REFINEMENT. 1.37 +REMARK 3 PROGRAM : CNS 1.0 1.38 +REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- 1.39 +REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, 1.40 +REMARK 3 : READ,RICE,SIMONSON,WARREN 1.41 +REMARK 3 1.42 +REMARK 3 REFINEMENT TARGET : ENGH & HUBER 1.43 +REMARK 3 1.44 +REMARK 3 DATA USED IN REFINEMENT. 1.45 +REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.70 1.46 +REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 35.13 1.47 +REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 1.48 +REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 1029074.030 1.49 +REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 1.50 +REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 97.6 1.51 +REMARK 3 NUMBER OF REFLECTIONS : 15821 1.52 +REMARK 3 1.53 +REMARK 3 FIT TO DATA USED IN REFINEMENT. 1.54 +REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT 1.55 +REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM 1.56 +REMARK 3 R VALUE (WORKING SET) : 0.192 1.57 +REMARK 3 FREE R VALUE : 0.223 1.58 +REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.100 1.59 +REMARK 3 FREE R VALUE TEST SET COUNT : 1594 1.60 +REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.006 1.61 +REMARK 3 1.62 +REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. 1.63 +REMARK 3 TOTAL NUMBER OF BINS USED : 6 1.64 +REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.70 1.65 +REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.81 1.66 +REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 98.30 1.67 +REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2360 1.68 +REMARK 3 BIN R VALUE (WORKING SET) : 0.2500 1.69 +REMARK 3 BIN FREE R VALUE : 0.2990 1.70 +REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 9.60 1.71 +REMARK 3 BIN FREE R VALUE TEST SET COUNT : 252 1.72 +REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.019 1.73 +REMARK 3 1.74 +REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. 1.75 +REMARK 3 PROTEIN ATOMS : 1094 1.76 +REMARK 3 NUCLEIC ACID ATOMS : 0 1.77 +REMARK 3 HETEROGEN ATOMS : 3 1.78 +REMARK 3 SOLVENT ATOMS : 234 1.79 +REMARK 3 1.80 +REMARK 3 B VALUES. 1.81 +REMARK 3 FROM WILSON PLOT (A**2) : 21.90 1.82 +REMARK 3 MEAN B VALUE (OVERALL, A**2) : 22.10 1.83 +REMARK 3 OVERALL ANISOTROPIC B VALUE. 1.84 +REMARK 3 B11 (A**2) : 7.56000 1.85 +REMARK 3 B22 (A**2) : -1.56000 1.86 +REMARK 3 B33 (A**2) : -5.99000 1.87 +REMARK 3 B12 (A**2) : 0.00000 1.88 +REMARK 3 B13 (A**2) : 0.45000 1.89 +REMARK 3 B23 (A**2) : 0.00000 1.90 +REMARK 3 1.91 +REMARK 3 ESTIMATED COORDINATE ERROR. 1.92 +REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.19 1.93 +REMARK 3 ESD FROM SIGMAA (A) : 0.18 1.94 +REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 1.95 +REMARK 3 1.96 +REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. 1.97 +REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.22 1.98 +REMARK 3 ESD FROM C-V SIGMAA (A) : 0.21 1.99 +REMARK 3 1.100 +REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. 1.101 +REMARK 3 BOND LENGTHS (A) : 0.006 1.102 +REMARK 3 BOND ANGLES (DEGREES) : 0.90 1.103 +REMARK 3 DIHEDRAL ANGLES (DEGREES) : 15.50 1.104 +REMARK 3 IMPROPER ANGLES (DEGREES) : 0.68 1.105 +REMARK 3 1.106 +REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED 1.107 +REMARK 3 1.108 +REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA 1.109 +REMARK 3 MAIN-CHAIN BOND (A**2) : 1.170 ; 1.500 1.110 +REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.620 ; 2.000 1.111 +REMARK 3 SIDE-CHAIN BOND (A**2) : 2.550 ; 2.000 1.112 +REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.670 ; 2.500 1.113 +REMARK 3 1.114 +REMARK 3 BULK SOLVENT MODELING. 1.115 +REMARK 3 METHOD USED : FLAT MODEL 1.116 +REMARK 3 KSOL : 0.41 1.117 +REMARK 3 BSOL : 73.90 1.118 +REMARK 3 1.119 +REMARK 3 NCS MODEL : NULL 1.120 +REMARK 3 1.121 +REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT 1.122 +REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL 1.123 +REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL 1.124 +REMARK 3 1.125 +REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM 1.126 +REMARK 3 PARAMETER FILE 2 : WATER_REP.PARAM 1.127 +REMARK 3 PARAMETER FILE 3 : ION.PARAM 1.128 +REMARK 3 PARAMETER FILE 4 : NULL 1.129 +REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP 1.130 +REMARK 3 TOPOLOGY FILE 2 : WATER.TOP 1.131 +REMARK 3 TOPOLOGY FILE 3 : ION.TOP 1.132 +REMARK 3 TOPOLOGY FILE 4 : NULL 1.133 +REMARK 3 1.134 +REMARK 3 OTHER REFINEMENT REMARKS: NULL 1.135 +REMARK 4 1.136 +REMARK 4 1JCC COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 1.137 +REMARK 100 1.138 +REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 14-JUN-01. 1.139 +REMARK 100 THE RCSB ID CODE IS RCSB013617. 1.140 +REMARK 200 1.141 +REMARK 200 EXPERIMENTAL DETAILS 1.142 +REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION 1.143 +REMARK 200 DATE OF DATA COLLECTION : 20-APR-00 1.144 +REMARK 200 TEMPERATURE (KELVIN) : 95 1.145 +REMARK 200 PH : 5.6 1.146 +REMARK 200 NUMBER OF CRYSTALS USED : 1 1.147 +REMARK 200 1.148 +REMARK 200 SYNCHROTRON (Y/N) : Y 1.149 +REMARK 200 RADIATION SOURCE : NSLS 1.150 +REMARK 200 BEAMLINE : X26C 1.151 +REMARK 200 X-RAY GENERATOR MODEL : NULL 1.152 +REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M 1.153 +REMARK 200 WAVELENGTH OR RANGE (A) : 1.1000 1.154 +REMARK 200 MONOCHROMATOR : GRAPHITE 1.155 +REMARK 200 OPTICS : NULL 1.156 +REMARK 200 1.157 +REMARK 200 DETECTOR TYPE : CCD 1.158 +REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 1.159 +REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MADNES 1.160 +REMARK 200 DATA SCALING SOFTWARE : SCALEPACK 1.161 +REMARK 200 1.162 +REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 15821 1.163 +REMARK 200 RESOLUTION RANGE HIGH (A) : 1.700 1.164 +REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 1.165 +REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 1.166 +REMARK 200 1.167 +REMARK 200 OVERALL. 1.168 +REMARK 200 COMPLETENESS FOR RANGE (%) : 97.6 1.169 +REMARK 200 DATA REDUNDANCY : 2.500 1.170 +REMARK 200 R MERGE (I) : 0.07900 1.171 +REMARK 200 R SYM (I) : NULL 1.172 +REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 7.7000 1.173 +REMARK 200 1.174 +REMARK 200 IN THE HIGHEST RESOLUTION SHELL. 1.175 +REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.70 1.176 +REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.76 1.177 +REMARK 200 COMPLETENESS FOR SHELL (%) : 97.6 1.178 +REMARK 200 DATA REDUNDANCY IN SHELL : 2.50 1.179 +REMARK 200 R MERGE FOR SHELL (I) : 0.38300 1.180 +REMARK 200 R SYM FOR SHELL (I) : NULL 1.181 +REMARK 200 <I/SIGMA(I)> FOR SHELL : 3.300 1.182 +REMARK 200 1.183 +REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH 1.184 +REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT 1.185 +REMARK 200 SOFTWARE USED: AMORE 1.186 +REMARK 200 STARTING MODEL: PDB ENTRY 1EQ7 1.187 +REMARK 200 1.188 +REMARK 200 REMARK: NULL 1.189 +REMARK 280 1.190 +REMARK 280 CRYSTAL 1.191 +REMARK 280 SOLVENT CONTENT, VS (%): 40.33 1.192 +REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.06 1.193 +REMARK 280 1.194 +REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM ACETATE, ZINC ACETATE, PEG 1.195 +REMARK 280 8000, PH 5.6, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 293K 1.196 +REMARK 290 1.197 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY 1.198 +REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 1.199 +REMARK 290 1.200 +REMARK 290 SYMOP SYMMETRY 1.201 +REMARK 290 NNNMMM OPERATOR 1.202 +REMARK 290 1555 X,Y,Z 1.203 +REMARK 290 2555 -X,Y,-Z 1.204 +REMARK 290 3555 X+1/2,Y+1/2,Z 1.205 +REMARK 290 4555 -X+1/2,Y+1/2,-Z 1.206 +REMARK 290 1.207 +REMARK 290 WHERE NNN -> OPERATOR NUMBER 1.208 +REMARK 290 MMM -> TRANSLATION VECTOR 1.209 +REMARK 290 1.210 +REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS 1.211 +REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM 1.212 +REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY 1.213 +REMARK 290 RELATED MOLECULES. 1.214 +REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 1.215 +REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 1.216 +REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 1.217 +REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 1.218 +REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 1.219 +REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 1.220 +REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 31.19400 1.221 +REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 16.66100 1.222 +REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 1.223 +REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 31.19400 1.224 +REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 16.66100 1.225 +REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 1.226 +REMARK 290 1.227 +REMARK 290 REMARK: NULL 1.228 +REMARK 300 1.229 +REMARK 300 BIOMOLECULE: 1 1.230 +REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM 1.231 +REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN 1.232 +REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON 1.233 +REMARK 300 BURIED SURFACE AREA. 1.234 +REMARK 300 REMARK: THE BIOLOGICAL ASSEMBLY IS A TRIMER. 1.235 +REMARK 350 1.236 +REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN 1.237 +REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE 1.238 +REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS 1.239 +REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND 1.240 +REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. 1.241 +REMARK 350 1.242 +REMARK 350 BIOMOLECULE: 1 1.243 +REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TRIMERIC 1.244 +REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC 1.245 +REMARK 350 SOFTWARE USED: PISA 1.246 +REMARK 350 TOTAL BURIED SURFACE AREA: 5650 ANGSTROM**2 1.247 +REMARK 350 SURFACE AREA OF THE COMPLEX: 8700 ANGSTROM**2 1.248 +REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -101.0 KCAL/MOL 1.249 +REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C 1.250 +REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 1.251 +REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 1.252 +REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 1.253 +REMARK 465 1.254 +REMARK 465 MISSING RESIDUES 1.255 +REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE 1.256 +REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN 1.257 +REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) 1.258 +REMARK 465 1.259 +REMARK 465 M RES C SSSEQI 1.260 +REMARK 465 ALA A 52 1.261 +REMARK 465 THR A 53 1.262 +REMARK 465 LYS A 54 1.263 +REMARK 465 TYR A 55 1.264 +REMARK 465 ARG A 56 1.265 +REMARK 465 THR B 53 1.266 +REMARK 465 LYS B 54 1.267 +REMARK 465 TYR B 55 1.268 +REMARK 465 ARG B 56 1.269 +REMARK 465 LYS C 54 1.270 +REMARK 465 TYR C 55 1.271 +REMARK 465 ARG C 56 1.272 +REMARK 470 1.273 +REMARK 470 MISSING ATOM 1.274 +REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; 1.275 +REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; 1.276 +REMARK 470 I=INSERTION CODE): 1.277 +REMARK 470 M RES CSSEQI ATOMS 1.278 +REMARK 470 GLN A 14 CD OE1 NE2 1.279 +REMARK 470 LYS A 19 CD CE NZ 1.280 +REMARK 470 GLN A 46 CD OE1 NE2 1.281 +REMARK 470 MET A 51 O 1.282 +REMARK 470 GLN B 14 CD OE1 NE2 1.283 +REMARK 470 GLN B 46 CD OE1 NE2 1.284 +REMARK 470 ALA B 52 O 1.285 +REMARK 470 GLN C 14 CD OE1 NE2 1.286 +REMARK 470 GLN C 22 CD OE1 NE2 1.287 +REMARK 470 THR C 53 O 1.288 +REMARK 500 1.289 +REMARK 500 GEOMETRY AND STEREOCHEMISTRY 1.290 +REMARK 500 SUBTOPIC: TORSION ANGLES 1.291 +REMARK 500 1.292 +REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: 1.293 +REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; 1.294 +REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). 