USER MOD reduce.3.24.130724 H: found=0, std=0, add=2151, rem=0, adj=79 USER MOD reduce.3.24.130724 removed 2143 hydrogens (3 hets) HEADER ONCOPROTEIN 09-APR-18 6G8I TITLE 14-3-3SIGMA IN COMPLEX WITH A R124BETA3R MUTATED YAP PS127 TITLE 2 PHOSPHOPEPTIDE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 14-3-3 PROTEIN SIGMA; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: EPITHELIAL CELL MARKER PROTEIN 1,STRATIFIN; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: ALA-HIS-SEP-SER-PRO-ALA-SER-LEU-GLN; COMPND 8 CHAIN: P; COMPND 9 ENGINEERED: YES; COMPND 0 OTHER_DETAILS: (BAR) IS A BETA3-ARGININE UNNATURAL AMINO ACID SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: SFN, HME1; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 0 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 1 ORGANISM_TAXID: 9606 KEYWDS BETA AMINO ACID HIPPO PATHWAY YAP/TAZ, ONCOPROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR S.A.ANDREI,V.THIJSSEN,L.BRUNSVELD,C.OTTMANN,L.G.MILROY REVDAT 1 17-APR-19 6G8I 0 JRNL AUTH V.THIJSSEN,S.A.ANDREI,L.BRUNSVELD,C.OTTMANN,L.G.MILROY JRNL TITL EFFECT OF SINGLE, SYNTHETIC ALPHA-TO-BETA3-AMINO ACID POINT JRNL TITL 2 MUTATIONS ON PHOSPHOPEPTIDE-PROTEIN BINDING JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 1.60 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.60 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 56.09 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.350 REMARK 3 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 3 NUMBER OF REFLECTIONS : 38473 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.151 REMARK 3 R VALUE (WORKING SET) : 0.150 REMARK 3 FREE R VALUE : 0.173 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.950 REMARK 3 FREE R VALUE TEST SET COUNT : 1905 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 56.1195 - 3.8559 1.00 2775 133 0.1601 0.1557 REMARK 3 2 3.8559 - 3.0606 1.00 2663 141 0.1344 0.1470 REMARK 3 3 3.0606 - 2.6737 1.00 2605 148 0.1388 0.1575 REMARK 3 4 2.6737 - 2.4292 1.00 2642 134 0.1289 0.1374 REMARK 3 5 2.4292 - 2.2551 1.00 2598 154 0.1198 0.1846 REMARK 3 6 2.2551 - 2.1222 1.00 2584 139 0.1329 0.1621 REMARK 3 7 2.1222 - 2.0159 1.00 2619 114 0.1384 0.1757 REMARK 3 8 2.0159 - 1.9281 1.00 2587 137 0.1472 0.2092 REMARK 3 9 1.9281 - 1.8539 1.00 2627 111 0.1617 0.1833 REMARK 3 10 1.8539 - 1.7899 1.00 2562 136 0.1770 0.1999 REMARK 3 11 1.7899 - 1.7339 1.00 2586 134 0.1876 0.2129 REMARK 3 12 1.7339 - 1.6844 1.00 2592 145 0.1993 0.2406 REMARK 3 13 1.6844 - 1.6400 1.00 2535 144 0.2092 0.2566 REMARK 3 14 1.6400 - 1.6000 1.00 2593 135 0.2361 0.2911 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.150 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 17.310 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 14.73 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 22.26 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : NULL NULL REMARK 3 ANGLE : NULL NULL REMARK 3 CHIRALITY : NULL NULL REMARK 3 PLANARITY : NULL NULL REMARK 3 DIHEDRAL : NULL NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 6G8I COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 09-APR-18. REMARK 100 THE DEPOSITION ID IS D_1200009492. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 18-JUL-16 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : PETRA III, DESY REMARK 200 BEAMLINE : P11 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.033200 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M-F REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : AIMLESS 0.5.31 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 38495 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.600 REMARK 200 RESOLUTION RANGE LOW (A) : 66.260 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 11.50 REMARK 200 R MERGE (I) : 0.16100 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 11.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.60 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.63 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 11.50 REMARK 200 R MERGE FOR SHELL (I) : 1.52600 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER 2.7.16 REMARK 200 STARTING MODEL: 3MHR REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 53.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.62 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.095 M HEPES PH 7.5, 26% PEG400, 0.19 REMARK 280 M CACL2, 5% GLYCEROL, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE REMARK 280 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 31.27500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 31.27500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 41.05900 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 56.08500 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 41.05900 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 56.08500 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 31.27500 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 41.05900 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 56.08500 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 31.27500 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 41.05900 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 56.08500 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5880 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 23410 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -101.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, P REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 2 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A 415 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 702 LIES ON A SPECIAL POSITION. REMARK 375 HOH A 763 LIES ON A SPECIAL POSITION. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 ACE P 123 REMARK 465 TSA P 124 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 HG SER A 0 O HOH A 412 1.56 REMARK 500 O HOH A 646 O HOH A 675 1.62 REMARK 500 O HOH A 412 O HOH A 507 1.65 REMARK 500 O HOH A 647 O HOH A 672 1.66 REMARK 500 O HOH A 630 O HOH A 665 1.82 REMARK 500 O HOH A 738 O HOH A 762 1.85 REMARK 500 O HOH A 463 O HOH A 464 1.91 REMARK 500 O HOH A 572 O HOH A 603 1.96 REMARK 500 O HOH A 463 O HOH A 571 1.96 REMARK 500 O HOH A 433 O HOH A 537 1.96 REMARK 500 O HOH A 718 O HOH A 732 2.01 REMARK 500 O HOH A 423 O HOH A 601 2.01 REMARK 500 O HOH A 405 O HOH A 432 2.02 REMARK 500 O HOH A 416 O HOH A 611 2.05 REMARK 500 O HOH A 692 O HOH A 754 2.05 REMARK 500 O HOH A 591 O HOH A 685 2.08 REMARK 500 O HOH A 455 O HOH A 541 2.08 REMARK 500 OG SER A 177 O HOH A 401 2.09 REMARK 500 OE2 GLU A 182 O HOH A 402 2.09 REMARK 500 O HOH A 571 O HOH A 608 2.10 REMARK 500 OE1 GLU A 182 O HOH A 403 2.10 REMARK 500 OD2 ASP A 211 O HOH A 404 2.11 REMARK 500 O HOH P 205 O HOH P 208 2.11 REMARK 500 O HOH A 695 O HOH A 708 2.12 REMARK 500 O HOH A 601 O HOH A 609 2.12 REMARK 500 OE1 GLU A 86 O HOH A 405 2.13 REMARK 500 O HOH A 655 O HOH A 745 2.14 REMARK 500 O HOH A 606 O HOH A 702 2.15 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O HOH A 688 O HOH A 706 6544 2.16 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ARG A 18 73.76 -102.90 REMARK 500 HIS A 106 35.83 -144.81 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 763 DISTANCE = 6.26 ANGSTROMS REMARK 525 HOH P 218 DISTANCE = 5.94 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA A 303 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LYS A 77 O REMARK 620 2 GLU A 80 OE1 74.8 REMARK 620 3 GLU A 80 OE2 122.9 49.5 REMARK 620 4 HOH A 491 O 109.1 82.1 57.9 REMARK 620 5 HOH A 598 O 77.4 131.6 128.2 70.7 REMARK 620 6 GLN A 8 OE1 101.9 46.2 50.3 107.6 177.7 REMARK 620 7 HOH A 657 O 158.6 126.5 78.4 79.2 87.4 93.9 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MG A 302 MG REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 161 O REMARK 620 2 HOH A 619 O 78.3 REMARK 620 3 HOH A 456 O 80.8 82.6 REMARK 620 4 GLU A 75 OE1 41.3 72.0 40.1 REMARK 620 5 HOH A 523 O 79.8 73.2 151.4 115.7 REMARK 620 6 HOH A 663 O 150.8 77.3 80.6 114.8 107.8 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA A 304 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 706 O REMARK 620 2 HOH A 528 O 55.6 REMARK 620 3 GLY A -1 O 65.6 59.6 REMARK 620 4 HOH A 559 O 103.7 146.2 88.3 REMARK 620 5 HOH A 491 O 130.0 81.8 117.0 125.8 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MG A 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 