1.295 +REMARK 500 1.296 +REMARK 500 STANDARD TABLE: 1.297 +REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) 1.298 +REMARK 500 1.299 +REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- 1.300 +REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 1.301 +REMARK 500 1.302 +REMARK 500 M RES CSSEQI PSI PHI 1.303 +REMARK 500 ASN A 50 55.39 -97.86 1.304 +REMARK 500 1.305 +REMARK 500 REMARK: NULL 1.306 +REMARK 525 1.307 +REMARK 525 SOLVENT 1.308 +REMARK 525 1.309 +REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT 1.310 +REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST 1.311 +REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT 1.312 +REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE 1.313 +REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; 1.314 +REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE 1.315 +REMARK 525 NUMBER; I=INSERTION CODE): 1.316 +REMARK 525 1.317 +REMARK 525 M RES CSSEQI 1.318 +REMARK 525 HOH A 174 DISTANCE = 6.08 ANGSTROMS 1.319 +REMARK 525 HOH A 202 DISTANCE = 6.09 ANGSTROMS 1.320 +REMARK 525 HOH C 294 DISTANCE = 5.70 ANGSTROMS 1.321 +REMARK 525 HOH B 302 DISTANCE = 8.76 ANGSTROMS 1.322 +REMARK 525 HOH A 287 DISTANCE = 5.90 ANGSTROMS 1.323 +REMARK 525 HOH A 303 DISTANCE = 7.51 ANGSTROMS 1.324 +REMARK 525 HOH A 304 DISTANCE = 7.35 ANGSTROMS 1.325 +REMARK 525 HOH A 306 DISTANCE = 6.62 ANGSTROMS 1.326 +REMARK 620 1.327 +REMARK 620 METAL COORDINATION 1.328 +REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; 1.329 +REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): 1.330 +REMARK 620 1.331 +REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL 1.332 +REMARK 620 ZN A 81 ZN 1.333 +REMARK 620 N RES CSSEQI ATOM 1.334 +REMARK 620 1 SER A 1 N 1.335 +REMARK 620 2 HOH A 334 O 86.5 1.336 +REMARK 620 3 ASP A 7 OD2 132.0 125.2 1.337 +REMARK 620 4 SER A 1 O 68.1 149.9 84.7 1.338 +REMARK 620 5 ASP C 26 OD1 128.2 89.9 90.7 93.5 1.339 +REMARK 620 6 ASP C 26 OD2 78.0 79.0 136.8 80.1 50.7 1.340 +REMARK 620 N 1 2 3 4 5 1.341 +REMARK 620 1.342 +REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL 1.343 +REMARK 620 ZN B 82 ZN 1.344 +REMARK 620 N RES CSSEQI ATOM 1.345 +REMARK 620 1 ASP B 7 OD1 1.346 +REMARK 620 2 SER B 1 N 104.2 1.347 +REMARK 620 3 SER B 1 O 104.4 69.6 1.348 +REMARK 620 4 ASP B 7 OD2 48.3 131.3 79.4 1.349 +REMARK 620 5 ASP B 26 OD1 162.7 93.1 82.2 119.4 1.350 +REMARK 620 6 HOH B 210 O 93.6 98.8 160.4 119.1 82.8 1.351 +REMARK 620 N 1 2 3 4 5 1.352 +REMARK 620 1.353 +REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL 1.354 +REMARK 620 ZN C 83 ZN 1.355 +REMARK 620 N RES CSSEQI ATOM 1.356 +REMARK 620 1 SER C 1 N 1.357 +REMARK 620 2 SER C 1 O 75.1 1.358 +REMARK 620 3 ASP C 7 OD2 126.8 95.3 1.359 +REMARK 620 4 HOH C 194 O 90.5 159.4 105.2 1.360 +REMARK 620 5 ASP A 26 OD2 89.3 79.6 141.2 85.6 1.361 +REMARK 620 6 ASP A 26 OD1 141.7 93.1 89.9 89.3 52.5 1.362 +REMARK 620 N 1 2 3 4 5 1.363 +REMARK 800 1.364 +REMARK 800 SITE 1.365 +REMARK 800 SITE_IDENTIFIER: AC1 1.366 +REMARK 800 EVIDENCE_CODE: SOFTWARE 1.367 +REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 81 1.368 +REMARK 800 SITE_IDENTIFIER: AC2 1.369 +REMARK 800 EVIDENCE_CODE: SOFTWARE 1.370 +REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN B 82 1.371 +REMARK 800 SITE_IDENTIFIER: AC3 1.372 +REMARK 800 EVIDENCE_CODE: SOFTWARE 1.373 +REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN C 83 1.374 +REMARK 900 1.375 +REMARK 900 RELATED ENTRIES 1.376 +REMARK 900 RELATED ID: 1EQ7 RELATED DB: PDB 1.377 +REMARK 900 1EQ7 IS THE WILD TYPE PROTEIN STRUCTURE 1.378 +REMARK 900 RELATED ID: 1JCB RELATED DB: PDB 1.379 +REMARK 900 1JCB HAS THE FOLLOWING MUTATIONS: M30A,V34A 1.380 +REMARK 900 RELATED ID: 1JCD RELATED DB: PDB 1.381 +REMARK 900 1JCD HAS THE FOLLOWING MUTATIONS: I6A,L9A,V13A,L16A,V20A, 1.382 +REMARK 900 L23A,V27A,M30A,V34A,L48A,M51A 1.383 +DBREF 1JCC A 1 56 UNP P69776 LPP_ECOLI 22 77 1.384 +DBREF 1JCC B 1 56 UNP P69776 LPP_ECOLI 22 77 1.385 +DBREF 1JCC C 1 56 UNP P69776 LPP_ECOLI 22 77 1.386 +SEQADV 1JCC ALA A 13 UNP P69776 VAL 34 ENGINEERED 1.387 +SEQADV 1JCC ALA A 16 UNP P69776 LEU 37 ENGINEERED 1.388 +SEQADV 1JCC ALA A 20 UNP P69776 VAL 41 ENGINEERED 1.389 +SEQADV 1JCC ALA A 23 UNP P69776 LEU 44 ENGINEERED 1.390 +SEQADV 1JCC ALA A 27 UNP P69776 VAL 48 ENGINEERED 1.391 +SEQADV 1JCC ALA A 30 UNP P69776 MET 51 ENGINEERED 1.392 +SEQADV 1JCC ALA A 34 UNP P69776 VAL 55 ENGINEERED 1.393 +SEQADV 1JCC ALA B 13 UNP P69776 VAL 34 ENGINEERED 1.394 +SEQADV 1JCC ALA B 16 UNP P69776 LEU 37 ENGINEERED 1.395 +SEQADV 1JCC ALA B 20 UNP P69776 VAL 41 ENGINEERED 1.396 +SEQADV 1JCC ALA B 23 UNP P69776 LEU 44 ENGINEERED 1.397 +SEQADV 1JCC ALA B 27 UNP P69776 VAL 48 ENGINEERED 1.398 +SEQADV 1JCC ALA B 30 UNP P69776 MET 51 ENGINEERED 1.399 +SEQADV 1JCC ALA B 34 UNP P69776 VAL 55 ENGINEERED 1.400 +SEQADV 1JCC ALA C 13 UNP P69776 VAL 34 ENGINEERED 1.401 +SEQADV 1JCC ALA C 16 UNP P69776 LEU 37 ENGINEERED 1.402 +SEQADV 1JCC ALA C 20 UNP P69776 VAL 41 ENGINEERED 1.403 +SEQADV 1JCC ALA C 23 UNP P69776 LEU 44 ENGINEERED 1.404 +SEQADV 1JCC ALA C 27 UNP P69776 VAL 48 ENGINEERED 1.405 +SEQADV 1JCC ALA C 30 UNP P69776 MET 51 ENGINEERED 1.406 +SEQADV 1JCC ALA C 34 UNP P69776 VAL 55 ENGINEERED 1.407 +SEQRES 1 A 56 SER SER ASN ALA LYS ILE ASP GLN LEU SER SER ASP ALA 1.408 +SEQRES 2 A 56 GLN THR ALA ASN ALA LYS ALA ASP GLN ALA SER ASN ASP 1.409 +SEQRES 3 A 56 ALA ASN ALA ALA ARG SER ASP ALA GLN ALA ALA LYS ASP 1.410 +SEQRES 4 A 56 ASP ALA ALA ARG ALA ASN GLN ARG LEU ASP ASN MET ALA 1.411 +SEQRES 5 A 56 THR LYS TYR ARG 1.412 +SEQRES 1 B 56 SER SER ASN ALA LYS ILE ASP GLN LEU SER SER ASP ALA 1.413 +SEQRES 2 B 56 GLN THR ALA ASN ALA LYS ALA ASP GLN ALA SER ASN ASP 1.414 +SEQRES 3 B 56 ALA ASN ALA ALA ARG SER ASP ALA GLN ALA ALA LYS ASP 1.415 +SEQRES 4 B 56 ASP ALA ALA ARG ALA ASN GLN ARG LEU ASP ASN MET ALA 1.416 +SEQRES 5 B 56 THR LYS TYR ARG 1.417 +SEQRES 1 C 56 SER SER ASN ALA LYS ILE ASP GLN LEU SER SER ASP ALA 1.418 +SEQRES 2 C 56 GLN THR ALA ASN ALA LYS ALA ASP GLN ALA SER ASN ASP 1.419 +SEQRES 3 C 56 ALA ASN ALA ALA ARG SER ASP ALA GLN ALA ALA LYS ASP 1.420 +SEQRES 4 C 56 ASP ALA ALA ARG ALA ASN GLN ARG LEU ASP ASN MET ALA 1.421 +SEQRES 5 C 56 THR LYS TYR ARG 1.422 +HET ZN A 81 1 1.423 +HET ZN B 82 1 1.424 +HET ZN C 83 1 1.425 +HETNAM ZN ZINC ION 1.426 +FORMUL 4 ZN 3(ZN 2+) 1.427 +FORMUL 7 HOH *234(H2 O) 1.428 +HELIX 1 1 ASN A 3 ASN A 50 1 48 1.429 +HELIX 2 2 ASN B 3 MET B 51 1 49 1.430 +HELIX 3 3 ASN C 3 ASN C 50 1 48 1.431 +LINK ZN ZN A 81 N SER A 1 1555 1555 2.72 1.432 +LINK ZN ZN A 81 O HOH A 334 1555 1555 2.54 1.433 +LINK ZN ZN A 81 OD2 ASP A 7 1555 1555 2.41 1.434 +LINK ZN ZN A 81 O SER A 1 1555 1555 2.44 1.435 +LINK ZN ZN B 82 OD1 ASP B 7 1555 1555 2.75 1.436 +LINK ZN ZN B 82 N SER B 1 1555 1555 2.72 1.437 +LINK ZN ZN B 82 O SER B 1 1555 1555 2.32 1.438 +LINK ZN ZN B 82 OD2 ASP B 7 1555 1555 2.62 1.439 +LINK ZN ZN C 83 N SER C 1 1555 1555 2.41 1.440 +LINK ZN ZN C 83 O SER C 1 1555 1555 2.33 1.441 +LINK ZN ZN C 83 OD2 ASP C 7 1555 1555 2.24 1.442 +LINK ZN ZN C 83 O HOH C 194 1555 1555 2.34 1.443 +LINK ZN ZN A 81 OD1 ASP C 26 1555 4556 2.34 1.444 +LINK ZN ZN A 81 OD2 ASP C 26 1555 4556 2.74 1.445 +LINK ZN ZN B 82 OD1 ASP B 26 1555 2656 2.25 1.446 +LINK ZN ZN B 82 O HOH B 210 1555 2656 2.68 1.447 +LINK ZN ZN C 83 OD2 ASP A 26 1555 4546 2.62 1.448 +LINK ZN ZN C 83 OD1 ASP A 26 1555 4546 2.32 1.449 +SITE 1 AC1 4 SER A 1 ASP A 7 HOH A 334 ASP C 26 1.450 +SITE 1 AC2 4 SER B 1 ASP B 7 ASP B 26 HOH B 210 1.451 +SITE 1 AC3 4 ASP A 26 SER C 1 ASP C 7 HOH C 194 1.452 +CRYST1 62.388 33.322 71.979 90.00 102.55 90.00 C 1 2 1 12 1.453 +ORIGX1 1.000000 0.000000 0.000000 0.00000 1.454 +ORIGX2 0.000000 1.000000 0.000000 0.00000 1.455 +ORIGX3 0.000000 0.000000 1.000000 0.00000 1.456 +SCALE1 0.016029 0.000000 0.003567 0.00000 1.457 +SCALE2 0.000000 0.030010 0.000000 0.00000 1.458 +SCALE3 0.000000 0.000000 0.014233 0.00000 1.459 +ATOM 1 N SER A 1 5.341 6.787 52.531 1.00 30.93 N 1.460 +ATOM 2 CA SER A 1 6.670 6.462 53.126 1.00 28.61 C 1.461 +ATOM 3 C SER A 1 7.356 7.713 53.664 1.00 28.30 C 1.462 +ATOM 4 O SER A 1 7.441 8.739 52.991 1.00 25.79 O 1.463 +ATOM 5 CB SER A 1 7.570 5.801 52.079 1.00 29.39 C 1.464 +ATOM 6 OG SER A 1 8.851 5.515 52.615 1.00 29.28 O 1.465 +ATOM 7 N SER A 2 7.845 7.629 54.891 1.00 26.67 N 1.466 +ATOM 8 CA SER A 2 8.536 8.756 55.489 1.00 26.19 C 1.467 +ATOM 9 C SER A 2 9.968 8.789 54.949 1.00 25.39 C 1.468 +ATOM 10 O SER A 2 10.714 9.739 55.197 1.00 24.00 O 1.469 +ATOM 11 CB SER A 2 8.547 8.608 57.009 1.00 27.07 C 1.470 +ATOM 12 OG SER A 2 9.116 7.364 57.371 1.00 29.98 O 1.471 +ATOM 13 N ASN A 3 10.338 7.754 54.197 1.00 23.68 N 1.472 +ATOM 14 CA ASN A 3 11.677 7.650 53.615 1.00 23.10 C 1.473 +ATOM 15 C ASN A 3 11.708 8.251 52.210 1.00 22.89 C 1.474 +ATOM 16 O ASN A 3 11.178 7.667 51.258 1.00 22.78 O 1.475 +ATOM 17 CB ASN A 3 12.111 6.180 53.561 1.00 25.45 C 1.476 +ATOM 18 CG ASN A 3 13.564 6.009 53.151 1.00 26.64 C 1.477 +ATOM 19 OD1 ASN A 3 13.988 6.482 52.097 1.00 27.63 O 1.478 +ATOM 20 ND2 ASN A 3 14.333 5.314 53.984 1.00 27.49 N 1.479 +ATOM 21 N ALA A 4 12.342 9.414 52.083 1.00 21.43 N 1.480 +ATOM 22 CA ALA A 4 12.433 10.112 50.802 1.00 20.48 C 1.481 +ATOM 23 C ALA A 4 13.109 9.293 49.705 1.00 20.46 C 1.482 +ATOM 24 O ALA A 4 12.691 9.332 48.543 1.00 19.29 O 1.483 +ATOM 25 CB ALA A 4 13.171 11.433 50.986 1.00 21.73 C 1.484 +ATOM 26 N LYS A 5 14.152 8.553 50.067 1.00 20.26 N 1.485 +ATOM 27 CA LYS A 5 14.874 7.744 49.082 1.00 19.74 C 1.486 +ATOM 28 C LYS A 5 13.971 6.682 48.460 1.00 19.05 C 1.487 +ATOM 29 O LYS A 5 14.008 6.457 47.247 1.00 17.88 O 1.488 +ATOM 30 CB LYS A 5 16.088 7.080 49.736 1.00 20.39 C 1.489 +ATOM 31 CG LYS A 5 16.847 6.103 48.847 1.00 20.79 C 1.490 +ATOM 32 CD LYS A 5 17.501 6.789 47.664 1.00 22.45 C 1.491 +ATOM 33 CE LYS A 5 18.411 5.820 46.920 1.00 23.30 C 1.492 +ATOM 34 NZ LYS A 5 18.972 6.423 45.681 1.00 26.14 N 1.493 +ATOM 35 N ILE A 6 13.161 6.033 49.289 1.00 17.27 N 1.494 +ATOM 36 CA ILE A 6 12.254 5.009 48.794 1.00 17.86 C 1.495 +ATOM 37 C ILE A 6 11.224 5.630 47.847 1.00 17.56 C 1.496 +ATOM 38 O ILE A 6 10.875 5.026 46.833 1.00 17.47 O 1.497 +ATOM 39 CB ILE A 6 11.553 4.278 49.959 1.00 17.62 C 1.498 +ATOM 40 CG1 ILE A 6 12.582 3.448 50.730 1.00 18.99 C 1.499 +ATOM 41 CG2 ILE A 6 10.467 3.347 49.429 1.00 18.54 C 1.500 +ATOM 42 CD1 ILE A 6 12.032 2.824 51.991 1.00 22.40 C 1.501 +ATOM 43 N ASP A 7 10.747 6.835 48.153 1.00 15.33 N 1.502 +ATOM 44 CA ASP A 7 9.775 7.479 47.261 1.00 17.54 C 1.503 +ATOM 45 C ASP A 7 10.394 7.818 45.912 1.00 16.54 C 1.504 +ATOM 46 O ASP A 7 9.763 7.648 44.865 1.00 17.43 O 1.505 +ATOM 47 CB ASP A 7 9.226 8.769 47.860 1.00 19.65 C 1.506 +ATOM 48 CG ASP A 7 8.266 8.521 48.987 1.00 22.08 C 1.507 +ATOM 49 OD1 ASP A 7 7.568 7.478 48.972 1.00 22.40 O 1.508 +ATOM 50 OD2 ASP A 7 8.204 9.391 49.880 1.00 24.72 O 1.509 +ATOM 51 N GLN A 8 11.624 8.320 45.945 1.00 15.76 N 1.510 +ATOM 52 CA GLN A 8 12.338 8.683 44.726 1.00 17.47 C 1.511 +ATOM 53 C GLN A 8 12.571 7.456 43.849 1.00 16.36 C 1.512 +ATOM 54 O GLN A 8 12.440 7.525 42.623 1.00 16.31 O 1.513 +ATOM 55 CB GLN A 8 13.679 9.332 45.077 1.00 19.41 C 1.514 +ATOM 56 CG GLN A 8 14.555 9.631 43.872 1.00 26.06 C 1.515 +ATOM 57 CD GLN A 8 15.904 10.187 44.270 1.00 30.55 C 1.516 +ATOM 58 OE1 GLN A 8 16.653 9.552 45.019 1.00 34.92 O 1.517 +ATOM 59 NE2 GLN A 8 16.227 11.378 43.770 1.00 33.86 N 1.518 +ATOM 60 N LEU A 9 12.916 6.334 44.471 1.00 15.99 N 1.519 +ATOM 61 CA LEU A 9 13.151 5.107 43.713 1.00 16.34 C 1.520 +ATOM 62 C LEU A 9 11.857 4.568 43.129 1.00 16.69 C 1.521 +ATOM 63 O LEU A 9 11.843 4.038 42.020 1.00 15.67 O 1.522 +ATOM 64 CB LEU A 9 13.777 4.032 44.601 1.00 17.76 C 1.523 +ATOM 65 CG LEU A 9 15.212 4.302 45.050 1.00 19.97 C 1.524 +ATOM 66 CD1 LEU A 9 15.663 3.191 45.978 1.00 21.43 C 1.525 +ATOM 67 CD2 LEU A 9 16.124 4.408 43.836 1.00 23.86 C 1.526 +ATOM 68 N SER A 10 10.772 4.688 43.887 1.00 15.38 N 1.527 +ATOM 69 CA SER A 10 9.478 4.205 43.419 1.00 16.27 C 1.528 +ATOM 70 C SER A 10 9.069 4.990 42.174 1.00 17.33 C 1.529 +ATOM 71 O SER A 10 8.572 4.415 41.202 1.00 16.71 O 1.530 +ATOM 72 CB SER A 10 8.417 4.366 44.515 1.00 17.47 C 1.531 +ATOM 73 OG SER A 10 7.140 3.948 44.053 1.00 20.53 O 1.532 +ATOM 74 N SER A 11 9.292 6.302 42.209 1.00 16.55 N 1.533 +ATOM 75 CA SER A 11 8.963 7.178 41.090 1.00 17.26 C 1.534 +ATOM 76 C SER A 11 9.825 6.860 39.869 1.00 17.29 C 1.535 +ATOM 77 O SER A 11 9.304 6.689 38.760 1.00 16.68 O 1.536 +ATOM 78 CB SER A 11 9.161 8.641 41.495 1.00 18.17 C 1.537 +ATOM 79 OG SER A 11 8.824 9.522 40.436 1.00 21.12 O 1.538 +ATOM 80 N ASP A 12 11.141 6.775 40.069 1.00 15.00 N 1.539 +ATOM 81 CA ASP A 12 12.059 6.479 38.963 1.00 16.38 C 1.540 +ATOM 82 C ASP A 12 11.768 5.131 38.295 1.00 15.01 C 1.541 +ATOM 83 O ASP A 12 11.880 5.001 37.070 1.00 14.57 O 1.542 +ATOM 84 CB ASP A 12 13.523 6.471 39.435 1.00 17.61 C 1.543 +ATOM 85 CG ASP A 12 14.019 7.836 39.887 1.00 20.26 C 1.544 +ATOM 86 OD1 ASP A 12 13.513 8.871 39.405 1.00 20.73 O 1.545 +ATOM 87 OD2 ASP A 12 14.949 7.867 40.723 1.00 23.08 O 1.546 +ATOM 88 N ALA A 13 11.407 4.125 39.089 1.00 13.68 N 1.547 +ATOM 89 CA ALA A 13 11.136 2.806 38.531 1.00 15.98 C 1.548 +ATOM 90 C ALA A 13 9.878 2.837 37.673 1.00 16.20 C 1.549 +ATOM 91 O ALA A 13 9.830 2.222 36.606 1.00 15.47 O 1.550 +ATOM 92 CB ALA A 13 10.984 1.780 39.646 1.00 16.88 C 1.551 +ATOM 93 N GLN A 14 8.860 3.551 38.143 1.00 16.91 N 1.552 +ATOM 94 CA GLN A 14 7.604 3.656 37.405 1.00 18.32 C 1.553 +ATOM 95 C GLN A 14 7.822 4.432 36.105 1.00 18.22 C 1.554 +ATOM 96 O GLN A 14 7.257 4.089 35.057 1.00 19.65 O 1.555 +ATOM 97 CB GLN A 14 6.540 4.347 38.271 1.00 21.36 C 1.556 +ATOM 98 CG GLN A 14 5.298 4.434 37.585 1.00 26.45 C 1.557 +ATOM 99 N THR A 15 8.643 5.476 36.172 1.00 17.55 N 1.558 +ATOM 100 CA THR A 15 8.941 6.294 34.998 1.00 17.22 C 1.559 +ATOM 101 C THR A 15 9.706 5.483 33.941 1.00 16.37 C 1.560 +ATOM 102 O THR A 15 9.449 5.607 32.733 1.00 17.45 O 1.561 +ATOM 103 CB THR A 