303 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 304 DBREF 6G8I A 1 231 UNP P31947 1433S_HUMAN 1 231 DBREF 6G8I P 123 133 PDB 6G8I 6G8I 123 133 SEQADV 6G8I GLY A -4 UNP P31947 EXPRESSION TAG SEQADV 6G8I ALA A -3 UNP P31947 EXPRESSION TAG SEQADV 6G8I MET A -2 UNP P31947 EXPRESSION TAG SEQADV 6G8I GLY A -1 UNP P31947 EXPRESSION TAG SEQADV 6G8I SER A 0 UNP P31947 EXPRESSION TAG SEQRES 1 A 236 GLY ALA MET GLY SER MET GLU ARG ALA SER LEU ILE GLN SEQRES 2 A 236 LYS ALA LYS LEU ALA GLU GLN ALA GLU ARG TYR GLU ASP SEQRES 3 A 236 MET ALA ALA PHE MET LYS GLY ALA VAL GLU LYS GLY GLU SEQRES 4 A 236 GLU LEU SER CYS GLU GLU ARG ASN LEU LEU SER VAL ALA SEQRES 5 A 236 TYR LYS ASN VAL VAL GLY GLY GLN ARG ALA ALA TRP ARG SEQRES 6 A 236 VAL LEU SER SER ILE GLU GLN LYS SER ASN GLU GLU GLY SEQRES 7 A 236 SER GLU GLU LYS GLY PRO GLU VAL ARG GLU TYR ARG GLU SEQRES 8 A 236 LYS VAL GLU THR GLU LEU GLN GLY VAL CYS ASP THR VAL SEQRES 9 A 236 LEU GLY LEU LEU ASP SER HIS LEU ILE LYS GLU ALA GLY SEQRES 10 A 236 ASP ALA GLU SER ARG VAL PHE TYR LEU LYS MET LYS GLY SEQRES 11 A 236 ASP TYR TYR ARG TYR LEU ALA GLU VAL ALA THR GLY ASP SEQRES 12 A 236 ASP LYS LYS ARG ILE ILE ASP SER ALA ARG SER ALA TYR SEQRES 13 A 236 GLN GLU ALA MET ASP ILE SER LYS LYS GLU MET PRO PRO SEQRES 14 A 236 THR ASN PRO ILE ARG LEU GLY LEU ALA LEU ASN PHE SER SEQRES 15 A 236 VAL PHE HIS TYR GLU ILE ALA ASN SER PRO GLU GLU ALA SEQRES 16 A 236 ILE SER LEU ALA LYS THR THR PHE ASP GLU ALA MET ALA SEQRES 17 A 236 ASP LEU HIS THR LEU SER GLU ASP SER TYR LYS ASP SER SEQRES 18 A 236 THR LEU ILE MET GLN LEU LEU ARG ASP ASN LEU THR LEU SEQRES 19 A 236 TRP THR SEQRES 1 P 11 ACE TSA ALA HIS SEP SER PRO ALA SER LEU GLN HET SEP P 127 13 HET CL A 301 1 HET MG A 302 1 HET NA A 303 1 HET NA A 304 1 HETNAM SEP PHOSPHOSERINE HETNAM CL CHLORIDE ION HETNAM MG MAGNESIUM ION HETNAM NA SODIUM ION HETSYN SEP PHOSPHONOSERINE FORMUL 2 SEP C3 H8 N O6 P FORMUL 3 CL CL 1- FORMUL 4 MG MG 2+ FORMUL 5 NA 2(NA 1+) FORMUL 7 HOH *381(H2 O) HELIX 1 AA1 GLU A 2 ALA A 16 1 15 HELIX 2 AA2 ARG A 18 LYS A 32 1 15 HELIX 3 AA3 SER A 37 ASN A 70 1 34 HELIX 4 AA4 PRO A 79 SER A 105 1 27 HELIX 5 AA5 HIS A 106 ALA A 111 1 6 HELIX 6 AA6 ASP A 113 ALA A 135 1 23 HELIX 7 AA7 ASP A 139 MET A 162 1 24 HELIX 8 AA8 ASN A 166 ILE A 183 1 18 HELIX 9 AA9 SER A 186 ALA A 203 1 18 HELIX 10 AB1 ASP A 204 LEU A 208 5 5 HELIX 11 AB2 SER A 209 THR A 231 1 23 LINK O LYS A 77 NA NA A 303 1555 1555 2.30 LINK OE1 GLU A 80 NA NA A 303 1555 1555 2.34 LINK OE2 GLU A 80 NA NA A 303 1555 1555 2.79 LINK O GLU A 161 MG MG A 302 1555 1555 2.29 LINK C AHIS P 126 N SEP P 127 1555 1555 1.33 LINK C BHIS P 126 N SEP P 127 1555 1555 1.33 LINK C SEP P 127 N SER P 128 1555 1555 1.32 LINK MG MG A 302 O HOH A 619 1555 1555 2.42 LINK MG MG A 302 O