15 9.763 7.543 35.398 1.00 17.89 C 1.562 +ATOM 104 OG1 THR A 15 8.958 8.390 36.229 1.00 18.40 O 1.563 +ATOM 105 CG2 THR A 15 10.200 8.328 34.161 1.00 19.34 C 1.564 +ATOM 106 N ALA A 16 10.643 4.650 34.386 1.00 14.99 N 1.565 +ATOM 107 CA ALA A 16 11.404 3.831 33.445 1.00 14.22 C 1.566 +ATOM 108 C ALA A 16 10.478 2.849 32.726 1.00 14.09 C 1.567 +ATOM 109 O ALA A 16 10.607 2.621 31.525 1.00 14.25 O 1.568 +ATOM 110 CB ALA A 16 12.507 3.063 34.183 1.00 13.54 C 1.569 +ATOM 111 N ASN A 17 9.540 2.270 33.467 1.00 13.74 N 1.570 +ATOM 112 CA ASN A 17 8.618 1.316 32.879 1.00 16.29 C 1.571 +ATOM 113 C ASN A 17 7.687 1.992 31.877 1.00 15.64 C 1.572 +ATOM 114 O ASN A 17 7.348 1.411 30.849 1.00 16.45 O 1.573 +ATOM 115 CB ASN A 17 7.796 0.629 33.971 1.00 18.98 C 1.574 +ATOM 116 CG ASN A 17 6.901 -0.458 33.415 1.00 22.40 C 1.575 +ATOM 117 OD1 ASN A 17 7.379 -1.429 32.829 1.00 23.71 O 1.576 +ATOM 118 ND2 ASN A 17 5.592 -0.296 33.588 1.00 27.98 N 1.577 +ATOM 119 N ALA A 18 7.271 3.218 32.170 1.00 15.34 N 1.578 +ATOM 120 CA ALA A 18 6.382 3.936 31.258 1.00 16.75 C 1.579 +ATOM 121 C ALA A 18 7.117 4.306 29.968 1.00 16.76 C 1.580 +ATOM 122 O ALA A 18 6.545 4.245 28.872 1.00 17.33 O 1.581 +ATOM 123 CB ALA A 18 5.835 5.189 31.937 1.00 15.57 C 1.582 +ATOM 124 N LYS A 19 8.388 4.684 30.097 1.00 16.03 N 1.583 +ATOM 125 CA LYS A 19 9.194 5.063 28.935 1.00 15.97 C 1.584 +ATOM 126 C LYS A 19 9.464 3.837 28.059 1.00 13.97 C 1.585 +ATOM 127 O LYS A 19 9.485 3.928 26.834 1.00 13.77 O 1.586 +ATOM 128 CB LYS A 19 10.522 5.683 29.385 1.00 16.10 C 1.587 +ATOM 129 CG LYS A 19 11.257 6.154 28.269 1.00 24.11 C 1.588 +ATOM 130 N ALA A 20 9.663 2.686 28.689 1.00 12.05 N 1.589 +ATOM 131 CA ALA A 20 9.916 1.465 27.927 1.00 11.72 C 1.590 +ATOM 132 C ALA A 20 8.666 1.115 27.107 1.00 12.78 C 1.591 +ATOM 133 O ALA A 20 8.779 0.643 25.966 1.00 12.59 O 1.592 +ATOM 134 CB ALA A 20 10.291 0.319 28.872 1.00 11.16 C 1.593 +ATOM 135 N ASP A 21 7.477 1.343 27.678 1.00 14.57 N 1.594 +ATOM 136 CA ASP A 21 6.234 1.073 26.946 1.00 15.33 C 1.595 +ATOM 137 C ASP A 21 6.196 1.948 25.699 1.00 16.54 C 1.596 +ATOM 138 O ASP A 21 5.840 1.476 24.614 1.00 15.96 O 1.597 +ATOM 139 CB ASP A 21 4.983 1.390 27.778 1.00 18.99 C 1.598 +ATOM 140 CG ASP A 21 4.668 0.329 28.805 1.00 23.02 C 1.599 +ATOM 141 OD1 ASP A 21 5.085 -0.833 28.615 1.00 24.96 O 1.600 +ATOM 142 OD2 ASP A 21 3.980 0.662 29.797 1.00 24.05 O 1.601 +ATOM 143 N GLN A 22 6.551 3.223 25.858 1.00 15.33 N 1.602 +ATOM 144 CA GLN A 22 6.565 4.162 24.732 1.00 15.77 C 1.603 +ATOM 145 C GLN A 22 7.504 3.660 23.632 1.00 14.95 C 1.604 +ATOM 146 O GLN A 22 7.161 3.688 22.444 1.00 15.25 O 1.605 +ATOM 147 CB GLN A 22 7.038 5.562 25.173 1.00 17.01 C 1.606 +ATOM 148 CG GLN A 22 6.012 6.426 25.909 1.00 19.16 C 1.607 +ATOM 149 CD GLN A 22 6.578 7.781 26.353 1.00 21.87 C 1.608 +ATOM 150 OE1 GLN A 22 5.842 8.645 26.831 1.00 23.32 O 1.609 +ATOM 151 NE2 GLN A 22 7.887 7.966 26.199 1.00 20.69 N 1.610 +ATOM 152 N ALA A 23 8.698 3.224 24.029 1.00 13.41 N 1.611 +ATOM 153 CA ALA A 23 9.684 2.731 23.075 1.00 12.28 C 1.612 +ATOM 154 C ALA A 23 9.187 1.482 22.353 1.00 13.28 C 1.613 +ATOM 155 O ALA A 23 9.429 1.326 21.159 1.00 12.83 O 1.614 +ATOM 156 CB ALA A 23 11.012 2.452 23.782 1.00 11.71 C 1.615 +ATOM 157 N SER A 24 8.496 0.599 23.075 1.00 12.70 N 1.616 +ATOM 158 CA SER A 24 7.953 -0.622 22.483 1.00 14.77 C 1.617 +ATOM 159 C SER A 24 6.972 -0.265 21.371 1.00 14.57 C 1.618 +ATOM 160 O SER A 24 7.036 -0.814 20.269 1.00 15.34 O 1.619 +ATOM 161 CB SER A 24 7.203 -1.459 23.533 1.00 16.03 C 1.620 +ATOM 162 OG SER A 24 8.062 -1.877 24.575 1.00 20.33 O 1.621 +ATOM 163 N ASN A 25 6.057 0.656 21.664 1.00 13.62 N 1.622 +ATOM 164 CA ASN A 25 5.063 1.043 20.670 1.00 16.01 C 1.623 +ATOM 165 C ASN A 25 5.690 1.660 19.429 1.00 13.81 C 1.624 +ATOM 166 O ASN A 25 5.266 1.371 18.306 1.00 13.88 O 1.625 +ATOM 167 CB ASN A 25 4.043 2.008 21.277 1.00 19.07 C 1.626 +ATOM 168 CG ASN A 25 3.183 1.349 22.335 1.00 22.75 C 1.627 +ATOM 169 OD1 ASN A 25 2.835 0.172 22.224 1.00 25.99 O 1.628 +ATOM 170 ND2 ASN A 25 2.820 2.108 23.363 1.00 26.08 N 1.629 +ATOM 171 N ASP A 26 6.713 2.488 19.628 1.00 13.65 N 1.630 +ATOM 172 CA ASP A 26 7.387 3.120 18.504 1.00 13.00 C 1.631 +ATOM 173 C ASP A 26 8.176 2.117 17.678 1.00 14.09 C 1.632 +ATOM 174 O ASP A 26 8.197 2.213 16.454 1.00 14.25 O 1.633 +ATOM 175 CB ASP A 26 8.303 4.229 18.992 1.00 14.99 C 1.634 +ATOM 176 CG ASP A 26 7.546 5.469 19.382 1.00 16.14 C 1.635 +ATOM 177 OD1 ASP A 26 8.098 6.233 20.190 1.00 18.44 O 1.636 +ATOM 178 OD2 ASP A 26 6.414 5.693 18.881 1.00 16.06 O 1.637 +ATOM 179 N ALA A 27 8.807 1.143 18.336 1.00 12.86 N 1.638 +ATOM 180 CA ALA A 27 9.575 0.142 17.609 1.00 13.10 C 1.639 +ATOM 181 C ALA A 27 8.649 -0.708 16.750 1.00 14.36 C 1.640 +ATOM 182 O ALA A 27 8.987 -1.053 15.615 1.00 11.69 O 1.641 +ATOM 183 CB ALA A 27 10.359 -0.737 18.577 1.00 13.17 C 1.642 +ATOM 184 N ASN A 28 7.472 -1.032 17.289 1.00 13.41 N 1.643 +ATOM 185 CA ASN A 28 6.496 -1.825 16.557 1.00 14.91 C 1.644 +ATOM 186 C ASN A 28 6.004 -1.056 15.325 1.00 15.22 C 1.645 +ATOM 187 O ASN A 28 5.875 -1.629 14.236 1.00 14.62 O 1.646 +ATOM 188 CB ASN A 28 5.319 -2.187 17.476 1.00 17.55 C 1.647 +ATOM 189 CG ASN A 28 4.196 -2.883 16.739 1.00 19.60 C 1.648 +ATOM 190 OD1 ASN A 28 3.242 -2.242 16.289 1.00 24.13 O 1.649 +ATOM 191 ND2 ASN A 28 4.310 -4.200 16.592 1.00 19.77 N 1.650 +ATOM 192 N ALA A 29 5.735 0.238 15.494 1.00 13.76 N 1.651 +ATOM 193 CA ALA A 29 5.277 1.077 14.382 1.00 13.55 C 1.652 +ATOM 194 C ALA A 29 6.338 1.146 13.287 1.00 14.33 C 1.653 +ATOM 195 O ALA A 29 6.016 1.100 12.099 1.00 12.42 O 1.654 +ATOM 196 CB ALA A 29 4.951 2.478 14.877 1.00 14.46 C 1.655 +ATOM 197 N ALA A 30 7.605 1.246 13.688 1.00 13.28 N 1.656 +ATOM 198 CA ALA A 30 8.707 1.310 12.729 1.00 13.96 C 1.657 +ATOM 199 C ALA A 30 8.841 0.021 11.927 1.00 12.91 C 1.658 +ATOM 200 O ALA A 30 9.170 0.056 10.739 1.00 14.24 O 1.659 +ATOM 201 CB ALA A 30 10.014 1.592 13.448 1.00 13.08 C 1.660 +ATOM 202 N ARG A 31 8.611 -1.119 12.573 1.00 12.69 N 1.661 +ATOM 203 CA ARG A 31 8.719 -2.397 11.870 1.00 12.31 C 1.662 +ATOM 204 C ARG A 31 7.621 -2.527 10.819 1.00 13.06 C 1.663 +ATOM 205 O ARG A 31 7.866 -3.015 9.711 1.00 13.77 O 1.664 +ATOM 206 CB ARG A 31 8.649 -3.578 12.854 1.00 11.40 C 1.665 +ATOM 207 CG ARG A 31 9.889 -3.710 13.742 1.00 14.17 C 1.666 +ATOM 208 CD ARG A 31 10.026 -5.120 14.322 1.00 17.41 C 1.667 +ATOM 209 NE ARG A 31 10.286 -6.111 13.277 1.00 19.86 N 1.668 +ATOM 210 CZ ARG A 31 10.821 -7.312 13.492 1.00 20.42 C 1.669 +ATOM 211 NH1 ARG A 31 11.160 -7.691 14.721 1.00 19.16 N 1.670 +ATOM 212 NH2 ARG A 31 11.031 -8.131 12.469 1.00 21.03 N 1.671 +ATOM 213 N SER A 32 6.420 -2.069 11.166 1.00 14.56 N 1.672 +ATOM 214 CA SER A 32 5.276 -2.124 10.268 1.00 14.92 C 1.673 +ATOM 215 C SER A 32 5.489 -1.231 9.055 1.00 15.18 C 1.674 +ATOM 216 O SER A 32 5.213 -1.638 7.925 1.00 16.24 O 1.675 +ATOM 217 CB SER A 32 4.001 -1.695 11.001 1.00 16.67 C 1.676 +ATOM 218 OG SER A 32 2.882 -1.774 10.137 1.00 22.66 O 1.677 +ATOM 219 N ASP A 33 5.971 -0.013 9.288 1.00 13.34 N 1.678 +ATOM 220 CA ASP A 33 6.221 0.916 8.186 1.00 13.38 C 1.679 +ATOM 221 C ASP A 33 7.370 0.419 7.310 1.00 13.11 C 1.680 +ATOM 222 O ASP A 33 7.336 0.576 6.089 1.00 12.92 O 1.681 +ATOM 223 CB ASP A 33 6.553 2.325 8.705 1.00 13.82 C 1.682 +ATOM 224 CG ASP A 33 5.340 3.069 9.253 1.00 17.81 C 1.683 +ATOM 225 OD1 ASP A 33 4.184 2.702 8.933 1.00 16.68 O 1.684 +ATOM 226 OD2 ASP A 33 5.557 4.053 10.000 1.00 17.93 O 1.685 +ATOM 227 N ALA A 34 8.395 -0.178 7.922 1.00 11.07 N 1.686 +ATOM 228 CA ALA A 34 9.526 -0.682 7.142 1.00 11.48 C 1.687 +ATOM 229 C ALA A 34 9.083 -1.834 6.241 1.00 12.28 C 1.688 +ATOM 230 O ALA A 34 9.563 -1.974 5.109 1.00 12.42 O 1.689 +ATOM 231 CB ALA A 34 10.651 -1.145 8.077 1.00 12.33 C 1.690 +ATOM 232 N GLN A 35 8.180 -2.669 6.747 1.00 11.32 N 1.691 +ATOM 233 CA GLN A 35 7.679 -3.798 5.968 1.00 12.99 C 1.692 +ATOM 234 C GLN A 35 6.888 -3.271 4.774 1.00 14.25 C 1.693 +ATOM 235 O GLN A 35 6.995 -3.787 3.656 1.00 14.06 O 1.694 +ATOM 236 CB GLN A 35 6.770 -4.688 6.823 1.00 14.96 C 1.695 +ATOM 237 CG GLN A 35 6.160 -5.857 6.048 1.00 20.69 C 1.696 +ATOM 238 CD GLN A 35 7.214 -6.800 5.498 1.00 23.00 C 1.697 +ATOM 239 OE1 GLN A 35 7.222 -7.121 4.306 1.00 24.42 O 1.698 +ATOM 240 NE2 GLN A 35 8.110 -7.252 6.365 1.00 24.51 N 1.699 +ATOM 241 N ALA A 36 6.078 -2.249 5.013 1.00 12.95 N 1.700 +ATOM 242 CA ALA A 36 5.295 -1.672 3.925 1.00 13.99 C 1.701 +ATOM 243 C ALA A 36 6.229 -1.089 2.871 1.00 13.10 C 1.702 +ATOM 244 O ALA A 36 5.955 -1.188 1.675 1.00 13.38 O 1.703 +ATOM 245 CB ALA A 36 4.353 -0.592 4.452 1.00 11.99 C 1.704 +ATOM 246 N ALA A 37 7.333 -0.482 3.299 1.00 11.96 N 1.705 +ATOM 247 CA ALA A 37 8.278 0.082 2.335 1.00 12.41 C 1.706 +ATOM 248 C ALA A 37 8.924 -1.035 1.511 1.00 12.61 C 1.707 +ATOM 249 O ALA A 37 9.150 -0.874 0.310 1.00 13.20 O 1.708 +ATOM 250 CB ALA A 37 9.354 0.911 3.055 1.00 12.05 C 1.709 +ATOM 251 N LYS A 38 9.216 -2.173 2.147 1.00 12.71 N 1.710 +ATOM 252 CA LYS A 38 9.809 -3.301 1.421 1.00 14.45 C 1.711 +ATOM 253 C LYS A 38 8.843 -3.802 0.362 1.00 14.48 C 1.712 +ATOM 254 O LYS A 38 9.241 -4.095 -0.776 1.00 15.21 O 1.713 +ATOM 255 CB LYS A 38 10.136 -4.459 2.371 1.00 16.48 C 1.714 +ATOM 256 CG LYS A 38 11.410 -4.265 3.162 1.00 21.19 C 1.715 +ATOM 257 CD LYS A 38 11.670 -5.434 4.108 1.00 25.80 C 1.716 +ATOM 258 CE LYS A 38 11.718 -6.763 3.369 1.00 26.46 C 1.717 +ATOM 259 NZ LYS A 38 11.865 -7.893 4.329 1.00 31.18 N 1.718 +ATOM 260 N ASP A 39 7.571 -3.918 0.737 1.00 14.62 N 1.719 +ATOM 261 CA ASP A 39 6.566 -4.400 -0.202 1.00 16.85 C 1.720 +ATOM 262 C ASP A 39 6.415 -3.455 -1.402 1.00 15.81 C 1.721 +ATOM 263 O ASP A 39 6.253 -3.915 -2.541 1.00 16.27 O 1.722 +ATOM 264 CB ASP A 39 5.197 -4.577 0.481 1.00 18.06 C 1.723 +ATOM 265 CG ASP A 39 5.204 -5.629 1.596 1.00 22.71 C 1.724 +ATOM 266 OD1 ASP A 39 6.123 -6.474 1.651 1.00 23.73 O 1.725 +ATOM 267 OD2 ASP A 39 4.263 -5.616 2.423 1.00 24.25 O 1.726 +ATOM 268 N ASP A 40 6.467 -2.145 -1.163 1.00 13.66 N 1.727 +ATOM 269 CA ASP A 40 6.314 -1.180 -2.255 1.00 13.08 C 1.728 +ATOM 270 C ASP A 40 7.525 -1.178 -3.201 1.00 12.91 C 1.729 +ATOM 271 O ASP A 40 7.370 -0.966 -4.413 1.00 12.22 O 1.730 +ATOM 272 CB ASP A 40 6.071 0.235 -1.700 1.00 13.87 C 1.731 +ATOM 273 CG ASP A 40 5.361 1.153 -2.700 1.00 14.03 C 1.732 +ATOM 274 OD1 ASP A 40 5.700 2.353 -2.752 1.00 13.57 O 1.733 +ATOM 275 OD2 ASP A 40 4.447 0.686 -3.424 1.00 15.41 O 1.734 +ATOM 276 N ALA A 41 8.728 -1.402 -2.670 1.00 11.26 N 1.735 +ATOM 277 CA ALA A 41 9.914 -1.446 -3.523 1.00 11.91 C 1.736 +ATOM 278 C ALA A 41 9.822 -2.709 -4.388 1.00 12.30 C 1.737 +ATOM 279 O ALA A 41 10.267 -2.722 -5.539 1.00 12.20 O 1.738 +ATOM 280 CB ALA A 41 11.200 -1.483 -2.676 1.00 10.57 C 1.739 +ATOM 281 N ALA A 42 9.249 -3.770 -3.820 1.00 12.39 N 1.740 +ATOM 282 CA ALA A 42 9.089 -5.020 -4.553 1.00 13.39 C 1.741 +ATOM 283 C ALA A 42 8.079 -4.804 -5.686 1.00 13.88 C 1.742 +ATOM 284 O ALA A 42 8.217 -5.362 -6.783 1.00 13.34 O 1.743 +ATOM 285 CB ALA A 42 8.601 -6.128 -3.599 1.00 13.92 C 1.744 +ATOM 286 N ARG A 43 7.069 -3.980 -5.423 1.00 12.53 N 1.745 +ATOM 287 CA ARG A 43 6.045 -3.685 -6.431 1.00 13.49 C 1.746 +ATOM 288 C ARG A 43 6.694 -3.010 -7.645 1.00 14.39 C 1.747 +ATOM 289 O ARG A 43 6.353 -3.306 -8.798 1.00 14.65 O 1.748 +ATOM 290 CB ARG A 43 4.970 -2.767 -5.833 1.00 14.68 C 1.749 +ATOM 291 CG ARG A 43 3.856 -2.355 -6.808 1.00 15.02 C 1.750 +ATOM 292 CD ARG A 43 2.720 -1.619 -6.098 1.00 17.36 C 1.751 +ATOM 293 NE ARG A 43 2.999 -0.212 -5.797 1.00 16.78 N 1.752 +ATOM 294 CZ ARG A 43 2.815 0.793 -6.651 1.00 17.44 C 1.753 +ATOM 295 NH1 ARG A 43 2.352 0.561 -7.876 1.00 19.72 N 1.754 +ATOM 296 NH2 ARG A 43 3.083 2.042 -6.277 1.00 18.56 N 1.755 +ATOM 297 N ALA A 44 7.634 -2.104 -7.384 1.00 13.74 N 1.756 +ATOM 298 CA ALA A 44 8.333 -1.400 -8.459 1.00 14.13 C 1.757 +ATOM 299 C ALA A 44 9.129 -2.371 -9.332 1.00 14.09 C 1.758 +ATOM 300 O ALA A 44 9.087 -2.299 -10.562 1.00 16.32 O 1.759 +ATOM 301 CB ALA A 44 9.267 -0.338 -7.870 1.00 13.24 C 1.760 +ATOM 302 N ASN A 45 9.858 -3.281 -8.695 1.00 14.48 N 1.761 +ATOM 303 CA ASN A 45 10.654 -4.242 -9.439 1.00 13.87 C 1.762 +ATOM 304 C ASN A 45 9.782 -5.243 -10.202 1.00 14.40 C 1.763 +ATOM 305 O ASN A 45 10.176 -5.732 -11.257 1.00 14.21 O 1.764 +ATOM 306 CB ASN A 45 11.645 -4.939 -8.493 1.00 13.91 C 1.765 +ATOM 307 CG ASN A 45 12.894 -4.099 -8.254 1.00 13.09 C 1.766 +ATOM 308 OD1 ASN A 45 13.685 -3.897 -9.170 1.00 13.23 O 1.767 +ATOM 309 ND2 ASN A 45 13.065 -3.587 -7.026 1.00 12.24 N 1.768 +ATOM 310 N GLN A 46 8.595 -5.537 -9.685 1.00 14.48 N 1.769 +ATOM 311 CA GLN A 46 7.695 -6.453 -10.393 1.00 17.48 C 1.770 +ATOM 312 C GLN A 46 7.197 -5.755 -11.660 1.00 17.93 C 1.771 +ATOM 313 O GLN A 46 7.103 -6.372 -12.729 1.00 19.11 O 1.772 +ATOM 314 CB GLN A 46 6.507 -6.841 -9.505 1.00 17.63 C 1.773 +ATOM 315 CG GLN A 46 5.605 -7.693 -10.201 1.00 27.50 C 1.774 +ATOM 316 N ARG A 47 6.880 -4.467 -11.549 1.00 17.08 N 1.775 +ATOM 317 CA ARG A 47 6.405 -3.710 -12.707 1.00 17.39 C 1.776 +ATOM 318 C ARG A 47 7.482 -3.714 -13.806 1.00 18.34 C 1.777 +ATOM 319 O ARG A 47 7.170 -3.834 -14.997 1.00 19.21 O 1.778 +ATOM 320 CB ARG A 47 6.055 -2.276 -12.295 1.00 16.85 C 1.779 +ATOM 321 CG ARG A 47 4.906 -2.181 -11.293 1.00 17.50 C 1.780 +ATOM 322 CD ARG A 47 4.740 -0.760 -10.744 1.00 17.47 C 1.781 +ATOM 323 NE ARG A 47 4.335 0.202 -11.771 1.00 20.47 N 1.782 +ATOM 324 CZ ARG A 47 4.236 1.514 -11.569 1.00 22.58 C 1.783 +ATOM 325 NH1 ARG A 47 4.520 2.030 -10.377 1.00 21.23 N 1.784 +ATOM 326 NH2 ARG A 47 3.841 2.319 -12.555 1.00 22.99 N 1.785 +ATOM 327 N LEU A 48 8.747 -3.596 -13.408 1.00 16.61 N 1.786 +ATOM 328 CA LEU A 48 9.847 -3.607 -14.370 1.00 18.70 C 1.787 +ATOM 329 C LEU A 48 10.024 -4.998 -14.991 1.00 20.95 C 1.788 +ATOM 330 O LEU A 48 10.351 -5.113 -16.178 1.00 22.27 O 1.789 +ATOM 331 CB LEU A 48 11.151 -3.147 -13.700 1.00 19.45 C 1.790 +ATOM 332 CG LEU A 48 11.254 -1.631 -13.495 1.00 19.78 C 1.791 +ATOM 333 CD1 LEU A 48 12.281 -1.298 -12.409 1.00 19.39 C 1.792 +ATOM 334 CD2 LEU A 48 11.623 -0.969 -14.825 1.00 21.36 C 1.793 +ATOM 335 N ASP A 49 9.810 -6.052 -14.202 1.00 21.05 N 1.794 +ATOM 336 CA ASP A 49 9.936 -7.416 -14.730 1.00 22.75 C 1.795 +ATOM 337 C ASP A 49 8.954 -7.595 -15.877 1.00 26.00 C 1.796 +ATOM 338 O ASP A 49 9.199 -8.359 -16.811 1.00 27.20 O 1.797 +ATOM 339 CB ASP A 49 9.621 -8.473 -13.661 1.00 20.50 C 1.798 +ATOM 340 CG ASP A 49 10.718 -8.619 -12.626 1.00 19.95 C 1.799 +ATOM 341 OD1 ASP A 49 11.860 -8.191 -12.888 1.00 19.60 O 1.800 +ATOM 342 OD2 ASP A 49 10.432 -9.184 -11.545 1.00 20.22 O 1.801 +ATOM 343 N ASN A 50 7.836 -6.885 -15.794 1.00 28.38 N 1.802 +ATOM 344 CA ASN A 50 6.798 -6.954 -16.815 1.00 32.31 C 1.803 +ATOM 345 C ASN A 50 6.893 -5.803 -17.820 1.00 33.58 C 1.804 +ATOM 346 O ASN A 50 5.932 -5.063 -18.020 1.00 36.74 O 1.805 +ATOM 347 CB ASN A 50 5.429 -6.949 -16.137 1.00 32.16 C 1.806 +ATOM 348 CG ASN A 50 5.227 -8.152 -15.235 1.00 33.55 C 1.807 +ATOM 349 OD1 ASN A 50 4.507 -8.085 -14.238 1.00 34.29 O 1.808 +ATOM 350 ND2 ASN A 50 5.857 -9.268 -15.588 1.00 34.94 N 1.809 +ATOM 351 N MET A 51 8.059 -5.656 -18.443 1.00 35.30 N 1.810 +ATOM 352 CA MET A 51 8.289 -4.612 -19.440 1.00 36.08 C 1.811 +ATOM 353 C MET A 51 9.241 -5.107 -20.525 1.00 35.80 C 1.812 +ATOM 354 CB MET A 51 8.875 -3.355 -18.785 1.00 36.94 C 1.813 +ATOM 355 CG MET A 51 7.855 -2.488 -18.061 1.00 38.46 C 1.814 +ATOM 356 SD MET A 51 8.600 -1.043 -17.261 1.00 42.65 S 1.815 +ATOM 357 CE MET A 51 8.952 -0.014 -18.679 1.00 39.10 C 1.816 +TER 358 MET A 51 1.817 +ATOM 359 N SER B 1 24.809 5.225 51.530 1.00 37.62 N 1.818 +ATOM 360 CA SER B 1 23.909 4.484 52.447 1.00 36.57 C 1.819 +ATOM 361 C SER B 1 24.510 3.183 52.933 1.00 36.01 C 1.820 +ATOM 362 O SER B 1 25.185 2.437 52.220 1.00 33.06 O 1.821 +ATOM 363 CB SER B 1 22.571 4.210 51.768 1.00 36.45 C 1.822 +ATOM 364 OG SER B 1 21.984 2.983 52.189 1.00 36.35 O 1.823 +ATOM 365 N SER B 2 24.258 2.858 54.183 1.00 35.68 N 1.824 +ATOM 366 CA SER B 2 24.805 1.606 54.651 1.00 36.50 C 1.825 +ATOM 367 C SER B 2 23.823 0.467 54.439 1.00 36.17 C 1.826 +ATOM 368 O SER B 2 24.124 -0.716 54.709 1.00 37.32 O 1.827 +ATOM 369 CB SER B 2 25.184 1.708 56.111 1.00 37.27 C 1.828 +ATOM 370 OG SER B 2 25.831 0.491 56.455 1.00 39.46 O 1.829 +ATOM 371 N ASN B 3 22.638 0.804 53.927 1.00 35.47 N 1.830 +ATOM 372 CA ASN B 3 21.620 -0.177 53.649 1.00 33.80 C 1.831 +ATOM 373 C ASN B 3 21.977 -0.761 52.315 1.00 33.13 C 1.832 +ATOM 374 O ASN B 3 21.765 -0.139 51.281 1.00 31.64 O 1.833 +ATOM 375 CB ASN B 3 20.240 0.482 53.587 1.00 34.56 C 1.834 +ATOM 376 CG ASN B 3 19.104 -0.539 53.606 1.00 34.81 C 1.835 +ATOM 377 OD1 ASN B 3 19.095 -1.488 52.824 1.00 34.96 O 1.836 +ATOM 378 ND2 ASN B 3 18.150 -0.341 54.518 1.00 35.84 N 1.837 +ATOM 379 N ALA B 4 22.529 -1.971 52.337 1.00 31.35 N 1.838 +ATOM 380 CA ALA B 4 22.940 -2.650 51.120 1.00 30.46 C 1.839 +ATOM 381 C ALA B 4 21.801 -2.872 50.140 1.00 30.25 C 1.840 +ATOM 382 O ALA B 4 21.944 -2.617 48.938 1.00 28.85 O 1.841 +ATOM 383 CB ALA B 4 23.596 -3.983 51.454 1.00 30.98 C 1.842 +ATOM 384 N LYS B 5 20.659 -3.341 50.633 1.00 29.35 N 1.843 +ATOM 385 CA LYS B 5 19.516 -3.581 49.768 1.00 27.45 C 1.844 +ATOM 386 C LYS B 5 19.047 -2.313 49.045 1.00 27.04 C 1.845 +ATOM 387 O LYS B 5 18.673 -2.366 47.874 1.00 25.66 O 1.846 +ATOM 388 CB LYS B 5 18.374 -4.206 50.567 1.00 28.99 C 1.847 +ATOM 389 CG LYS B 5 18.751 -5.561 51.160 1.00 29.65 C 1.848 +ATOM 390 CD LYS B 5 17.615 -6.203 51.943 1.00 31.51 C 1.849 +ATOM 391 CE LYS B 5 18.014 -7.593 52.422 1.00 32.10 C 1.850 +ATOM 392 NZ LYS B 5 16.919 -8.250 53.190 1.00 32.89 N 1.851 +ATOM 393 N ILE B 6 19.072 -1.174 49.730 1.00 26.31 N 1.852 +ATOM 394 CA ILE B 6 18.654 0.075 49.106 1.00 27.23 C 1.853 +ATOM 395 C ILE B 6 19.610 0.438 47.971 1.00 26.57 C 1.854 +ATOM 396 O ILE B 6 19.186 0.935 46.923 1.00 24.98 O 1.855 +ATOM 397 CB ILE B 6 18.601 1.222 50.133 1.00 28.76 C 1.856 +ATOM 398 CG1 ILE B 6 17.460 0.965 51.123 1.00 29.04 C 1.857 +ATOM 399 CG2 ILE B 6 18.395 2.562 49.436 1.00 28.27 C 1.858 +ATOM 400 CD1 ILE B 6 16.097 0.831 50.469 1.00 29.85 C 1.859 +ATOM 401 N ASP B 7 20.900 0.180 48.172 1.00 25.83 N 1.860 +ATOM 402 CA ASP B 7 21.891 0.486 47.140 1.00 25.44 C 1.861 +ATOM 403 C ASP B 7 21.676 -0.337 45.881 1.00 24.07 C 1.862 +ATOM 404 O ASP B 7 21.831 0.170 44.772 1.00 22.89 O 1.863 +ATOM 405 CB ASP B 7 23.313 0.231 47.638 1.00 27.57 C 1.864 +ATOM 406 CG ASP B 7 23.724 1.187 48.721 1.00 30.62 C 1.865 +ATOM 407 OD1 ASP B 7 23.313 2.366 48.662 1.00 30.93 O 1.866 +ATOM 408 OD2 ASP B 7 24.474 0.763 49.628 1.00 34.49 O 1.867 +ATOM 409 N GLN B 8 21.349 -1.615 46.059 1.00 24.44 N 1.868 +ATOM 410 CA GLN B 8 21.114 -2.500 44.921 1.00 24.75 C 1.869 +ATOM 411 C GLN B 8 19.894 -2.001 44.153 1.00 22.82 C 1.870 +ATOM 412 O GLN B 8 19.868 -2.042 42.922 1.00 22.99 O 1.871 +ATOM 413 CB GLN B 8 20.882 -3.937 45.389 1.00 27.05 C 1.872 +ATOM 414 CG GLN B 8 20.591 -4.918 44.260 1.00 30.25 C 1.873 +ATOM 415 CD GLN B 8 21.755 -5.091 43.295 1.00 33.62 C 1.874 +ATOM 416 OE1 GLN B 8 21.636 -5.781 42.283 1.00 37.71 O 1.875 +ATOM 417 NE2 GLN B 8 22.887 -4.471 43.607 1.00 35.68 N 1.876 +ATOM 418 N LEU B 9 18.887 -1.537 44.888 1.00 21.98 N 1.877 +ATOM 419 CA LEU B 9 17.671 -1.007 44.270 1.00 21.61 C 1.878 +ATOM 420 C LEU B 9 18.003 0.249 43.464 1.00 20.82 C 1.879 +ATOM 421 O LEU B 9 17.482 0.450 42.363 1.00 18.28 O 1.880 +ATOM 422 CB LEU B 9 16.632 -0.654 45.341 1.00 22.45 C 1.881 +ATOM 423 CG LEU B 9 16.082 -1.796 46.200 1.00 24.91 C 1.882 +ATOM 424 CD1 LEU B 9 15.242 -1.240 47.341 1.00 26.69 C 1.883 +ATOM 425 CD2 LEU B 9 15.260 -2.726 45.325 1.00 26.04 C 1.884 +ATOM 426 N SER B 10 18.858 1.103 44.019 1.00 18.87 N 1.885 +ATOM 427 CA SER B 10 19.246 2.331 43.336 1.00 19.06 C 1.886 +ATOM 428 C SER B 10 19.965 1.987 42.025 1.00 18.52 C 1.887 +ATOM 429 O SER B 10 19.736 2.620 40.989 1.00 15.85 O 1.888 +ATOM 430 CB SER B 10 20.155 3.176 44.244 1.00 21.80 C 1.889 +ATOM 431 OG SER B 10 20.370 4.469 43.699 1.00 23.87 O 1.890 +ATOM 432 N SER B 11 20.820 0.967 42.067 1.00 18.02 N 1.891 +ATOM 433 CA SER B 11 21.555 0.553 40.876 1.00 18.49 C 1.892 +ATOM 434 C SER B 11 20.612 -0.004 39.811 1.00 17.39 C 1.893 +ATOM 435 O SER B 11 20.727 0.327 38.632 1.00 16.64 O 1.894 +ATOM 436 CB SER B 11 22.597 -0.509 41.230 1.00 20.10 C 1.895 +ATOM 437 OG SER B 11 23.336 -0.885 40.077 1.00 25.73 O 1.896 +ATOM 438 N ASP B 12 19.675 -0.845 40.233 1.00 17.19 N 1.897 +ATOM 439 CA ASP B 12 18.725 -1.427 39.294 1.00 16.86 C 1.898 +ATOM 440 C ASP B 12 17.848 -0.345 38.659 1.00 16.99 C 1.899 +ATOM 441 O ASP B 12 17.574 -0.404 37.464 1.00 16.58 O 1.900 +ATOM 442 CB ASP B 12 17.830 -2.469 39.983 1.00 20.58 C 1.901 +ATOM 443 CG ASP B 12 18.615 -3.647 40.557 1.00 22.99 C 1.902 +ATOM 444 OD1 ASP B 12 19.645 -4.047 39.969 1.00 24.21 O 1.903 +ATOM 445 OD2 ASP B 12 18.178 -4.190 41.592 1.00 26.39 O 1.904 +ATOM 446 N ALA B 13 17.407 0.629 39.455 1.00 16.09 N 1.905 +ATOM 447 CA ALA B 13 16.561 1.711 38.942 1.00 16.78 C 1.906 +ATOM 448 C ALA B 13 17.323 2.566 37.934 1.00 16.82 C 1.907 +ATOM 449 O ALA B 13 16.782 2.957 36.895 1.00 14.92 O 1.908 +ATOM 450 CB ALA B 13 16.052 2.591 40.094 1.00 18.39 C 1.909 +ATOM 451 N GLN B 14 18.582 2.861 38.241 1.00 17.13 N 1.910 +ATOM 452 CA GLN B 14 19.397 3.671 37.348 1.00 17.93 C 1.911 +ATOM 453 C GLN B 14 19.628 2.962 36.021 1.00 17.92 C 1.912 +ATOM 454 O GLN B 14 19.541 3.573 34.954 1.00 18.47 O 1.913 +ATOM 455 CB GLN B 14 20.743 3.982 38.004 1.00 19.67 C 1.914 +ATOM 456 CG GLN B 14 20.540 4.666 39.223 1.00 25.54 C 1.915 +ATOM 457 N THR B 15 19.911 1.669 36.082 1.00 17.05 N 1.916 +ATOM 458 CA THR B 15 20.164 0.915 34.867 1.00 15.86 C 1.917 +ATOM 459 C THR B 15 18.896 0.846 34.022 1.00 15.17 C 1.918 +ATOM 460 O THR B 15 18.949 1.001 32.800 1.00 14.99 O 1.919 +ATOM 461 CB THR B 15 20.677 -0.496 35.198 1.00 18.84 C 1.920 +ATOM 462 OG1 THR B 15 21.945 -0.389 35.876 1.00 20.00 O 1.921 +ATOM 463 CG2 THR B 15 20.849 -1.311 33.934 1.00 19.17 C 1.922 +ATOM 464 N ALA B 16 17.756 0.637 34.675 1.00 14.35 N 1.923 +ATOM 465 CA ALA B 16 16.481 0.555 33.958 1.00 14.12 C 1.924 +ATOM 466 C ALA B 16 16.170 1.868 33.247 1.00 13.69 C 1.925 +ATOM 467 O ALA B 16 15.757 1.872 32.081 1.00 14.78 O 1.926 +ATOM 468 CB ALA B 16 15.356 0.206 34.925 1.00 14.03 C 1.927 +ATOM 469 N ASN B 17 16.360 2.984 33.932 1.00 13.14 N 1.928 +ATOM 470 CA ASN B 17 16.080 4.273 33.296 1.00 15.92 C 1.929 +ATOM 471 C ASN B 17 17.006 4.551 32.131 1.00 14.40 C 1.930 +ATOM 472 O ASN B 17 16.576 5.068 31.094 1.00 13.47 O 1.931 +ATOM 473 CB ASN B 17 16.182 5.406 34.310 1.00 18.28 C 1.932 +ATOM 474 CG ASN B 17 14.857 5.700 34.967 1.00 20.38 C 1.933 +ATOM 475 OD1 ASN B 17 13.933 6.204 34.321 1.00 23.58 O 1.934 +ATOM 476 ND2 ASN B 17 14.743 5.372 36.247 1.00 20.48 N 1.935 +ATOM 477 N ALA B 18 18.279 4.210 32.302 1.00 14.70 N 1.936 +ATOM 478 CA ALA B 18 19.261 4.435 31.249 1.00 15.28 C 1.937 +ATOM 479 C ALA B 18 18.923 3.607 30.014 1.00 15.31 C 1.938 +ATOM 480 O ALA B 18 19.035 4.089 28.884 1.00 17.26 O 1.939 +ATOM 481 CB ALA B 18 20.661 4.088 31.758 1.00 17.84 C 1.940 +ATOM 482 N LYS B 19 18.519 2.360 30.221 1.00 15.02 N 1.941 +ATOM 483 CA LYS B 19 18.161 1.493 29.104 1.00 16.03 C 1.942 +ATOM 484 C LYS B 19 16.882 1.965 28.417 1.00 13.81 C 1.943 +ATOM 485 O LYS B 19 16.781 1.929 27.186 1.00 13.17 O 1.944 +ATOM 486 CB LYS B 19 17.987 0.051 29.579 1.00 18.44 C 1.945 +ATOM 487 CG LYS B 19 19.283 -0.680 29.864 1.00 22.33 C 1.946 +ATOM 488 CD LYS B 19 18.996 -2.153 30.103 1.00 23.38 C 1.947 +ATOM 489 CE LYS B 19 20.192 -3.007 29.757 1.00 23.82 C 1.948 +ATOM 490 NZ LYS B 19 19.796 -4.430 29.612 1.00 24.02 N 1.949 +ATOM 491 N ALA B 20 15.903 2.394 29.207 1.00 12.94 N 1.950 +ATOM 492 CA ALA B 20 14.648 2.888 28.638 1.00 12.74 C 1.951 +ATOM 493 C ALA B 20 14.910 4.136 27.781 1.00 13.71 C 1.952 +ATOM 494 O ALA B 20 14.302 4.296 26.714 1.00 13.76 O 1.953 +ATOM 495 CB ALA B 20 13.648 3.210 29.758 1.00 12.87 C 1.954 +ATOM 496 N ASP B 21 15.805 5.021 28.233 1.00 12.42 N 1.955 +ATOM 497 CA ASP B 21 16.120 6.228 27.459 1.00 15.42 C 1.956 +ATOM 498 C ASP B 21 16.823 5.840 26.163 1.00 16.20 C 1.957 +ATOM 499 O ASP B 21 16.601 6.444 25.116 1.00 17.70 O 1.958 +ATOM 500 CB ASP B 21 17.037 7.185 28.228 1.00 17.70 C 1.959 +ATOM 501 CG ASP B 21 16.345 7.874 29.390 1.00 20.59 C 1.960 +ATOM 502 OD1 ASP B 21 15.114 8.091 29.343 1.00 22.86 O 1.961 +ATOM 503 OD2 ASP B 21 17.055 8.227 30.354 1.00 23.42 O 1.962 +ATOM 504 N GLN B 22 17.687 4.835 26.249 1.00 16.83 N 1.963 +ATOM 505 CA GLN B 22 18.431 4.340 25.089 1.00 18.45 C 1.964 +ATOM 506 C GLN B 22 17.462 3.752 24.059 1.00 17.82 C 1.965 +ATOM 507 O GLN B 22 17.568 4.024 22.857 1.00 15.69 O 1.966 +ATOM 508 CB GLN B 22 19.440 3.273 25.548 1.00 21.46 C 1.967 +ATOM 509 CG GLN B 22 19.751 2.163 24.539 1.00 28.70 C 1.968 +ATOM 510 CD GLN B 22 20.401 0.944 25.203 1.00 31.25 C 1.969 +ATOM 511 OE1 GLN B 22 20.545 -0.112 24.589 1.00 35.17 O 1.970 +ATOM 512 NE2 GLN B 22 20.794 1.095 26.467 1.00 35.31 N 1.971 +ATOM 513 N ALA B 23 16.513 2.953 24.536 1.00 15.72 N 1.972 +ATOM 514 CA ALA B 23 15.530 2.330 23.658 1.00 15.26 C 1.973 +ATOM 515 C ALA B 23 14.569 3.355 23.062 1.00 15.02 C 1.974 +ATOM 516 O ALA B 23 14.117 3.202 21.923 1.00 13.86 O 1.975 +ATOM 517 CB ALA B 23 14.749 1.271 24.418 1.00 15.95 C 1.976 +ATOM 518 N SER B 24 14.258 4.391 23.832 1.00 14.05 N 1.977 +ATOM 519 CA SER B 24 13.358 5.436 23.362 1.00 15.69 C 1.978 +ATOM 520 C SER B 24 14.014 6.167 22.189 1.00 15.52 C 1.979 +ATOM 521 O SER B 24 13.364 6.484 21.190 1.00 15.20 O 1.980 +ATOM 522 CB SER B 24 13.057 6.413 24.502 1.00 16.97 C 1.981 +ATOM 523 OG SER B 24 12.332 7.534 24.023 1.00 22.40 O 1.982 +ATOM 524 N ASN B 25 15.310 6.424 22.305 1.00 16.19 N 1.983 +ATOM 525 CA ASN B 25 16.033 7.105 21.231 1.00 17.24 C 1.984 +ATOM 526 C ASN B 25 16.133 6.217 19.992 1.00 16.02 C 1.985 +ATOM 527 O ASN B 25 15.937 6.687 18.864 1.00 15.16 O 1.986 +ATOM 528 CB ASN B 25 17.429 7.515 21.708 1.00 21.84 C 1.987 +ATOM 529 CG ASN B 25 17.376 8.541 22.815 1.00 26.69 C 1.988 +ATOM 530 OD1 ASN B 25 16.622 9.515 22.736 1.00 28.68 O 1.989 +ATOM 531 ND2 ASN B 25 18.177 8.336 23.857 1.00 31.64 N 1.990 +ATOM 532 N ASP B 26 16.426 4.937 20.201 1.00 14.92 N 1.991 +ATOM 533 CA ASP B 26 16.527 3.975 19.101 1.00 13.54 C 1.992 +ATOM 534 C ASP B 26 15.242 3.885 18.316 1.00 13.04 C 1.993 +ATOM 535 O ASP B 26 15.262 3.891 17.093 1.00 11.25 O 1.994 +ATOM 536 CB ASP B 26 16.822 2.561 19.607 1.00 15.96 C 1.995 +ATOM 537 CG ASP B 26 18.253 2.377 19.978 1.00 19.04 C 1.996 +ATOM 538 OD1 ASP B 26 19.042 3.195 19.487 1.00 18.95 O 1.997 +ATOM 539 OD2 ASP B 26 18.580 1.428 20.732 1.00 21.03 O 1.998 +ATOM 540 N ALA B 27 14.133 3.764 19.042 1.00 11.63 N 1.999 +ATOM 541 CA ALA B 27 12.813 3.630 18.424 1.00 10.48 C 1.1000 +ATOM 542 C ALA B 27 12.409 4.874 17.654 1.00 11.53 C 1.1001 +ATOM 543 O ALA B 27 11.822 4.784 16.568 1.00 10.67 O 1.1002 +ATOM 544 CB ALA B 27 11.770 3.310 19.490 1.00 10.97 C 1.1003 +ATOM 545 N ASN B 28 12.718 6.036 18.215 1.00 11.10 N 1.1004 +ATOM 546 CA ASN B 28 12.385 7.292 17.558 1.00 11.35 C 1.1005 +ATOM 547 C ASN B 28 13.144 7.418 16.242 1.00 11.20 C 1.1006 +ATOM 548 O ASN B 28 12.556 7.780 15.217 1.00 11.00 O 1.1007 +ATOM 549 CB ASN B 28 12.710 8.467 18.481 1.00 13.73 C 1.1008 +ATOM 550 CG ASN B 28 12.545 9.803 17.797 1.00 18.27 C 1.1009 +ATOM 551 OD1 ASN B 28 13.518 10.392 17.324 1.00 21.97 O 1.1010 +ATOM 552 ND2 ASN B 28 11.306 10.286 17.729 1.00 16.39 N 1.1011 +ATOM 553 N ALA B 29 14.441 7.123 16.265 1.00 11.24 N 1.1012 +ATOM 554 CA ALA B 29 15.254 7.198 15.048 1.00 12.84 C 1.1013 +ATOM 555 C ALA B 29 14.810 6.163 14.006 1.00 13.14 C 1.1014 +ATOM 556 O ALA B 29 14.812 6.443 12.795 1.00 13.09 O 1.1015 +ATOM 557 CB ALA B 29 16.749 7.001 15.390 1.00 13.04 C 1.1016 +ATOM 558 N ALA B 30 14.438 4.972 14.464 1.00 11.25 N 1.1017 +ATOM 559 CA ALA B 30 13.991 3.918 13.555 1.00 10.47 C 1.1018 +ATOM 560 C ALA B 30 12.650 4.255 12.883 1.00 10.51 C 1.1019 +ATOM 561 O ALA B 30 12.438 3.910 11.718 1.00 11.28 O 1.1020 +ATOM 562 CB ALA B 30 13.896 2.571 14.300 1.00 10.85 C 1.1021 +ATOM 563 N ARG B 31 11.741 4.922 13.591 1.00 8.95 N 1.1022 +ATOM 564 CA ARG B 31 10.471 5.287 12.959 1.00 10.41 C 1.1023 +ATOM 565 C ARG B 31 10.749 6.287 11.842 1.00 11.71 C 1.1024 +ATOM 566 O ARG B 31 10.167 6.202 10.762 1.00 12.78 O 1.1025 +ATOM 567 CB ARG B 31 9.492 5.930 13.953 1.00 13.79 C 1.1026 +ATOM 568 CG ARG B 31 8.739 4.944 14.835 1.00 15.29 C 1.1027 +ATOM 569 CD ARG B 31 7.569 5.619 15.566 1.00 18.03 C 1.1028 +ATOM 570 NE ARG B 31 6.444 5.927 14.672 1.00 18.99 N 1.1029 +ATOM 571 CZ ARG B 31 5.213 6.209 15.094 1.00 20.10 C 1.1030 +ATOM 572 NH1 ARG B 31 4.946 6.219 16.394 1.00 19.38 N 1.1031 +ATOM 573 NH2 ARG B 31 4.243 6.469 14.221 1.00 21.08 N 1.1032 +ATOM 574 N SER B 32 11.642 7.235 12.101 1.00 11.40 N 1.1033 +ATOM 575 CA SER B 32 11.975 8.248 11.100 1.00 12.62 C 1.1034 +ATOM 576 C SER B 32 12.649 7.607 9.887 1.00 13.24 C 1.1035 +ATOM 577 O SER B 32 12.349 7.954 8.743 1.00 13.81 O 1.1036 +ATOM 578 CB SER B 32 12.899 9.315 11.699 1.00 14.31 C 1.1037 +ATOM 579 OG SER B 32 13.126 10.371 10.770 1.00 13.86 O 1.1038 +ATOM 580 N ASP B 33 13.557 6.674 10.146 1.00 12.18 N 1.1039 +ATOM 581 CA ASP B 33 14.277 5.972 9.089 1.00 13.39 C 1.1040 +ATOM 582 C ASP B 33 13.303 5.176 8.209 1.00 12.74 C 1.1041 +ATOM 583 O ASP B 33 13.477 5.096 6.992 1.00 13.35 O 1.1042 +ATOM 584 CB ASP B 33 15.305 5.022 9.718 1.00 16.65 C 1.1043 +ATOM 585 CG ASP B 33 16.126 4.281 8.683 1.00 19.49 C 1.1044 +ATOM 586 OD1 ASP B 33 16.866 4.945 7.918 1.00 19.68 O 1.1045 +ATOM 587 OD2 ASP B 33 16.027 3.034 8.641 1.00 21.28 O 1.1046 +ATOM 588 N ALA B 34 12.284 4.587 8.833 1.00 12.44 N 1.1047 +ATOM 589 CA ALA B 34 11.289 3.804 8.103 1.00 14.15 C 1.1048 +ATOM 590 C ALA B 34 10.472 4.702 7.171 1.00 14.67 C 1.1049 +ATOM 591 O ALA B 34 10.069 4.282 6.084 1.00 13.86 O 1.1050 +ATOM 592 CB ALA B 34 10.374 3.092 9.079 1.00 12.32 C 1.1051 +ATOM 593 N GLN B 35 10.214 5.934 7.601 1.00 13.53 N 1.1052 +ATOM 594 CA GLN B 35 9.468 6.880 6.767 1.00 15.04 C 1.1053 +ATOM 595 C GLN B 35 10.303 7.230 5.541 1.00 14.88 C 1.1054 +ATOM 596 O GLN B 35 9.779 7.365 4.432 1.00 14.53 O 1.1055 +ATOM 597 CB GLN B 35 9.153 8.155 7.548 1.00 17.62 C 1.1056 +ATOM 598 CG GLN B 35 7.978 8.027 8.485 1.00 22.18 C 1.1057 +ATOM 599 CD GLN B 35 6.671 7.817 7.739 1.00 23.40 C 1.1058 +ATOM 600 OE1 GLN B 35 6.312 8.608 6.864 1.00 26.69 O 1.1059 +ATOM 601 NE2 GLN B 35 5.955 6.757 8.081 1.00 25.28 N 1.1060 +ATOM 602 N ALA B 36 11.611 7.383 5.742 1.00 12.96 N 1.1061 +ATOM 603 CA ALA B 36 12.500 7.697 4.626 1.00 12.21 C 1.1062 +ATOM 604 C ALA B 36 12.483 6.538 3.624 1.00 12.13 C 1.1063 +ATOM 605 O ALA B 36 12.513 6.750 2.405 1.00 13.17 O 1.1064 +ATOM 606 CB ALA B 36 13.922 7.942 5.134 1.00 14.53 C 1.1065 +ATOM 607 N ALA B 37 12.441 5.308 4.128 1.00 10.89 N 1.1066 +ATOM 608 CA ALA B 37 12.409 4.152 3.231 1.00 10.30 C 1.1067 +ATOM 609 C ALA B 37 11.084 4.123 2.468 1.00 10.74 C 1.1068 +ATOM 610 O ALA B 37 11.063 3.788 1.287 1.00 12.16 O 1.1069 +ATOM 611 CB ALA B 37 12.595 2.861 4.016 1.00 9.67 C 1.1070 +ATOM 612 N LYS B 38 9.985 4.459 3.141 1.00 12.22 N 1.1071 +ATOM 613 CA LYS B 38 8.676 4.491 2.474 1.00 13.52 C 1.1072 +ATOM 614 C LYS B 38 8.702 5.537 1.352 1.00 15.06 C 1.1073 +ATOM 615 O LYS B 38 8.163 5.317 0.256 1.00 13.71 O 1.1074 +ATOM 616 CB LYS B 38 7.557 4.837 3.475 1.00 16.07 C 1.1075 +ATOM 617 CG LYS B 38 7.109 3.672 4.354 1.00 19.48 C 1.1076 +ATOM 618 CD LYS B 38 6.097 4.117 5.416 1.00 23.18 C 1.1077 +ATOM 619 CE LYS B 38 4.799 4.616 4.796 1.00 24.34 C 1.1078 +ATOM 620 NZ LYS B 38 4.066 3.507 4.125 1.00 27.85 N 1.1079 +ATOM 621 N ASP B 39 9.336 6.676 1.620 1.00 13.39 N 1.1080 +ATOM 622 CA ASP B 39 9.411 7.732 0.614 1.00 15.17 C 1.1081 +ATOM 623 C ASP B 39 10.272 7.288 -0.572 1.00 14.47 C 1.1082 +ATOM 624 O ASP B 39 9.953 7.595 -1.726 1.00 14.04 O 1.1083 +ATOM 625 CB ASP B 39 9.958 9.038 1.228 1.00 16.14 C 1.1084 +ATOM 626 CG ASP B 39 8.993 9.672 2.230 1.00 21.03 C 1.1085 +ATOM 627 OD1 ASP B 39 7.772 9.409 2.140 1.00 23.53 O 1.1086 +ATOM 628 OD2 ASP B 39 9.445 10.446 3.108 1.00 23.15 O 1.1087 +ATOM 629 N ASP B 40 11.357 6.561 -0.303 1.00 13.25 N 1.1088 +ATOM 630 CA ASP B 40 12.220 6.083 -1.384 1.00 14.17 C 1.1089 +ATOM 631 C ASP B 40 11.473 5.105 -2.298 1.00 13.81 C 1.1090 +ATOM 632 O ASP B 40 11.564 5.212 -3.524 1.00 12.91 O 1.1091 +ATOM 633 CB ASP B 40 13.478 5.403 -0.824 1.00 17.25 C 1.1092 +ATOM 634 CG ASP B 40 14.469 6.398 -0.208 1.00 22.28 C 1.1093 +ATOM 635 OD1 ASP B 40 15.450 5.948 0.433 1.00 24.14 O 1.1094 +ATOM 636 OD2 ASP B 40 14.281 7.621 -0.364 1.00 22.33 O 1.1095 +ATOM 637 N ALA B 41 10.747 4.152 -1.711 1.00 12.45 N 1.1096 +ATOM 638 CA ALA B 41 9.997 3.178 -2.508 1.00 12.75 C 1.1097 +ATOM 639 C ALA B 41 8.916 3.888 -3.322 1.00 14.61 C 1.1098 +ATOM 640 O ALA B 41 8.690 3.559 -4.489 1.00 12.75 O 1.1099 +ATOM 641 CB ALA B 41 9.363 2.120 -1.604 1.00 15.28 C 1.1100 +ATOM 642 N ALA B 42 8.255 4.867 -2.704 1.00 14.04 N 1.1101 +ATOM 643 CA ALA B 42 7.194 5.623 -3.376 1.00 15.43 C 1.1102 +ATOM 644 C ALA B 42 7.738 6.396 -4.569 1.00 16.35 C 1.1103 +ATOM 645 O ALA B 42 7.085 6.484 -5.621 1.00 17.40 O 1.1104 +ATOM 646 CB ALA B 42 6.534 6.595 -2.387 1.00 15.42 C 1.1105 +ATOM 647 N ARG B 43 8.935 6.953 -4.409 1.00 15.51 N 1.1106 +ATOM 648 CA ARG B 43 9.565 7.729 -5.471 1.00 16.07 C 1.1107 +ATOM 649 C ARG B 43 9.952 6.830 -6.654 1.00 16.13 C 1.1108 +ATOM 650 O ARG B 43 9.873 7.255 -7.810 1.00 15.03 O 1.1109 +ATOM 651 CB ARG B 43 10.793 8.476 -4.920 1.00 16.22 C 1.1110 +ATOM 652 CG ARG B 43 11.113 9.771 -5.657 1.00 21.33 C 1.1111 +ATOM 653 CD ARG B 43 12.209 10.589 -4.968 1.00 22.96 C 1.1112 +ATOM 654 NE ARG B 43 11.867 10.946 -3.592 1.00 24.48 N 1.1113 +ATOM 655 CZ ARG B 43 12.402 10.373 -2.515 1.00 25.05 C 1.1114 +ATOM 656 NH1 ARG B 43 13.308 9.415 -2.652 1.00 26.67 N 1.1115 +ATOM 657 NH2 ARG B 43 12.033 10.758 -1.299 1.00 26.05 N 1.1116 +ATOM 658 N ALA B 44 10.355 5.590 -6.375 1.00 15.10 N 1.1117 +ATOM 659 CA ALA B 44 10.719 4.665 -7.454 1.00 15.08 C 1.1118 +ATOM 660 C ALA B 44 9.478 4.365 -8.294 1.00 15.80 C 1.1119 +ATOM 661 O ALA B 44 9.555 4.331 -9.519 1.00 15.41 O 1.1120 +ATOM 662 CB ALA B 44 11.302 3.371 -6.889 1.00 16.65 C 1.1121 +ATOM 663 N ASN B 45 8.338 4.143 -7.638 1.00 14.11 N 1.1122 +ATOM 664 CA ASN B 45 7.103 3.886 -8.376 1.00 16.40 C 1.1123 +ATOM 665 C ASN B 45 6.663 5.161 -9.119 1.00 16.28 C 1.1124 +ATOM 666 O ASN B 45 6.115 5.080 -10.224 1.00 17.09 O 1.1125 +ATOM 667 CB ASN B 45 6.005 3.380 -7.428 1.00 14.74 C 1.1126 +ATOM 668 CG ASN B 45 6.162 1.891 -7.097 1.00 15.69 C 1.1127 +ATOM 669 OD1 ASN B 45 5.965 1.031 -7.958 1.00 13.28 O 1.1128 +ATOM 670 ND2 ASN B 45 6.531 1.587 -5.852 1.00 13.49 N 1.1129 +ATOM 671 N GLN B 46 6.917 6.332 -8.529 1.00 15.41 N 1.1130 +ATOM 672 CA GLN B 46 6.558 7.600 -9.171 1.00 19.10 C 1.1131 +ATOM 673 C GLN B 46 7.284 7.748 -10.507 1.00 18.63 C 1.1132 +ATOM 674 O GLN B 46 6.695 8.210 -11.488 1.00 21.11 O 1.1133 +ATOM 675 CB GLN B 46 6.900 8.790 -8.260 1.00 20.26 C 1.1134 +ATOM 676 CG GLN B 46 6.522 10.023 -8.857 1.00 29.74 C 1.1135 +ATOM 677 N ARG B 47 8.561 7.370 -10.550 1.00 17.16 N 1.1136 +ATOM 678 CA ARG B 47 9.334 7.453 -11.792 1.00 18.44 C 1.1137 +ATOM 679 C ARG B 47 8.713 6.543 -12.858 1.00 19.97 C 1.1138 +ATOM 680 O ARG B 47 8.694 6.878 -14.048 1.00 20.03 O 1.1139 +ATOM 681 CB ARG B 47 10.795 7.049 -11.559 1.00 19.03 C 1.1140 +ATOM 682 CG ARG B 47 11.643 8.080 -10.798 1.00 22.17 C 1.1141 +ATOM 683 CD ARG B 47 13.136 7.723 -10.856 1.00 22.20 C 1.1142 +ATOM 684 NE ARG B 47 13.646 7.786 -12.227 1.00 22.89 N 1.1143 +ATOM 685 CZ ARG B 47 14.845 7.358 -12.619 1.00 23.29 C 1.1144 +ATOM 686 NH1 ARG B 47 15.692 6.824 -11.749 1.00 24.32 N 1.1145 +ATOM 687 NH2 ARG B 47 15.203 7.468 -13.890 1.00 25.06 N 1.1146 +ATOM 688 N LEU B 48 8.213 5.388 -12.431 1.00 19.57 N 1.1147 +ATOM 689 CA LEU B 48 7.576 4.449 -13.354 1.00 21.60 C 1.1148 +ATOM 690 C LEU B 48 6.223 5.001 -13.815 1.00 22.52 C 1.1149 +ATOM 691 O LEU B 48 5.811 4.783 -14.957 1.00 22.52 O 1.1150 +ATOM 692 CB LEU B 48 7.369 3.089 -12.676 1.00 21.78 C 1.1151 +ATOM 693 CG LEU B 48 8.629 2.311 -12.294 1.00 22.20 C 1.1152 +ATOM 694 CD1 LEU B 48 8.252 1.042 -11.519 1.00 20.72 C 1.1153 +ATOM 695 CD2 LEU B 48 9.403 1.957 -13.550 1.00 24.18 C 1.1154 +ATOM 696 N ASP B 49 5.541 5.718 -12.924 1.00 23.57 N 1.1155 +ATOM 697 CA ASP B 49 4.236 6.299 -13.231 1.00 25.55 C 1.1156 +ATOM 698 C ASP B 49 4.310 7.429 -14.246 1.00 28.11 C 1.1157 +ATOM 699 O ASP B 49 3.459 7.537 -15.127 1.00 28.14 O 1.1158 +ATOM 700 CB ASP B 49 3.574 6.879 -11.973 1.00 23.94 C 1.1159 +ATOM 701 CG ASP B 49 3.082 5.819 -11.011 1.00 24.85 C 1.1160 +ATOM 702 OD1 ASP B 49 3.065 4.621 -11.375 1.00 24.55 O 1.1161 +ATOM 703 OD2 ASP B 49 2.697 6.201 -9.885 1.00 22.65 O 1.1162 +ATOM 704 N ASN B 50 5.323 8.277 -14.109 1.00 30.10 N 1.1163 +ATOM 705 CA ASN B 50 5.458 9.438 -14.978 1.00 32.68 C 1.1164 +ATOM 706 C ASN B 50 6.232 9.261 -16.277 1.00 34.89 C 1.1165 +ATOM 707 O ASN B 50 6.356 10.212 -17.051 1.00 34.82 O 1.1166 +ATOM 708 CB ASN B 50 6.062 10.601 -14.185 1.00 34.87 C 1.1167 +ATOM 709 CG ASN B 50 5.305 10.887 -12.901 1.00 34.86 C 1.1168 +ATOM 710 OD1 ASN B 50 4.075 10.885 -12.878 1.00 37.00 O 1.1169 +ATOM 711 ND2 ASN B 50 6.040 11.147 -11.825 1.00 38.02 N 1.1170 +ATOM 712 N MET B 51 6.747 8.064 -16.533 1.00 36.21 N 1.1171 +ATOM 713 CA MET B 51 7.499 7.842 -17.764 1.00 38.66 C 1.1172 +ATOM 714 C MET B 51 6.571 7.731 -18.971 1.00 38.84 C 1.1173 +ATOM 715 O MET B 51 5.494 7.143 -18.886 1.00 39.80 O 1.1174 +ATOM 716 CB MET B 51 8.366 6.581 -17.649 1.00 39.77 C 1.1175 +ATOM 717 CG MET B 51 7.591 5.277 -17.531 1.00 42.14 C 1.1176 +ATOM 718 SD MET B 51 8.698 3.844 -17.391 1.00 46.27 S 1.1177 +ATOM 719 CE MET B 51 9.002 3.471 -19.124 1.00 43.33 C 1.1178 +ATOM 720 N ALA B 52 6.990 8.311 -20.092 1.00 39.62 N 1.1179 +ATOM 721 CA ALA B 52 6.197 8.275 -21.316 1.00 39.70 C 1.1180 +ATOM 722 C ALA B 52 6.601 7.088 -22.184 1.00 40.02 C 1.1181 +ATOM 723 CB ALA B 52 6.376 9.574 -22.093 1.00 39.58 C 1.1182 +TER 724 ALA B 52 1.1183 +ATOM 725 N SER C 1 11.466 -8.477 50.421 1.00 17.41 N 1.1184 +ATOM 726 CA SER C 1 11.288 -7.352 51.381 1.00 16.21 C 1.1185 +ATOM 727 C SER C 1 9.944 -7.360 52.122 1.00 14.97 C 1.1186 +ATOM 728 O SER C 1 8.921 -7.811 51.612 1.00 15.22 O 1.1187 +ATOM 729 CB SER C 1 11.443 -6.021 50.637 1.00 16.62 C 1.1188 +ATOM 730 OG SER C 1 11.270 -4.928 51.522 1.00 15.05 O 1.1189 +ATOM 731 N SER C 2 9.945 -6.848 53.339 1.00 14.17 N 1.1190 +ATOM 732 CA SER C 2 8.719 -6.784 54.111 1.00 15.62 C 1.1191 +ATOM 733 C SER C 2 7.910 -5.565 53.655 1.00 14.71 C 1.1192 +ATOM 734 O SER C 2 6.750 -5.419 54.005 1.00 14.56 O 1.1193 +ATOM 735 CB SER C 2 9.051 -6.660 55.599 1.00 16.30 C 1.1194 +ATOM 736 OG SER C 2 9.837 -5.506 