HOH A 456 1555 1555 2.51 LINK NA NA A 303 O HOH A 491 1555 1555 2.83 LINK NA NA A 303 O HOH A 598 1555 1555 2.38 LINK NA NA A 304 O HOH A 706 1555 1555 3.13 LINK NA NA A 304 O HOH A 528 1555 1555 2.14 LINK O GLY A -1 NA NA A 304 1555 3655 2.41 LINK OE1AGLN A 8 NA NA A 303 1555 4555 2.76 LINK OE1 GLU A 75 MG MG A 302 1555 7554 2.38 LINK MG MG A 302 O HOH A 523 1555 7544 2.40 LINK MG MG A 302 O HOH A 663 1555 6545 2.35 LINK NA NA A 303 O HOH A 657 1555 4555 2.58 LINK NA NA A 304 O HOH A 559 1555 3655 2.24 LINK NA NA A 304 O HOH A 491 1555 4555 3.09 CISPEP 1 SER A 105 HIS A 106 0 8.65 SITE *** AC1 4 LYS A 9 LYS A 87 HOH A 709 HOH A 735 SITE *** AC2 6 GLU A 75 GLU A 161 HOH A 456 HOH A 523 SITE *** AC2 6 HOH A 619 HOH A 663 SITE *** AC3 6 GLN A 8 LYS A 77 GLU A 80 HOH A 491 SITE *** AC3 6 HOH A 598 HOH A 657 SITE *** AC4 4 GLY A -1 HOH A 491 HOH A 528 HOH A 559 CRYST1 82.118 112.170 62.550 90.00 90.00 90.00 C 2 2 21 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.012178 0.000000 0.000000 0.00000 SCALE2 0.000000 0.008915 0.000000 0.00000 SCALE3 0.000000 0.000000 0.015987 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: P 127 SEP H2 : P 127 SEP N : P 126 HIS C B:(H bumps) USER MOD NoAdj-H: P 127 SEP H : P 127 SEP N : P 126 HIS C B:(H bumps) USER MOD Set 1.1: A 122 LYS NZ :NH3+ -159:sc= 1.12 (180deg=0.4) USER MOD Set 1.2: A 175 ASN : amide:sc= 1.48 K(o=4.1,f=-3.3!) USER MOD Set 1.3: P 128 SER OG A: rot 81:sc= 1.48 USER MOD Set 2.1: A 209 SER OG A: rot -109:sc= 0.0434 USER MOD Set 2.2: A 212 SER OG : rot 78:sc= 0.339 USER MOD Set 3.1: A 162 MET CE B:methyl -179:sc= -1.28 (180deg=-0.242) USER MOD Set 3.2: A 166 ASN : amide:sc= -0.894 K(o=-2.2,f=-11!) USER MOD Set 4.1: A 106 HIS : no HD1:sc= -0.257 K(o=1,f=-9.4!) USER MOD Set 4.2: A 109 LYS NZ :NH3+ 174:sc= 1.28 (180deg=-0.0518) USER MOD Set 5.1: A 64 SER OG A: rot -155:sc= 0.544 USER MOD Set 5.2: A 68 LYS NZ :NH3+ 168:sc= 0.741 (180deg=1.26) USER MOD Set 6.1: A 1 MET CE :methyl -167:sc= -0.0566 (180deg=-0.37) USER MOD Set 6.2: A 9 LYS NZ :NH3+ 180:sc= 1.28 (180deg=1.28) USER MOD Single : A 0 SER OG : rot -93:sc= 2.69 USER MOD Single : A 5 SER OG : rot 4:sc= 0.618 USER MOD Single : A 8 GLN A: amide:sc= 0.818 K(o=0.82,f=0.027) USER MOD Single : A 8 GLN B: amide:sc= -0.318 X(o=-0.32,f=0) USER MOD Single : A -2 MET CE :methyl -171:sc= -0.0128 (180deg=-0.0431) USER MOD Single : A -4 GLY N :NH3+ 132:sc= 0.0344 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -176:sc= 0.814 (180deg=0.806) USER MOD Single : A 15 GLN : amide:sc= 1.05 K(o=1.1,f=-2!) USER MOD Single : A 19 TYR OH : rot 180:sc= 0.377 USER MOD Single : A 22 MET CE :methyl 179:sc= -0.173 (180deg=-0.178) USER MOD Single : A 26 MET CE :methyl -167:sc= -0.0151 (180deg=-0.259) USER MOD Single : A 27 LYS NZ :NH3+ -129:sc= 1.82 (180deg=0.522) USER MOD Single : A 32 LYS NZ :NH3+ -131:sc= 1.41 (180deg=0.0525) USER MOD Single : A 37 SER OG : rot 169:sc= 0.966 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= 0.267 K(o=0.27,f=-3.1!) USER MOD Single : A 45 SER OG : rot 173:sc= 2.12 USER MOD Single : A 48 TYR OH : rot -36:sc= 0.944 USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0.992 (180deg=0.866) USER MOD Single : A 50 ASN : amide:sc= 1.93 K(o=1.9,f=1.3) USER MOD Single : A 55 GLN : amide:sc= -0.848 K(o=-0.85,f=-3.4!) USER MOD Single : A 63 SER OG A: rot 158:sc= 1.15 USER MOD Single : A 63 SER OG B: rot 177:sc= 1.26 USER MOD Single : A 64 SER OG B: rot 88:sc= 1.01 USER MOD Single : A 67 GLN : amide:sc= -0.21 X(o=-0.21,f=-0.21) USER MOD Single : A 69 SER OG : rot -71:sc= 2.33 USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 74 SER OG : rot -171:sc= 0.757 USER MOD Single : A 77 LYS NZ :NH3+ 163:sc= 0.374 (180deg=0.0602) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 148:sc= 0.313 (180deg=0.0345) USER MOD Single : A 90 THR OG1 : rot 80:sc= 0.988 USER MOD Single : A 93 GLN : amide:sc= 1.36 K(o=1.4,f=-0.023) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 82:sc= 0.65 USER MOD Single : A 105 SER OG : rot -83:sc= 2.35 USER MOD Single : A 116 SER OG : rot 180:sc=-0.00435 USER MOD Single : A 120 TYR OH : rot -170:sc= 1.13 USER MOD Single : A 123 MET CE A:methyl 164:sc= -0.0235 (180deg=-0.154) USER MOD Single : A 123 MET CE B:methyl -159:sc= -1.53 (180deg=-2.3) USER MOD Single : A 124 LYS NZ :NH3+ 174:sc= 0.454 (180deg=0.435) USER MOD Single : A 127 TYR OH : rot -147:sc= 1.05 USER MOD Single : A 128 TYR OH : rot 30:sc= 1.33 USER MOD Single : A 130 TYR OH : rot 15:sc= 1.98 USER MOD Single : A 136 THR OG1 : rot -139:sc= 0.253 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 151:sc= 1.27 (180deg=1) USER MOD Single : A 146 SER OG : rot 69:sc= 0.82 USER MOD Single : A 149 SER OG : rot 68:sc= 0.0113 USER MOD Single : A 151 TYR OH : rot -12:sc= 1.64 USER MOD Single : A 152 GLN : amide:sc= 0.457 X(o=0.46,f=0.67) USER MOD Single : A 155 MET CE A:methyl -176:sc= -0.429 (180deg=-0.503) USER MOD Single : A 155 MET CE B:methyl 165:sc= -0.0493 (180deg=-0.233) USER MOD Single : A 158 SER OG : rot -33:sc= 0.595 USER MOD Single : A 159 LYS NZ :NH3+ -164:sc= 0.473 (180deg=0.34) USER MOD Single : A 160 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 MET CE A:methyl 150:sc= -0.674 (180deg=-0.814) USER MOD Single : A 165 THR OG1 : rot -100:sc= 2.1 USER MOD Single : A 177 SER OG A: rot -58:sc= 0.196! USER MOD Single : A 177 SER OG B: rot 93:sc= 1.38 USER MOD Single : A 180 HIS : no HE2:sc= 1.94 K(o=1.9,f=-2.7!) USER MOD Single : A 181 TYR OH : rot 30:sc= 1.13 USER MOD Single : A 185 ASN : amide:sc= -0.277 X(o=-0.28,f=-0.69) USER MOD Single : A 186 SER OG : rot -90:sc= 2.19 USER MOD Single : A 192 SER OG A: rot 86:sc= 1.4 USER MOD Single : A 192 SER OG B: rot -97:sc= 0.689 USER MOD Single : A 195 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 195 LYS NZ B:NH3+ -134:sc= 0.207 (180deg=-0.429) USER MOD Single : A 196 THR OG1A: rot 151:sc= 1.87 USER MOD Single : A 196 THR OG1B: rot -77:sc= 0.468 USER MOD Single : A 197 THR OG1 : rot 83:sc= 2.2 USER MOD Single : A 202 MET CE A:methyl 166:sc= 0 (180deg=-0.125) USER MOD Single : A 202 MET CE B:methyl -124:sc= 0 (180deg=-0.0628) USER MOD Single : A 206 HIS : no HD1:sc= -0.0239 X(o=-0.024,f=0) USER MOD Single : A 207 THR OG1 : rot -69:sc= 1.03 USER MOD Single : A 209 SER OG B: rot -143:sc= 1.58 USER MOD Single : A 213 TYR OH : rot 180:sc= 0 USER MOD Single : A 214 LYS NZ A:NH3+ -165:sc= -0.0268 (180deg=-0.18) USER MOD Single : A 214 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 SER OG : rot -87:sc= 2.27 USER MOD Single : A 217 THR OG1 : rot -75:sc= 1.61 USER MOD Single : A 220 MET CE :methyl 155:sc= -1.4 (180deg=-2.46) USER MOD Single : A 221 GLN : amide:sc= 0.289 X(o=0.29,f=-0.083) USER MOD Single : A 226 ASN : amide:sc= 1.53 K(o=1.5,f=-6.1!) USER MOD Single : A 228 THR OG1 : rot 76:sc= 0.222 USER MOD Single : A 231 THR OG1 : rot -83:sc= 1.3 USER MOD Single : P 126 HIS A: no HD1:sc= -0.041 X(o=-0.041,f=-0.0097) USER MOD Single : P 126 HIS B: no HD1:sc= 0 X(o=0,f=0) USER MOD Single : P 128 SER OG B: rot -74:sc= 0.361 USER MOD Single : P 131 SER OG : rot 180:sc= 0 USER MOD Single : P 133 GLN : amide:sc= 0.305 K(o=0.3,f=-5.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 45.403 -12.570 4.106 1.00 51.66 N ATOM 2 CA GLY A -4 44.057 -11.937 4.149 1.00 38.48 C ATOM 3 C GLY A -4 43.846 -11.188 5.436 1.00 32.13 C ATOM 4 O GLY A -4 44.351 -11.622 6.486 1.00 26.69 O ATOM 0 H1 GLY A -4 45.324 -13.419 3.850 1.00 51.66 H new ATOM 0 H2 GLY A -4 45.919 -12.132 3.528 1.00 51.66 H new ATOM 0 H3 GLY A -4 45.772 -12.538 4.915 1.00 51.66 H new ATOM 0 HA2 GLY A -4 43.959 -11.330 3.399 1.00 38.48 H new ATOM 0 HA3 GLY A -4 43.374 -12.619 4.053 1.00 38.48 H new ATOM 10 N ALA A -3 43.092 -10.081 5.365 1.00 27.94 N ATOM 11 CA ALA A -3 42.890 -9.233 6.532 1.00 28.75 C ATOM 12 C ALA A -3 42.119 -9.939 7.634 1.00 19.68 C ATOM 13 O ALA A -3 42.120 -9.461 8.776 1.00 31.42 O ATOM 14 CB ALA A -3 42.154 -7.958 6.131 1.00 33.74 C ATOM 0 H ALA A -3 42.694 -9.811 4.652 1.00 27.94 H new ATOM 0 HA ALA A -3 43.768 -9.015 6.881 1.00 28.75 H new ATOM 0 HB1 ALA A -3 42.024 -7.400 6.913 1.00 33.74 H new ATOM 0 HB2 ALA A -3 42.678 -7.475 5.473 1.00 33.74 H new ATOM 0 HB3 ALA A -3 41.292 -8.188 5.751 1.00 33.74 H new ATOM 20 N MET A -2 41.459 -11.058 7.329 1.00 20.40 N ATOM 21 CA MET A -2 40.725 -11.823 8.333 1.00 19.70 C ATOM 22 C MET A -2 41.517 -12.999 8.885 1.00 15.49 C