55.837 1.00 17.85 O 1.1195 +ATOM 737 N ASN C 3 8.543 -4.713 52.848 1.00 14.61 N 1.1196 +ATOM 738 CA ASN C 3 7.950 -3.469 52.339 1.00 14.25 C 1.1197 +ATOM 739 C ASN C 3 7.308 -3.651 50.949 1.00 13.77 C 1.1198 +ATOM 740 O ASN C 3 8.008 -3.842 49.957 1.00 12.93 O 1.1199 +ATOM 741 CB ASN C 3 9.063 -2.405 52.302 1.00 14.15 C 1.1200 +ATOM 742 CG ASN C 3 8.558 -0.999 51.994 1.00 15.73 C 1.1201 +ATOM 743 OD1 ASN C 3 9.032 -0.020 52.581 1.00 17.54 O 1.1202 +ATOM 744 ND2 ASN C 3 7.626 -0.887 51.072 1.00 14.33 N 1.1203 +ATOM 745 N ALA C 4 5.981 -3.562 50.876 1.00 14.25 N 1.1204 +ATOM 746 CA ALA C 4 5.268 -3.741 49.601 1.00 14.17 C 1.1205 +ATOM 747 C ALA C 4 5.700 -2.796 48.477 1.00 15.24 C 1.1206 +ATOM 748 O ALA C 4 5.715 -3.182 47.305 1.00 15.37 O 1.1207 +ATOM 749 CB ALA C 4 3.758 -3.618 49.818 1.00 13.11 C 1.1208 +ATOM 750 N LYS C 5 6.025 -1.556 48.834 1.00 15.78 N 1.1209 +ATOM 751 CA LYS C 5 6.455 -0.556 47.860 1.00 16.74 C 1.1210 +ATOM 752 C LYS C 5 7.828 -0.912 47.279 1.00 13.82 C 1.1211 +ATOM 753 O LYS C 5 8.097 -0.669 46.102 1.00 13.47 O 1.1212 +ATOM 754 CB LYS C 5 6.497 0.821 48.532 1.00 17.74 C 1.1213 +ATOM 755 CG LYS C 5 6.750 1.979 47.592 1.00 21.64 C 1.1214 +ATOM 756 CD LYS C 5 6.486 3.298 48.303 1.00 23.77 C 1.1215 +ATOM 757 CE LYS C 5 6.288 4.426 47.313 1.00 25.99 C 1.1216 +ATOM 758 NZ LYS C 5 5.723 5.622 47.993 1.00 25.91 N 1.1217 +ATOM 759 N ILE C 6 8.700 -1.480 48.108 1.00 13.57 N 1.1218 +ATOM 760 CA ILE C 6 10.017 -1.883 47.636 1.00 13.93 C 1.1219 +ATOM 761 C ILE C 6 9.882 -3.053 46.654 1.00 12.36 C 1.1220 +ATOM 762 O ILE C 6 10.540 -3.089 45.610 1.00 12.33 O 1.1221 +ATOM 763 CB ILE C 6 10.938 -2.270 48.813 1.00 14.89 C 1.1222 +ATOM 764 CG1 ILE C 6 11.372 -0.995 49.544 1.00 17.83 C 1.1223 +ATOM 765 CG2 ILE C 6 12.146 -3.049 48.309 1.00 15.11 C 1.1224 +ATOM 766 CD1 ILE C 6 12.284 -1.235 50.728 1.00 17.56 C 1.1225 +ATOM 767 N ASP C 7 9.022 -4.014 46.967 1.00 11.43 N 1.1226 +ATOM 768 CA ASP C 7 8.847 -5.121 46.037 1.00 12.66 C 1.1227 +ATOM 769 C ASP C 7 8.270 -4.638 44.713 1.00 13.19 C 1.1228 +ATOM 770 O ASP C 7 8.636 -5.146 43.647 1.00 14.05 O 1.1229 +ATOM 771 CB ASP C 7 7.934 -6.183 46.623 1.00 13.78 C 1.1230 +ATOM 772 CG ASP C 7 8.634 -7.055 47.619 1.00 14.98 C 1.1231 +ATOM 773 OD1 ASP C 7 9.887 -7.104 47.626 1.00 15.26 O 1.1232 +ATOM 774 OD2 ASP C 7 7.912 -7.711 48.390 1.00 16.95 O 1.1233 +ATOM 775 N GLN C 8 7.371 -3.659 44.769 1.00 11.97 N 1.1234 +ATOM 776 CA GLN C 8 6.761 -3.146 43.544 1.00 14.77 C 1.1235 +ATOM 777 C GLN C 8 7.762 -2.406 42.668 1.00 14.31 C 1.1236 +ATOM 778 O GLN C 8 7.749 -2.557 41.437 1.00 14.29 O 1.1237 +ATOM 779 CB GLN C 8 5.584 -2.218 43.867 1.00 15.22 C 1.1238 +ATOM 780 CG GLN C 8 5.030 -1.477 42.639 1.00 20.03 C 1.1239 +ATOM 781 CD GLN C 8 3.808 -0.635 42.952 1.00 25.81 C 1.1240 +ATOM 782 OE1 GLN C 8 2.671 -1.116 42.872 1.00 31.25 O 1.1241 +ATOM 783 NE2 GLN C 8 4.029 0.620 43.318 1.00 28.42 N 1.1242 +ATOM 784 N LEU C 9 8.635 -1.610 43.284 1.00 14.26 N 1.1243 +ATOM 785 CA LEU C 9 9.603 -0.857 42.492 1.00 14.87 C 1.1244 +ATOM 786 C LEU C 9 10.645 -1.803 41.904 1.00 16.26 C 1.1245 +ATOM 787 O LEU C 9 11.182 -1.563 40.814 1.00 15.04 O 1.1246 +ATOM 788 CB LEU C 9 10.257 0.243 43.348 1.00 16.65 C 1.1247 +ATOM 789 CG LEU C 9 11.340 -0.095 44.369 1.00 17.64 C 1.1248 +ATOM 790 CD1 LEU C 9 12.703 -0.192 43.674 1.00 20.24 C 1.1249 +ATOM 791 CD2 LEU C 9 11.382 1.009 45.421 1.00 19.61 C 1.1250 +ATOM 792 N SER C 10 10.928 -2.896 42.609 1.00 14.87 N 1.1251 +ATOM 793 CA SER C 10 11.890 -3.844 42.087 1.00 16.84 C 1.1252 +ATOM 794 C SER C 10 11.259 -4.521 40.866 1.00 15.60 C 1.1253 +ATOM 795 O SER C 10 11.923 -4.741 39.853 1.00 15.62 O 1.1254 +ATOM 796 CB SER C 10 12.264 -4.879 43.150 1.00 17.92 C 1.1255 +ATOM 797 OG SER C 10 13.262 -5.748 42.646 1.00 22.01 O 1.1256 +ATOM 798 N SER C 11 9.970 -4.830 40.958 1.00 15.97 N 1.1257 +ATOM 799 CA SER C 11 9.272 -5.463 39.847 1.00 17.85 C 1.1258 +ATOM 800 C SER C 11 9.257 -4.547 38.622 1.00 17.13 C 1.1259 +ATOM 801 O SER C 11 9.469 -4.999 37.493 1.00 15.82 O 1.1260 +ATOM 802 CB SER C 11 7.833 -5.800 40.239 1.00 19.21 C 1.1261 +ATOM 803 OG SER C 11 7.116 -6.243 39.098 1.00 26.65 O 1.1262 +ATOM 804 N ASP C 12 9.008 -3.261 38.861 1.00 15.39 N 1.1263 +ATOM 805 CA ASP C 12 8.948 -2.259 37.797 1.00 15.67 C 1.1264 +ATOM 806 C ASP C 12 10.283 -2.094 37.087 1.00 15.50 C 1.1265 +ATOM 807 O ASP C 12 10.332 -1.958 35.862 1.00 15.17 O 1.1266 +ATOM 808 CB ASP C 12 8.518 -0.898 38.362 1.00 17.98 C 1.1267 +ATOM 809 CG ASP C 12 7.035 -0.843 38.720 1.00 22.97 C 1.1268 +ATOM 810 OD1 ASP C 12 6.626 0.126 39.405 1.00 22.94 O 1.1269 +ATOM 811 OD2 ASP C 12 6.276 -1.750 38.314 1.00 24.21 O 1.1270 +ATOM 812 N ALA C 13 11.368 -2.086 37.853 1.00 13.99 N 1.1271 +ATOM 813 CA ALA C 13 12.687 -1.930 37.254 1.00 14.67 C 1.1272 +ATOM 814 C ALA C 13 13.017 -3.129 36.369 1.00 14.43 C 1.1273 +ATOM 815 O ALA C 13 13.534 -2.970 35.264 1.00 15.60 O 1.1274 +ATOM 816 CB ALA C 13 13.747 -1.765 38.348 1.00 15.72 C 1.1275 +ATOM 817 N GLN C 14 12.719 -4.333 36.854 1.00 14.95 N 1.1276 +ATOM 818 CA GLN C 14 12.998 -5.537 36.087 1.00 15.53 C 1.1277 +ATOM 819 C GLN C 14 12.157 -5.566 34.818 1.00 15.69 C 1.1278 +ATOM 820 O GLN C 14 12.657 -5.888 33.738 1.00 15.37 O 1.1279 +ATOM 821 CB GLN C 14 12.707 -6.791 36.917 1.00 17.83 C 1.1280 +ATOM 822 CG GLN C 14 13.644 -6.943 37.973 1.00 26.23 C 1.1281 +ATOM 823 N THR C 15 10.874 -5.245 34.947 1.00 14.39 N 1.1282 +ATOM 824 CA THR C 15 9.992 -5.258 33.783 1.00 16.11 C 1.1283 +ATOM 825 C THR C 15 10.430 -4.207 32.757 1.00 15.94 C 1.1284 +ATOM 826 O THR C 15 10.391 -4.461 31.548 1.00 15.23 O 1.1285 +ATOM 827 CB THR C 15 8.520 -5.019 34.191 1.00 17.02 C 1.1286 +ATOM 828 OG1 THR C 15 8.098 -6.053 35.095 1.00 17.29 O 1.1287 +ATOM 829 CG2 THR C 15 7.614 -5.044 32.962 1.00 18.56 C 1.1288 +ATOM 830 N ALA C 16 10.861 -3.041 33.238 1.00 13.63 N 1.1289 +ATOM 831 CA ALA C 16 11.314 -1.966 32.350 1.00 13.45 C 1.1290 +ATOM 832 C ALA C 16 12.577 -2.356 31.578 1.00 13.28 C 1.1291 +ATOM 833 O ALA C 16 12.676 -2.110 30.381 1.00 14.48 O 1.1292 +ATOM 834 CB ALA C 16 11.563 -0.682 33.163 1.00 11.88 C 1.1293 +ATOM 835 N ASN C 17 13.539 -2.971 32.267 1.00 13.77 N 1.1294 +ATOM 836 CA ASN C 17 14.801 -3.403 31.648 1.00 15.58 C 1.1295 +ATOM 837 C ASN C 17 14.507 -4.391 30.508 1.00 16.36 C 1.1296 +ATOM 838 O ASN C 17 14.985 -4.222 29.377 1.00 15.55 O 1.1297 +ATOM 839 CB ASN C 17 15.695 -4.057 32.730 1.00 19.12 C 1.1298 +ATOM 840 CG ASN C 17 17.148 -4.284 32.275 1.00 22.38 C 1.1299 +ATOM 841 OD1 ASN C 17 17.409 -4.994 31.309 1.00 25.21 O 1.1300 +ATOM 842 ND2 ASN C 17 18.097 -3.695 33.005 1.00 26.43 N 1.1301 +ATOM 843 N ALA C 18 13.698 -5.410 30.790 1.00 15.53 N 1.1302 +ATOM 844 CA ALA C 18 13.370 -6.404 29.768 1.00 16.47 C 1.1303 +ATOM 845 C ALA C 18 12.670 -5.789 28.553 1.00 16.36 C 1.1304 +ATOM 846 O ALA C 18 12.999 -6.118 27.404 1.00 16.22 O 1.1305 +ATOM 847 CB ALA C 18 12.500 -7.517 30.372 1.00 17.68 C 1.1306 +ATOM 848 N LYS C 19 11.706 -4.905 28.798 1.00 14.82 N 1.1307 +ATOM 849 CA LYS C 19 10.973 -4.270 27.700 1.00 16.03 C 1.1308 +ATOM 850 C LYS C 19 11.882 -3.396 26.849 1.00 15.30 C 1.1309 +ATOM 851 O LYS C 19 11.737 -3.347 25.621 1.00 14.96 O 1.1310 +ATOM 852 CB LYS C 19 9.835 -3.401 28.233 1.00 16.68 C 1.1311 +ATOM 853 CG LYS C 19 8.687 -4.143 28.880 1.00 20.84 C 1.1312 +ATOM 854 CD LYS C 19 7.643 -3.140 29.344 1.00 23.25 C 1.1313 +ATOM 855 CE LYS C 19 6.426 -3.810 29.942 1.00 25.83 C 1.1314 +ATOM 856 NZ LYS C 19 5.535 -2.793 30.555 1.00 24.01 N 1.1315 +ATOM 857 N ALA C 20 12.803 -2.687 27.501 1.00 13.87 N 1.1316 +ATOM 858 CA ALA C 20 13.725 -1.813 26.777 1.00 13.65 C 1.1317 +ATOM 859 C ALA C 20 14.605 -2.631 25.837 1.00 13.50 C 1.1318 +ATOM 860 O ALA C 20 14.845 -2.231 24.693 1.00 13.32 O 1.1319 +ATOM 861 CB ALA C 20 14.582 -1.019 27.755 1.00 12.74 C 1.1320 +ATOM 862 N ASP C 21 15.101 -3.767 26.325 1.00 14.67 N 1.1321 +ATOM 863 CA ASP C 21 15.929 -4.656 25.518 1.00 16.70 C 1.1322 +ATOM 864 C ASP C 21 15.154 -5.112 24.283 1.00 16.72 C 1.1323 +ATOM 865 O ASP C 21 15.679 -5.113 23.166 1.00 17.01 O 1.1324 +ATOM 866 CB ASP C 21 16.331 -5.898 26.325 1.00 20.22 C 1.1325 +ATOM 867 CG ASP C 21 17.506 -5.652 27.255 1.00 22.08 C 1.1326 +ATOM 868 OD1 ASP C 21 17.712 -6.496 28.156 1.00 25.88 O 1.1327 +ATOM 869 OD2 ASP C 21 18.229 -4.644 27.092 1.00 22.52 O 1.1328 +ATOM 870 N GLN C 22 13.904 -5.510 24.490 1.00 16.48 N 1.1329 +ATOM 871 CA GLN C 22 13.067 -5.974 23.391 1.00 16.57 C 1.1330 +ATOM 872 C GLN C 22 12.809 -4.852 22.378 1.00 16.27 C 1.1331 +ATOM 873 O GLN C 22 12.870 -5.069 21.164 1.00 14.84 O 1.1332 +ATOM 874 CB GLN C 22 11.739 -6.507 23.930 1.00 16.64 C 1.1333 +ATOM 875 CG GLN C 22 10.978 -7.110 22.888 1.00 23.92 C 1.1334 +ATOM 876 N ALA C 23 12.522 -3.657 22.883 1.00 14.47 N 1.1335 +ATOM 877 CA ALA C 23 12.262 -2.504 22.020 1.00 14.25 C 1.1336 +ATOM 878 C ALA C 23 13.476 -2.139 21.161 1.00 14.29 C 1.1337 +ATOM 879 O ALA C 23 13.336 -1.796 19.983 1.00 16.10 O 1.1338 +ATOM 880 CB ALA C 23 11.823 -1.301 22.875 1.00 11.50 C 1.1339 +ATOM 881 N SER C 24 14.673 -2.207 21.737 1.00 14.61 N 1.1340 +ATOM 882 CA SER C 24 15.874 -1.886 20.972 1.00 15.03 C 1.1341 +ATOM 883 C SER C 24 16.090 -2.949 19.901 1.00 16.15 C 1.1342 +ATOM 884 O SER C 24 16.480 -2.634 18.774 1.00 16.37 O 1.1343 +ATOM 885 CB SER C 24 17.098 -1.800 21.889 1.00 17.65 C 1.1344 +ATOM 886 OG SER C 24 17.085 -0.605 22.658 1.00 19.68 O 1.1345 +ATOM 887 N ASN C 25 15.835 -4.209 20.249 1.00 16.21 N 1.1346 +ATOM 888 CA ASN C 25 15.995 -5.295 19.286 1.00 16.43 C 1.1347 +ATOM 889 C ASN C 25 15.096 -5.043 18.082 1.00 16.07 C 1.1348 +ATOM 890 O ASN C 25 15.533 -5.171 16.934 1.00 16.70 O 1.1349 +ATOM 891 CB ASN C 25 15.623 -6.648 19.905 1.00 18.36 C 1.1350 +ATOM 892 CG ASN C 25 16.664 -7.150 20.881 1.00 22.35 C 1.1351 +ATOM 893 OD1 ASN C 25 17.835 -6.790 20.797 1.00 23.21 O 1.1352 +ATOM 894 ND2 ASN C 25 16.242 -8.008 21.805 1.00 27.28 N 1.1353 +ATOM 895 N ASP C 26 13.843 -4.687 18.354 1.00 13.37 N 1.1354 +ATOM 896 CA ASP C 26 12.875 -4.409 17.293 1.00 13.48 C 1.1355 +ATOM 897 C ASP C 26 13.234 -3.183 16.470 1.00 13.86 C 1.1356 +ATOM 898 O ASP C 26 12.956 -3.140 15.270 1.00 13.94 O 1.1357 +ATOM 899 CB ASP C 26 11.487 -4.226 17.882 1.00 14.13 C 1.1358 +ATOM 900 CG ASP C 26 10.810 -5.536 18.181 1.00 16.34 C 1.1359 +ATOM 901 OD1 ASP C 26 9.910 -5.517 19.039 1.00 18.59 O 1.1360 +ATOM 902 OD2 ASP C 26 11.157 -6.573 17.560 1.00 17.25 O 1.1361 +ATOM 903 N ALA C 27 13.832 -2.181 17.110 1.00 12.95 N 1.1362 +ATOM 904 CA ALA C 27 14.228 -0.972 16.391 1.00 12.27 C 1.1363 +ATOM 905 C ALA C 27 15.325 -1.343 15.393 1.00 14.24 C 1.1364 +ATOM 906 O ALA C 27 15.286 -0.926 14.238 1.00 12.27 O 1.1365 +ATOM 907 CB ALA C 27 14.727 0.106 17.371 1.00 13.97 C 1.1366 +ATOM 908 N ASN C 28 16.296 -2.140 15.836 1.00 13.33 N 1.1367 +ATOM 909 CA ASN C 28 17.367 -2.566 14.936 1.00 15.55 C 1.1368 +ATOM 910 C ASN C 28 16.817 -3.431 13.794 1.00 15.79 C 1.1369 +ATOM 911 O ASN C 28 17.306 -3.351 12.662 1.00 16.15 O 1.1370 +ATOM 912 CB ASN C 28 18.444 -3.321 15.720 1.00 17.45 C 1.1371 +ATOM 913 CG ASN C 28 19.326 -2.390 16.533 1.00 21.66 C 1.1372 +ATOM 914 OD1 ASN C 28 19.919 -2.797 17.535 1.00 24.59 O 1.1373 +ATOM 915 ND2 ASN C 28 19.425 -1.136 16.099 1.00 21.39 N 1.1374 +ATOM 916 N ALA C 29 15.800 -4.246 14.071 1.00 14.19 N 1.1375 +ATOM 917 CA ALA C 29 15.215 -5.076 13.018 1.00 13.61 C 1.1376 +ATOM 918 C ALA C 29 14.560 -4.166 11.976 1.00 14.30 C 1.1377 +ATOM 919 O ALA C 29 14.709 -4.377 10.768 1.00 13.14 O 1.1378 +ATOM 920 CB ALA C 29 14.170 -6.039 13.600 1.00 13.87 C 1.1379 +ATOM 921 N ALA C 30 13.839 -3.151 12.452 1.00 12.73 N 1.1380 +ATOM 922 CA ALA C 30 13.166 -2.209 11.559 1.00 15.17 C 1.1381 +ATOM 923 C ALA C 30 14.184 -1.505 10.673 1.00 15.65 C 1.1382 +ATOM 924 O ALA C 30 13.957 -1.313 9.473 1.00 16.52 O 1.1383 +ATOM 925 CB ALA C 30 12.367 -1.181 12.373 1.00 13.52 C 1.1384 +ATOM 926 N ARG C 31 15.314 -1.125 11.256 1.00 16.43 N 1.1385 +ATOM 927 CA ARG C 31 16.347 -0.453 10.482 1.00 18.24 C 1.1386 +ATOM 928 C ARG C 31 16.904 -1.366 9.400 1.00 17.56 C 1.1387 +ATOM 929 O ARG C 31 17.283 -0.904 8.323 1.00 17.45 O 1.1388 +ATOM 930 CB ARG C 31 17.475 0.016 11.393 1.00 19.33 C 1.1389 +ATOM 931 CG ARG C 31 17.168 1.302 12.123 1.00 23.94 C 1.1390 +ATOM 932 CD ARG C 31 18.369 1.713 12.946 1.00 25.25 C 1.1391 +ATOM 933 NE ARG C 31 18.351 3.127 13.303 1.00 28.33 N 1.1392 +ATOM 934 CZ ARG C 31 18.560 4.126 12.452 1.00 26.62 C 1.1393 +ATOM 935 NH1 ARG C 31 18.806 3.879 11.173 1.00 29.53 N 1.1394 +ATOM 936 NH2 ARG C 31 18.530 5.373 12.885 1.00 26.10 N 1.1395 +ATOM 937 N SER C 32 16.953 -2.663 9.684 1.00 17.09 N 1.1396 +ATOM 938 CA SER C 32 17.460 -3.630 8.714 1.00 18.49 C 1.1397 +ATOM 939 C SER C 32 16.480 -3.750 7.533 1.00 18.90 C 1.1398 +ATOM 940 O SER C 32 16.893 -3.795 6.361 1.00 18.18 O 1.1399 +ATOM 941 CB SER C 32 17.651 -4.995 9.391 1.00 19.75 C 1.1400 +ATOM 942 OG SER C 32 18.327 -5.903 8.534 1.00 22.62 O 1.1401 +ATOM 943 N ASP C 33 15.186 -3.799 7.834 1.00 19.08 N 1.1402 +ATOM 944 CA ASP C 33 14.176 -3.897 6.776 1.00 19.49 C 1.1403 +ATOM 945 C ASP C 33 14.106 -2.589 5.998 1.00 19.22 C 1.1404 +ATOM 946 O ASP C 33 13.869 -2.587 4.788 1.00 18.59 O 1.1405 +ATOM 947 CB ASP C 33 12.800 -4.221 7.355 1.00 22.61 C 1.1406 +ATOM 948 CG ASP C 33 12.633 -5.694 7.670 1.00 26.32 C 1.1407 +ATOM 949 OD1 ASP C 33 13.372 -6.510 7.082 1.00 26.91 O 1.1408 +ATOM 950 OD2 ASP C 33 11.754 -6.038 8.488 1.00 29.29 O 1.1409 +ATOM 951 N ALA C 34 14.327 -1.478 6.694 1.00 16.99 N 1.1410 +ATOM 952 CA ALA C 34 14.300 -0.168 6.050 1.00 16.24 C 1.1411 +ATOM 953 C ALA C 34 15.429 -0.103 5.023 1.00 15.95 C 1.1412 +ATOM 954 O ALA C 34 15.257 0.436 3.922 1.00 15.16 O 1.1413 +ATOM 955 CB ALA C 34 14.467 0.932 7.084 1.00 15.70 C 1.1414 +ATOM 956 N GLN C 35 16.586 -0.655 5.386 1.00 16.21 N 1.1415 +ATOM 957 CA GLN C 35 17.732 -0.678 4.481 1.00 17.90 C 1.1416 +ATOM 958 C GLN C 35 17.435 -1.586 3.292 1.00 17.12 C 1.1417 +ATOM 959 O GLN C 35 17.797 -1.276 2.155 1.00 15.74 O 1.1418 +ATOM 960 CB GLN C 35 18.992 -1.184 5.200 1.00 20.03 C 1.1419 +ATOM 961 CG GLN C 35 20.251 -1.101 4.333 1.00 23.37 C 1.1420 +ATOM 962 CD GLN C 35 20.584 0.324 3.929 1.00 25.42 C 1.1421 +ATOM 963 OE1 GLN C 35 20.985 1.141 4.761 1.00 28.55 O 1.1422 +ATOM 964 NE2 GLN C 35 20.409 0.636 2.645 1.00 28.11 N 1.1423 +ATOM 965 N ALA C 36 16.778 -2.711 3.554 1.00 16.61 N 1.1424 +ATOM 966 CA ALA C 36 16.420 -3.642 2.491 1.00 16.42 C 1.1425 +ATOM 967 C ALA C 36 15.510 -2.918 1.492 1.00 15.52 C 1.1426 +ATOM 968 O ALA C 36 15.667 -3.055 0.277 1.00 15.51 O 1.1427 +ATOM 969 CB ALA C 36 15.707 -4.856 3.076 1.00 18.35 C 1.1428 +ATOM 970 N ALA C 37 14.557 -2.149 2.011 1.00 15.61 N 1.1429 +ATOM 971 CA ALA C 37 13.635 -1.397 1.159 1.00 13.54 C 1.1430 +ATOM 972 C ALA C 37 14.381 -0.361 0.309 1.00 14.22 C 1.1431 +ATOM 973 O ALA C 37 14.124 -0.225 -0.891 1.00 14.17 O 1.1432 +ATOM 974 CB ALA C 37 12.576 -0.702 2.021 1.00 14.75 C 1.1433 +ATOM 975 N LYS C 38 15.298 0.375 0.931 1.00 12.58 N 1.1434 +ATOM 976 CA LYS C 38 16.064 1.391 0.216 1.00 13.87 C 1.1435 +ATOM 977 C LYS C 38 16.914 0.760 -0.881 1.00 13.74 C 1.1436 +ATOM 978 O LYS C 38 16.996 1.294 -1.989 1.00 14.11 O 1.1437 +ATOM 979 CB LYS C 38 16.978 2.167 1.175 1.00 14.69 C 1.1438 +ATOM 980 CG LYS C 38 16.263 3.032 2.197 1.00 16.47 C 1.1439 +ATOM 981 CD LYS C 38 17.286 3.617 3.160 1.00 17.53 C 1.1440 +ATOM 982 CE LYS C 38 16.644 4.226 4.388 1.00 20.65 C 1.1441 +ATOM 983 NZ LYS C 38 17.679 4.648 5.380 1.00 20.23 N 1.1442 +ATOM 984 N ASP C 39 17.543 -0.374 -0.575 1.00 14.25 N 1.1443 +ATOM 985 CA ASP C 39 18.390 -1.056 -1.556 1.00 15.47 C 1.1444 +ATOM 986 C ASP C 39 17.567 -1.544 -2.742 1.00 14.75 C 1.1445 +ATOM 987 O ASP C 39 17.998 -1.427 -3.899 1.00 15.35 O 1.1446 +ATOM 988 CB ASP C 39 19.108 -2.258 -0.919 1.00 17.54 C 1.1447 +ATOM 989 CG ASP C 39 20.229 -1.854 0.027 1.00 21.35 C 1.1448 +ATOM 990 OD1 ASP C 39 20.794 -2.758 0.687 1.00 23.81 O 1.1449 +ATOM 991 OD2 ASP C 39 20.555 -0.655 0.109 1.00 23.00 O 1.1450 +ATOM 992 N ASP C 40 16.375 -2.070 -2.472 1.00 13.08 N 1.1451 +ATOM 993 CA ASP C 40 15.538 -2.570 -3.559 1.00 13.46 C 1.1452 +ATOM 994 C ASP C 40 14.967 -1.429 -4.394 1.00 13.06 C 1.1453 +ATOM 995 O ASP C 40 14.785 -1.577 -5.610 1.00 11.47 O 1.1454 +ATOM 996 CB ASP C 40 14.403 -3.451 -3.023 1.00 12.70 C 1.1455 +ATOM 997 CG ASP C 40 14.008 -4.563 -4.009 1.00 16.94 C 1.1456 +ATOM 998 OD1 ASP C 40 12.803 -4.880 -4.091 1.00 14.73 O 1.1457 +ATOM 999 OD2 ASP C 40 14.907 -5.129 -4.690 1.00 15.59 O 1.1458 +ATOM 1000 N ALA C 41 14.690 -0.288 -3.761 1.00 11.45 N 1.1459 +ATOM 1001 CA ALA C 41 14.180 0.848 -4.516 1.00 12.03 C 1.1460 +ATOM 1002 C ALA C 41 15.299 1.390 -5.417 1.00 11.28 C 1.1461 +ATOM 1003 O ALA C 41 15.042 1.820 -6.542 1.00 13.64 O 1.1462 +ATOM 1004 CB ALA C 41 13.667 1.948 -3.570 1.00 11.36 C 1.1463 +ATOM 1005 N ALA C 42 16.540 1.367 -4.927 1.00 12.59 N 1.1464 +ATOM 1006 CA ALA C 42 17.674 1.836 -5.721 1.00 11.99 C 1.1465 +ATOM 1007 C ALA C 42 17.874 0.891 -6.903 1.00 12.60 C 1.1466 +ATOM 1008 O ALA C 42 18.243 1.322 -7.999 1.00 13.26 O 1.1467 +ATOM 1009 CB ALA C 42 18.946 1.891 -4.867 1.00 12.59 C 1.1468 +ATOM 1010 N ARG C 43 17.627 -0.398 -6.678 1.00 12.69 N 1.1469 +ATOM 1011 CA ARG C 43 17.759 -1.386 -7.746 1.00 13.23 C 1.1470 +ATOM 1012 C ARG C 43 16.775 -1.042 -8.867 1.00 13.36 C 1.1471 +ATOM 1013 O ARG C 43 17.122 -1.074 -10.049 1.00 12.92 O 1.1472 +ATOM 1014 CB ARG C 43 17.477 -2.804 -7.209 1.00 14.06 C 1.1473 +ATOM 1015 CG ARG C 43 17.672 -3.914 -8.249 1.00 15.16 C 1.1474 +ATOM 1016 CD ARG C 43 17.661 -5.308 -7.624 1.00 16.94 C 1.1475 +ATOM 1017 NE ARG C 43 16.336 -5.778 -7.222 1.00 17.10 N 1.1476 +ATOM 1018 CZ ARG C 43 15.506 -6.477 -7.998 1.00 16.27 C 1.1477 +ATOM 1019 NH1 ARG C 43 15.851 -6.815 -9.237 1.00 18.19 N 1.1478 +ATOM 1020 NH2 ARG C 43 14.338 -6.882 -7.517 1.00 17.34 N 1.1479 +ATOM 1021 N ALA C 44 15.545 -0.701 -8.499 1.00 13.96 N 1.1480 +ATOM 1022 CA ALA C 44 14.544 -0.352 -9.507 1.00 13.75 C 1.1481 +ATOM 1023 C ALA C 44 14.980 0.883 -10.300 1.00 13.87 C 1.1482 +ATOM 1024 O ALA C 44 14.912 0.885 -11.531 1.00 14.37 O 1.1483 +ATOM 1025 CB ALA C 44 13.188 -0.110 -8.854 1.00 14.34 C 1.1484 +ATOM 1026 N ASN C 45 15.445 1.926 -9.610 1.00 13.94 N 1.1485 +ATOM 1027 CA ASN C 45 15.879 3.141 -10.304 1.00 15.52 C 1.1486 +ATOM 1028 C ASN C 45 17.058 2.873 -11.245 1.00 15.50 C 1.1487 +ATOM 1029 O ASN C 45 17.160 3.480 -12.317 1.00 17.30 O 1.1488 +ATOM 1030 CB ASN C 45 16.254 4.242 -9.299 1.00 17.31 C 1.1489 +ATOM 1031 CG ASN C 45 15.038 4.851 -8.625 1.00 21.14 C 1.1490 +ATOM 1032 OD1 ASN C 45 14.028 5.118 -9.279 1.00 25.80 O 1.1491 +ATOM 1033 ND2 ASN C 45 15.130 5.088 -7.320 1.00 21.56 N 1.1492 +ATOM 1034 N GLN C 46 17.944 1.965 -10.842 1.00 15.90 N 1.1493 +ATOM 1035 CA GLN C 46 19.102 1.615 -11.660 1.00 15.83 C 1.1494 +ATOM 1036 C GLN C 46 18.668 0.842 -12.910 1.00 15.85 C 1.1495 +ATOM 1037 O GLN C 46 19.211 1.058 -13.996 1.00 16.45 O 1.1496 +ATOM 1038 CB GLN C 46 20.108 0.802 -10.837 1.00 18.35 C 1.1497 +ATOM 1039 CG GLN C 46 21.361 0.395 -11.606 1.00 23.23 C 1.1498 +ATOM 1040 CD GLN C 46 22.506 -0.006 -10.692 1.00 28.08 C 1.1499 +ATOM 1041 OE1 GLN C 46 23.179 0.848 -10.105 1.00 30.72 O 1.1500 +ATOM 1042 NE2 GLN C 46 22.726 -1.310 -10.555 1.00 28.75 N 1.1501 +ATOM 1043 N ARG C 47 17.689 -0.049 -12.765 1.00 15.04 N 1.1502 +ATOM 1044 CA ARG C 47 17.182 -0.805 -13.914 1.00 15.88 C 1.1503 +ATOM 1045 C ARG C 47 16.523 0.153 -14.910 1.00 17.65 C 1.1504 +ATOM 1046 O ARG C 47 16.665 -0.005 -16.127 1.00 18.79 O 1.1505 +ATOM 1047 CB ARG C 47 16.163 -1.857 -13.461 1.00 15.79 C 1.1506 +ATOM 1048 CG ARG C 47 16.753 -2.950 -12.586 1.00 16.45 C 1.1507 +ATOM 1049 CD ARG C 47 15.664 -3.861 -12.028 1.00 15.56 C 1.1508 +ATOM 1050 NE ARG C 47 15.047 -4.672 -13.077 1.00 14.85 N 1.1509 +ATOM 1051 CZ ARG C 47 13.973 -5.432 -12.903 1.00 14.29 C 1.1510 +ATOM 1052 NH1 ARG C 47 13.383 -5.485 -11.715 1.00 15.12 N 1.1511 +ATOM 1053 NH2 ARG C 47 13.491 -6.149 -13.921 1.00 14.56 N 1.1512 +ATOM 1054 N LEU C 48 15.802 1.144 -14.393 1.00 17.24 N 1.1513 +ATOM 1055 CA LEU C 48 15.137 2.121 -15.251 1.00 19.19 C 1.1514 +ATOM 1056 C LEU C 48 16.189 2.948 -15.988 1.00 19.56 C 1.1515 +ATOM 1057 O LEU C 48 16.060 3.204 -17.183 1.00 19.73 O 1.1516 +ATOM 1058 CB LEU C 48 14.237 3.046 -14.415 1.00 18.98 C 1.1517 +ATOM 1059 CG LEU C 48 13.404 4.109 -15.147 1.00 22.22 C 1.1518 +ATOM 1060 CD1 LEU C 48 12.369 3.433 -16.029 1.00 21.49 C 1.1519 +ATOM 1061 CD2 LEU C 48 12.709 5.014 -14.132 1.00 19.75 C 1.1520 +ATOM 1062 N ASP C 49 17.239 3.353 -15.282 1.00 18.61 N 1.1521 +ATOM 1063 CA ASP C 49 18.288 4.154 -15.905 1.00 19.53 C 1.1522 +ATOM 1064 C ASP C 49 19.120 3.380 -16.918 1.00 18.65 C 1.1523 +ATOM 1065 O ASP C 49 19.665 3.963 -17.857 1.00 18.24 O 1.1524 +ATOM 1066 CB ASP C 49 19.219 4.748 -14.848 1.00 21.51 C 1.1525 +ATOM 1067 CG ASP C 49 18.606 5.937 -14.135 1.00 24.20 C 1.1526 +ATOM 1068 OD1 ASP C 49 17.953 6.759 -14.808 1.00 26.65 O 1.1527 +ATOM 1069 OD2 ASP C 49 18.788 6.061 -12.909 1.00 27.02 O 1.1528 +ATOM 1070 N ASN C 50 19.216 2.069 -16.732 1.00 16.96 N 1.1529 +ATOM 1071 CA ASN C 50 20.016 1.243 -17.627 1.00 18.52 C 1.1530 +ATOM 1072 C ASN C 50 19.223 0.595 -18.761 1.00 18.46 C 1.1531 +ATOM 1073 O ASN C 50 19.741 -0.283 -19.457 1.00 19.28 O 1.1532 +ATOM 1074 CB ASN C 50 20.755 0.168 -16.817 1.00 17.98 C 1.1533 +ATOM 1075 CG ASN C 50 21.844 0.750 -15.916 1.00 21.08 C 1.1534 +ATOM 1076 OD1 ASN C 50 22.378 0.061 -15.033 1.00 22.08 O 1.1535 +ATOM 1077 ND2 ASN C 50 22.187 2.015 -16.142 1.00 16.64 N 1.1536 +ATOM 1078 N MET C 51 17.983 1.034 -18.961 1.00 21.09 N 1.1537 +ATOM 1079 CA MET C 51 17.142 0.479 -20.022 1.00 24.20 C 1.1538 +ATOM 1080 C MET C 51 17.689 0.725 -21.417 1.00 24.88 C 1.1539 +ATOM 1081 O MET C 51 18.250 1.783 -21.705 1.00 26.01 O 1.1540 +ATOM 1082 CB MET C 51 15.727 1.064 -19.982 1.00 25.70 C 1.1541 +ATOM 1083 CG MET C 51 14.797 0.466 -18.956 1.00 30.75 C 1.1542 +ATOM 1084 SD MET C 51 13.082 0.841 -19.389 1.00 36.38 S 1.1543 +ATOM 1085 CE MET C 51 13.060 2.610 -19.205 1.00 35.46 C 1.1544 +ATOM 1086 N ALA C 52 17.482 -0.254 -22.288 1.00 27.19 N 1.1545 +ATOM 1087 CA ALA C 52 17.926 -0.164 -23.670 1.00 29.66 C 1.1546 +ATOM 1088 C ALA C 52 16.956 0.717 -24.453 1.00 31.56 C 1.1547 +ATOM 1089 O ALA C 52 15.767 0.768 -24.146 1.00 32.88 O 1.1548 +ATOM 1090 CB ALA C 52 17.986 -1.558 -24.285 1.00 28.85 C 1.1549 +ATOM 1091 N THR C 53 17.473 1.406 -25.464 1.00 33.61 N 1.1550 +ATOM 1092 CA THR C 53 16.662 2.284 -26.299 1.00 34.85 C 1.1551 +ATOM 1093 C THR C 53 15.514 1.508 -26.940 1.00 34.25 C 1.1552 +ATOM 1094 CB THR C 53 17.514 2.913 -27.416 1.00 36.03 C 1.1553 +ATOM 1095 OG1 THR C 53 18.632 3.602 -26.835 1.00 39.01 O 1.1554 +ATOM 1096 CG2 THR C 53 16.683 3.886 -28.234 1.00 36.82 C 1.1555 +TER 1097 THR C 53 1.1556 +HETATM 1098 ZN ZN A 81 6.108 8.865 50.946 1.00 20.35 ZN 1.1557 +HETATM 1099 ZN ZN B 82 25.589 3.098 50.029 1.00 24.34 ZN 1.1558 +HETATM 1100 ZN ZN C 83 9.244 -9.008 49.645 1.00 16.98 ZN 1.1559 +HETATM 1101 O HOH A 107 9.993 -7.643 -6.935 1.00 19.13 O 1.1560 +HETATM 1102 O HOH A 111 14.340 -8.631 -11.330 1.00 16.20 O 1.1561 +HETATM 1103 O HOH A 112 10.212 5.923 21.655 1.00 17.58 O 1.1562 +HETATM 1104 O HOH A 113 1.359 -1.664 -9.436 1.00 33.38 O 1.1563 +HETATM 1105 O HOH A 114 5.205 7.623 35.708 1.00 30.30 O 1.1564 +HETATM 1106 O HOH A 119 3.676 3.972 -3.847 1.00 20.80 O 1.1565 +HETATM 1107 O HOH A 120 3.638 -0.581 -14.517 1.00 36.01 O 1.1566 +HETATM 1108 O HOH A 127 6.725 1.233 43.945 1.00 23.36 O 1.1567 +HETATM 1109 O HOH A 128 2.604 4.230 26.160 1.00 36.82 O 1.1568 +HETATM 1110 O HOH A 131 4.415 -5.964 -3.235 1.00 25.34 O 1.1569 +HETATM 1111 O HOH A 132 10.255 10.202 26.460 1.00 34.02 O 1.1570 +HETATM 1112 O HOH A 134 2.563 -1.146 -2.405 1.00 34.54 O 1.1571 +HETATM 1113 O HOH A 137 2.340 -1.959 13.894 1.00 32.62 O 1.1572 +HETATM 1114 O HOH A 140 11.200 -8.669 -9.047 1.00 31.19 O 1.1573 +HETATM 1115 O HOH A 143 12.485 -6.737 -17.654 1.00 44.47 O 1.1574 +HETATM 1116 O HOH A 145 7.550 5.173 11.081 1.00 36.66 O 1.1575 +HETATM 1117 O HOH A 146 3.368 -3.474 6.948 1.00 23.71 O 1.1576 +HETATM 1118 O HOH A 149 17.583 7.490 37.012 1.00 41.47 O 1.1577 +HETATM 1119 O HOH A 151 8.441 -7.861 0.493 1.00 43.73 O 1.1578 +HETATM 1120 O HOH A 153 17.152 10.026 40.735 1.00 40.52 O 1.1579 +HETATM 1121 O HOH A 155 13.606 10.669 54.390 1.00 27.21 O 1.1580 +HETATM 1122 O HOH A 159 9.120 2.925 53.244 1.00 32.13 O 1.1581 +HETATM 1123 O HOH A 161 0.947 5.913 10.315 1.00 42.96 O 1.1582 +HETATM 1124 O HOH A 163 6.746 7.943 44.785 1.00 37.53 O 1.1583 +HETATM 1125 O HOH A 171 3.182 5.565 23.375 1.00 28.74 O 1.1584 +HETATM 1126 O HOH A 172 11.051 9.820 38.460 1.00 29.26 O 1.1585 +HETATM 1127 O HOH A 173 3.082 6.562 37.125 1.00 40.25 O 1.1586 +HETATM 1128 O HOH A 174 0.104 -4.322 -16.075 1.00 46.84 O 1.1587 +HETATM 1129 O HOH A 177 11.685 11.728 47.232 1.00 31.47 O 1.1588 +HETATM 1130 O HOH A 179 6.226 -8.343 -2.134 1.00 36.61 O 1.1589 +HETATM 1131 O HOH A 180 2.858 3.727 30.759 1.00 43.09 O 1.1590 +HETATM 1132 O HOH A 182 17.180 7.898 53.540 1.00 42.00 O 1.1591 +HETATM 1133 O HOH A 184 5.740 -5.450 10.750 1.00 32.31 O 1.1592 +HETATM 1134 O HOH A 186 8.486 11.508 52.814 1.00 30.80 O 1.1593 +HETATM 1135 O HOH A 189 1.480 0.733 -13.974 1.00 53.36 O 1.1594 +HETATM 1136 O HOH A 191 10.152 11.713 44.517 1.00 34.36 O 1.1595 +HETATM 1137 O HOH A 198 8.014 -9.934 -3.454 1.00 39.82 O 1.1596 +HETATM 1138 O HOH A 199 8.273 -10.737 -11.245 1.00 40.84 O 1.1597 +HETATM 1139 O HOH A 200 6.110 -9.615 -12.267 1.00 53.36 O 1.1598 +HETATM 1140 O HOH A 201 17.889 9.830 51.518 1.00 53.90 O 1.1599 +HETATM 1141 O HOH A 202 8.773 -3.721 -24.171 1.00 43.29 O 1.1600 +HETATM 1142 O HOH A 204 3.863 4.747 28.352 1.00 27.74 O 1.1601 +HETATM 1143 O HOH A 211 4.053 5.777 11.276 1.00 35.21 O 1.1602 +HETATM 1144 O HOH A 213 3.414 -4.124 4.448 1.00 39.81 O 1.1603 +HETATM 1145 O HOH A 214 3.249 -1.359 0.767 1.00 20.13 O 1.1604 +HETATM 1146 O HOH A 215 1.931 -3.148 2.390 1.00 35.23 O 1.1605 +HETATM 1147 O HOH A 216 2.104 1.153 1.491 1.00 44.69 O 1.1606 +HETATM 1148 O HOH A 217 0.384 -4.284 -5.000 1.00 49.94 O 1.1607 +HETATM 1149 O HOH A 218 1.749 -3.642 -2.729 1.00 51.39 O 1.1608 +HETATM 1150 O HOH A 219 -0.132 -7.381 -5.622 1.00 42.19 O 1.1609 +HETATM 1151 O HOH A 220 15.014 12.584 47.000 1.00 38.94 O 1.1610 +HETATM 1152 O HOH A 221 7.306 10.349 44.929 1.00 28.91 O 1.1611 +HETATM 1153 O HOH A 224 6.227 9.666 39.920 1.00 23.02 O 1.1612 +HETATM 1154 O HOH A 225 6.393 7.715 37.935 1.00 25.45 O 1.1613 +HETATM 1155 O HOH A 226 4.398 5.130 40.198 1.00 42.01 O 1.1614 +HETATM 1156 O HOH A 227 12.515 10.796 41.549 1.00 34.45 O 1.1615 +HETATM 1157 O HOH A 228 5.297 -2.320 26.220 1.00 33.16 O 1.1616 +HETATM 1158 O HOH A 229 2.547 0.584 17.569 1.00 29.66 O 1.1617 +HETATM 1159 O HOH A 231 9.471 -4.130 23.741 1.00 23.59 O 1.1618 +HETATM 1160 O HOH A 232 10.216 11.999 56.732 1.00 33.32 O 1.1619 +HETATM 1161 O HOH A 238 4.348 -8.641 2.908 1.00 46.65 O 1.1620 +HETATM 1162 O HOH A 246 17.063 6.137 39.251 1.00 32.13 O 1.1621 +HETATM 1163 O HOH A 253 3.187 -5.547 8.648 1.00 45.89 O 1.1622 +HETATM 1164 O HOH A 258 2.797 7.400 52.852 1.00 37.95 O 1.1623 +HETATM 1165 O HOH A 259 10.715 2.275 55.297 1.00 43.08 O 1.1624 +HETATM 1166 O HOH A 270 3.410 7.634 27.180 1.00 46.25 O 1.1625 +HETATM 1167 O HOH A 272 10.511 -9.988 -2.617 1.00 53.80 O 1.1626 +HETATM 1168 O HOH A 274 4.945 -7.050 -5.742 1.00 30.61 O 1.1627 +HETATM 1169 O HOH A 285 4.812 2.790 35.136 1.00 37.15 O 1.1628 +HETATM 1170 O HOH A 287 20.449 8.779 38.804 1.00 48.25 O 1.1629 +HETATM 1171 O HOH A 288 3.259 5.630 34.793 1.00 48.36 O 1.1630 +HETATM 1172 O HOH A 292 10.804 -7.678 -0.657 1.00 40.59 O 1.1631 +HETATM 1173 O HOH A 297 13.962 2.919 54.985 1.00 44.54 O 1.1632 +HETATM 1174 O HOH A 303 -3.148 1.045 32.136 1.00 42.80 O 1.1633 +HETATM 1175 O HOH A 304 -1.919 3.317 33.288 1.00 58.38 O 1.1634 +HETATM 1176 O HOH A 306 -2.688 -4.561 14.482 1.00 48.66 O 1.1635 +HETATM 1177 O HOH A 311 -0.281 -0.019 -3.977 1.00 36.43 O 1.1636 +HETATM 1178 O HOH A 318 10.732 4.760 56.797 1.00 47.25 O 1.1637 +HETATM 1179 O HOH A 334 3.892 8.564 49.747 1.00 28.23 O 1.1638 +HETATM 1180 O HOH B 103 6.017 3.543 -0.143 1.00 13.09 O 1.1639 +HETATM 1181 O HOH B 105 9.177 9.516 12.135 1.00 21.15 O 1.1640 +HETATM 1182 O HOH B 108 12.097 9.706 22.413 1.00 26.40 O 1.1641 +HETATM 1183 O HOH B 110 16.217 -4.712 37.497 1.00 29.45 O 1.1642 +HETATM 1184 O HOH B 115 4.282 6.111 -5.541 1.00 18.77 O 1.1643 +HETATM 1185 O HOH B 116 9.947 11.484 -12.078 1.00 35.98 O 1.1644 +HETATM 1186 O HOH B 117 4.896 2.014 1.923 1.00 23.86 O 1.1645 +HETATM 1187 O HOH B 118 0.246 4.342 -6.783 1.00 36.49 O 1.1646 +HETATM 1188 O HOH B 122 17.533 -2.876 36.148 1.00 23.43 O 1.1647 +HETATM 1189 O HOH B 126 18.139 1.677 7.642 1.00 24.32 O 1.1648 +HETATM 1190 O HOH B 135 26.289 -0.800 50.257 1.00 34.39 O 1.1649 +HETATM 1191 O HOH B 139 8.018 10.014 -2.265 1.00 33.86 O 1.1650 +HETATM 1192 O HOH B 141 12.018 2.950 -10.513 1.00 25.83 O 1.1651 +HETATM 1193 O HOH B 144 4.486 5.580 0.572 1.00 39.35 O 1.1652 +HETATM 1194 O HOH B 147 14.267 11.928 15.347 1.00 30.16 O 1.1653 +HETATM 1195 O HOH B 148 5.723 7.878 1.490 1.00 33.73 O 1.1654 +HETATM 1196 O HOH B 150 14.596 10.360 21.207 1.00 41.74 O 1.1655 +HETATM 1197 O HOH B 152 21.388 4.454 47.621 1.00 27.63 O 1.1656 +HETATM 1198 O HOH B 154 13.800 5.974 -4.996 1.00 19.14 O 1.1657 +HETATM 1199 O HOH B 162 2.818 4.765 -7.458 1.00 25.42 O 1.1658 +HETATM 1200 O HOH B 164 26.986 6.236 53.325 1.00 44.72 O 1.1659 +HETATM 1201 O HOH B 167 2.390 8.859 -9.424 1.00 36.83 O 1.1660 +HETATM 1202 O HOH B 169 19.843 6.477 34.772 1.00 24.13 O 1.1661 +HETATM 1203 O HOH B 170 12.274 9.823 -13.863 1.00 29.31 O 1.1662 +HETATM 1204 O HOH B 183 16.010 8.906 1.937 1.00 43.26 O 1.1663 +HETATM 1205 O HOH B 187 9.749 11.741 7.479 1.00 30.67 O 1.1664 +HETATM 1206 O HOH B 188 16.945 -6.181 55.614 1.00 43.82 O 1.1665 +HETATM 1207 O HOH B 190 20.825 6.131 28.438 1.00 31.69 O 1.1666 +HETATM 1208 O HOH B 192 1.293 2.814 -9.815 1.00 22.78 O 1.1667 +HETATM 1209 O HOH B 193 16.682 9.026 -9.956 1.00 36.17 O 1.1668 +HETATM 1210 O HOH B 205 13.770 9.258 27.440 1.00 44.18 O 1.1669 +HETATM 1211 O HOH B 206 15.172 11.246 30.156 1.00 55.53 O 1.1670 +HETATM 1212 O HOH B 207 13.845 9.906 32.267 1.00 51.70 O 1.1671 +HETATM 1213 O HOH B 208 9.808 7.035 24.388 1.00 34.73 O 1.1672 +HETATM 1214 O HOH B 210 20.130 4.428 22.320 1.00 38.72 O 1.1673 +HETATM 1215 O HOH B 212 3.091 2.165 6.381 1.00 35.71 O 1.1674 +HETATM 1216 O HOH B 233 6.839 7.564 12.126 1.00 30.31 O 1.1675 +HETATM 1217 O HOH B 235 7.426 12.845 -15.551 1.00 52.57 O 1.1676 +HETATM 1218 O HOH B 239 24.294 -3.347 47.403 1.00 26.29 O 1.1677 +HETATM 1219 O HOH B 241 18.613 -1.896 25.552 1.00 40.78 O 1.1678 +HETATM 1220 O HOH B 242 20.332 -3.959 53.526 1.00 27.13 O 1.1679 +HETATM 1221 O HOH B 243 18.035 -3.148 54.860 1.00 44.80 O 1.1680 +HETATM 1222 O HOH B 244 14.579 -7.404 51.886 1.00 52.09 O 1.1681 +HETATM 1223 O HOH B 245 14.146 -9.020 54.328 1.00 39.62 O 1.1682 +HETATM 1224 O HOH B 247 8.737 12.923 3.158 1.00 46.96 O 1.1683 +HETATM 1225 O HOH B 249 6.323 12.234 4.653 1.00 51.77 O 1.1684 +HETATM 1226 O HOH B 250 2.992 7.003 -1.509 1.00 51.20 O 1.1685 +HETATM 1227 O HOH B 251 5.117 9.378 -0.802 1.00 35.74 O 1.1686 +HETATM 1228 O HOH B 252 3.311 8.370 -4.615 1.00 47.07 O 1.1687 +HETATM 1229 O HOH B 255 22.038 2.154 28.866 1.00 41.65 O 1.1688 +HETATM 1230 O HOH B 256 23.395 1.782 37.565 1.00 27.12 O 1.1689 +HETATM 1231 O HOH B 257 20.154 -7.667 40.781 1.00 54.95 O 1.1690 +HETATM 1232 O HOH B 262 13.901 1.879 10.237 1.00 27.59 O 1.1691 +HETATM 1233 O HOH B 266 11.244 11.297 4.770 1.00 25.29 O 1.1692 +HETATM 1234 O HOH B 268 6.933 11.980 7.319 1.00 30.93 O 1.1693 +HETATM 1235 O HOH B 271 7.153 9.984 -4.768 1.00 28.84 O 1.1694 +HETATM 1236 O HOH B 275 6.575 8.781 4.423 1.00 50.19 O 1.1695 +HETATM 1237 O HOH B 277 10.833 11.711 10.405 1.00 29.82 O 1.1696 +HETATM 1238 O HOH B 278 22.833 2.256 25.981 1.00 30.68 O 1.1697 +HETATM 1239 O HOH B 279 13.586 8.930 35.650 1.00 38.04 O 1.1698 +HETATM 1240 O HOH B 280 9.707 8.585 -21.244 1.00 50.65 O 1.1699 +HETATM 1241 O HOH B 281 9.427 11.267 -15.744 1.00 45.31 O 1.1700 +HETATM 1242 O HOH B 289 22.681 5.387 40.325 1.00 51.34 O 1.1701 +HETATM 1243 O HOH B 290 25.252 0.659 38.933 1.00 33.49 O 1.1702 +HETATM 1244 O HOH B 291 22.560 -2.530 37.283 1.00 30.59 O 1.1703 +HETATM 1245 O HOH B 298 14.933 8.378 -4.757 1.00 47.35 O 1.1704 +HETATM 1246 O HOH B 299 11.772 7.047 -17.894 1.00 51.85 O 1.1705 +HETATM 1247 O HOH B 301 3.155 9.029 2.408 1.00 48.26 O 1.1706 +HETATM 1248 O HOH B 302 22.121 -14.214 39.953 1.00 43.09 O 1.1707 +HETATM 1249 O HOH B 305 10.515 8.145 -15.482 1.00 50.03 O 1.1708 +HETATM 1250 O HOH B 310 18.093 10.237 26.189 1.00 51.56 O 1.1709 +HETATM 1251 O HOH B 313 22.160 -1.893 26.270 1.00 43.51 O 1.1710 +HETATM 1252 O HOH B 314 16.381 -8.705 55.676 1.00 48.58 O 1.1711 +HETATM 1253 O HOH B 316 20.487 -6.347 36.321 1.00 43.22 O 1.1712 +HETATM 1254 O HOH B 317 22.339 -8.837 41.960 1.00 43.60 O 1.1713 +HETATM 1255 O HOH B 323 21.171 6.689 23.135 1.00 53.46 O 1.1714 +HETATM 1256 O HOH B 324 6.344 11.456 -6.748 1.00 43.16 O 1.1715 +HETATM 1257 O HOH B 325 13.260 7.500 31.362 1.00 52.15 O 1.1716 +HETATM 1258 O HOH B 326 7.095 14.537 -12.456 1.00 40.89 O 1.1717 +HETATM 1259 O HOH B 328 19.962 -3.956 37.139 1.00 43.11 O 1.1718 +HETATM 1260 O HOH B 330 20.326 8.204 30.027 1.00 41.14 O 1.1719 +HETATM 1261 O HOH B 333 14.130 7.345 -16.887 1.00 44.06 O 1.1720 +HETATM 1262 O HOH C 101 17.423 -5.539 -3.580 1.00 18.39 O 1.1721 +HETATM 1263 O HOH C 102 10.196 -4.750 9.903 1.00 22.86 O 1.1722 +HETATM 1264 O HOH C 104 12.279 -7.206 -5.315 1.00 16.80 O 1.1723 +HETATM 1265 O HOH C 106 11.755 -5.191 -1.523 1.00 18.69 O 1.1724 +HETATM 1266 O HOH C 109 23.421 -1.087 1.630 1.00 39.80 O 1.1725 +HETATM 1267 O HOH C 121 5.376 -7.301 55.637 1.00 19.36 O 1.1726 +HETATM 1268 O HOH C 123 13.105 -10.176 52.093 1.00 29.42 O 1.1727 +HETATM 1269 O HOH C 124 17.319 -2.324 -17.264 1.00 18.79 O 1.1728 +HETATM 1270 O HOH C 125 8.445 -3.112 56.229 1.00 27.39 O 1.1729 +HETATM 1271 O HOH C 129 13.943 -4.519 52.176 1.00 35.31 O 1.1730 +HETATM 1272 O HOH C 130 21.289 -2.773 -14.759 1.00 19.71 O 1.1731 +HETATM 1273 O HOH C 133 4.275 -3.328 53.234 1.00 15.57 O 1.1732 +HETATM 1274 O HOH C 136 16.975 3.988 -2.256 1.00 23.56 O 1.1733 +HETATM 1275 O HOH C 138 19.888 -2.930 12.132 1.00 30.69 O 1.1734 +HETATM 1276 O HOH C 142 17.937 7.334 4.121 1.00 30.28 O 1.1735 +HETATM 1277 O HOH C 156 10.638 -0.517 55.026 1.00 32.17 O 1.1736 +HETATM 1278 O HOH C 157 20.613 1.802 -0.889 1.00 43.12 O 1.1737 +HETATM 1279 O HOH C 158 12.224 -8.312 40.399 1.00 34.82 O 1.1738 +HETATM 1280 O HOH C 160 20.595 4.353 1.259 1.00 51.47 O 1.1739 +HETATM 1281 O HOH C 165 13.936 -8.670 26.845 1.00 28.09 O 1.1740 +HETATM 1282 O HOH C 166 4.014 1.496 39.709 1.00 42.35 O 1.1741 +HETATM 1283 O HOH C 168 9.546 -8.019 37.029 1.00 25.33 O 1.1742 +HETATM 1284 O HOH C 175 17.480 3.439 15.606 1.00 22.17 O 1.1743 +HETATM 1285 O HOH C 176 4.339 -5.320 45.983 1.00 23.43 O 1.1744 +HETATM 1286 O HOH C 178 11.281 -8.477 9.339 1.00 46.23 O 1.1745 +HETATM 1287 O HOH C 181 17.603 -6.834 16.298 1.00 38.67 O 1.1746 +HETATM 1288 O HOH C 185 18.315 5.501 -6.408 1.00 28.48 O 1.1747 +HETATM 1289 O HOH C 194 10.118 -10.599 48.167 1.00 15.87 O 1.1748 +HETATM 1290 O HOH C 195 13.987 -12.615 53.546 1.00 43.62 O 1.1749 +HETATM 1291 O HOH C 196 12.605 -6.806 54.388 1.00 26.22 O 1.1750 +HETATM 1292 O HOH C 197 20.517 4.730 -11.632 1.00 40.71 O 1.1751 +HETATM 1293 O HOH C 203 7.745 1.546 41.499 1.00 25.77 O 1.1752 +HETATM 1294 O HOH C 209 18.866 1.382 17.047 1.00 27.41 O 1.1753 +HETATM 1295 O HOH C 222 10.003 -7.834 28.036 1.00 26.96 O 1.1754 +HETATM 1296 O HOH C 223 19.905 6.406 -27.486 1.00 48.31 O 1.1755 +HETATM 1297 O HOH C 230 9.414 -3.937 21.016 1.00 22.59 O 1.1756 +HETATM 1298 O HOH C 234 15.052 -4.736 40.276 1.00 24.83 O 1.1757 +HETATM 1299 O HOH C 236 19.963 2.039 9.576 1.00 53.11 O 1.1758 +HETATM 1300 O HOH C 237 20.728 -2.452 9.344 1.00 35.98 O 1.1759 +HETATM 1301 O HOH C 240 18.593 -5.134 23.083 1.00 27.37 O 1.1760 +HETATM 1302 O HOH C 248 20.842 -1.586 -4.543 1.00 29.45 O 1.1761 +HETATM 1303 O HOH C 254 14.650 -6.431 -16.373 1.00 27.96 O 1.1762 +HETATM 1304 O HOH C 260 4.586 0.661 36.666 1.00 34.74 O 1.1763 +HETATM 1305 O HOH C 261 6.403 -4.664 36.849 1.00 34.23 O 1.1764 +HETATM 1306 O HOH C 263 18.941 4.356 -20.701 1.00 42.80 O 1.1765 +HETATM 1307 O HOH C 264 19.694 3.765 -8.145 1.00 26.25 O 1.1766 +HETATM 1308 O HOH C 265 19.833 -4.366 -13.564 1.00 30.97 O 1.1767 +HETATM 1309 O HOH C 267 21.260 -1.955 -7.440 1.00 29.83 O 1.1768 +HETATM 1310 O HOH C 269 12.297 -7.174 46.327 1.00 37.44 O 1.1769 +HETATM 1311 O HOH C 273 13.634 -9.103 -8.847 1.00 31.83 O 1.1770 +HETATM 1312 O HOH C 276 16.421 -7.534 7.468 1.00 41.49 O 1.1771 +HETATM 1313 O HOH C 282 21.486 -3.891 3.072 1.00 33.92 O 1.1772 +HETATM 1314 O HOH C 283 3.946 -3.471 35.043 1.00 37.21 O 1.1773 +HETATM 1315 O HOH C 284 17.493 6.296 -19.597 1.00 34.07 O 1.1774 +HETATM 1316 O HOH C 286 12.924 -9.136 22.127 1.00 31.37 O 1.1775 +HETATM 1317 O HOH C 293 24.175 -0.330 5.835 1.00 48.18 O 1.1776 +HETATM 1318 O HOH C 294 0.286 -3.402 50.829 1.00 29.19 O 1.1777 +HETATM 1319 O HOH C 295 5.516 -7.628 49.118 1.00 30.04 O 1.1778 +HETATM 1320 O HOH C 296 13.991 -8.624 48.673 1.00 48.65 O 1.1779 +HETATM 1321 O HOH C 300 6.177 -8.242 51.651 1.00 38.60 O 1.1780 +HETATM 1322 O HOH C 307 15.975 -8.838 28.485 1.00 41.21 O 1.1781 +HETATM 1323 O HOH C 308 13.740 -5.615 0.064 1.00 36.47 O 1.1782 +HETATM 1324 O HOH C 309 14.519 -9.243 24.380 1.00 38.53 O 1.1783 +HETATM 1325 O HOH C 312 7.557 -8.731 38.483 1.00 33.77 O 1.1784 +HETATM 1326 O HOH C 315 15.943 -2.747 -21.871 1.00 37.94 O 1.1785 +HETATM 1327 O HOH C 319 26.292 -0.036 -11.403 1.00 49.62 O 1.1786 +HETATM 1328 O HOH C 320 20.967 -6.327 8.715 1.00 30.89 O 1.1787 +HETATM 1329 O HOH C 321 14.892 -7.699 33.600 1.00 31.06 O 1.1788 +HETATM 1330 O HOH C 322 21.209 -5.169 33.215 1.00 49.75 O 1.1789 +HETATM 1331 O HOH C 327 16.281 -7.013 35.875 1.00 43.46 O 1.1790 +HETATM 1332 O HOH C 329 16.175 4.847 -4.592 1.00 37.97 O 1.1791 +HETATM 1333 O HOH C 331 13.042 -9.686 37.607 1.00 39.62 O 1.1792 +HETATM 1334 O HOH C 332 3.914 6.757 45.976 1.00 46.06 O 1.1793 +CONECT 1 1098 1.1794 +CONECT 4 1098 1.1795 +CONECT 50 1098 1.1796 +CONECT 359 1099 1.1797 +CONECT 362 1099 1.1798 +CONECT 407 1099 1.1799 +CONECT 408 1099 1.1800 +CONECT 725 1100 1.1801 +CONECT 728 1100 1.1802 +CONECT 774 1100 1.1803 +CONECT 1098 1 4 50 1179 1.1804 +CONECT 1099 359 362 407 408 1.1805 +CONECT 1100 725 728 774 1289 1.1806 +CONECT 1179 1098 1.1807 +CONECT 1289 1100 1.1808 +MASTER 351 0 3 3 0 0 3 6 1331 3 15 15 1.1809 +END