ATOM 23 O MET A -2 40.981 -13.789 9.694 1.00 15.68 O ATOM 24 CB MET A -2 39.409 -12.347 7.734 1.00 20.94 C ATOM 25 CG MET A -2 38.506 -11.238 7.239 1.00 17.14 C ATOM 26 SD MET A -2 38.026 -10.090 8.521 1.00 20.45 S ATOM 27 CE MET A -2 37.064 -8.897 7.577 1.00 29.13 C ATOM 0 H MET A -2 41.425 -11.392 6.537 1.00 20.40 H new ATOM 0 HA MET A -2 40.552 -11.215 9.069 1.00 19.70 H new ATOM 0 HB2 MET A -2 39.610 -12.947 6.999 1.00 20.94 H new ATOM 0 HB3 MET A -2 38.938 -12.867 8.404 1.00 20.94 H new ATOM 0 HG2 MET A -2 38.959 -10.752 6.532 1.00 17.14 H new ATOM 0 HG3 MET A -2 37.709 -11.629 6.849 1.00 17.14 H new ATOM 0 HE1 MET A -2 36.857 -8.132 8.137 1.00 29.13 H new ATOM 0 HE2 MET A -2 37.576 -8.604 6.807 1.00 29.13 H new ATOM 0 HE3 MET A -2 36.239 -9.310 7.278 1.00 29.13 H new ATOM 37 N GLY A -1 42.778 -13.132 8.482 1.00 14.89 N ATOM 38 CA GLY A -1 43.576 -14.263 8.883 1.00 16.80 C ATOM 39 C GLY A -1 43.803 -14.376 10.366 1.00 16.68 C ATOM 40 O GLY A -1 44.005 -15.501 10.856 1.00 15.66 O ATOM 0 H GLY A -1 43.184 -12.570 7.973 1.00 14.89 H new ATOM 0 HA2 GLY A -1 43.146 -15.074 8.571 1.00 16.80 H new ATOM 0 HA3 GLY A -1 44.437 -14.210 8.439 1.00 16.80 H new ATOM 44 N SER A 0 43.740 -13.265 11.095 1.00 12.92 N ATOM 45 CA SER A 0 43.965 -13.295 12.527 1.00 9.75 C ATOM 46 C SER A 0 42.697 -13.504 13.342 1.00 12.20 C ATOM 47 O SER A 0 42.783 -13.631 14.573 1.00 14.92 O ATOM 48 CB SER A 0 44.677 -12.006 12.974 1.00 14.03 C ATOM 49 OG SER A 0 43.829 -10.888 12.774 1.00 22.51 O ATOM 0 H SER A 0 43.568 -12.486 10.775 1.00 12.92 H new ATOM 0 HA SER A 0 44.527 -14.066 12.700 1.00 9.75 H new ATOM 0 HB2 SER A 0 44.923 -12.071 13.910 1.00 14.03 H new ATOM 0 HB3 SER A 0 45.499 -11.891 12.472 1.00 14.03 H new ATOM 0 HG SER A 0 43.979 -10.554 12.018 1.00 22.51 H new ATOM 55 N MET A 1 41.520 -13.579 12.714 1.00 12.05 N ATOM 56 CA MET A 1 40.280 -13.680 13.449 1.00 9.83 C ATOM 57 C MET A 1 39.800 -15.127 13.483 1.00 11.72 C ATOM 58 O MET A 1 39.940 -15.857 12.503 1.00 12.82 O ATOM 59 CB MET A 1 39.180 -12.795 12.846 1.00 13.61 C ATOM 60 CG MET A 1 38.138 -12.403 13.858 1.00 17.25 C ATOM 61 SD MET A 1 36.660 -11.550 13.223 1.00 18.05 S ATOM 62 CE MET A 1 37.469 -10.176 12.380 1.00 21.23 C ATOM 0 H MET A 1 41.429 -13.572 11.859 1.00 12.05 H new ATOM 0 HA MET A 1 40.458 -13.370 14.351 1.00 9.83 H new ATOM 0 HB2 MET A 1 39.581 -11.995 12.472 1.00 13.61 H new ATOM 0 HB3 MET A 1 38.754 -13.267 12.114 1.00 13.61 H new ATOM 0 HG2 MET A 1 37.849 -13.205 14.321 1.00 17.25 H new ATOM 0 HG3 MET A 1 38.558 -11.830 14.518 1.00 17.25 H new ATOM 0 HE1 MET A 1 36.809 -9.502 12.152 1.00 21.23 H new ATOM 0 HE2 MET A 1 38.139 -9.788 12.964 1.00 21.23 H new ATOM 0 HE3 MET A 1 37.894 -10.498 11.570 1.00 21.23 H new ATOM 72 N GLU A 2 39.310 -15.545 14.641 1.00 11.44 N ATOM 73 CA GLU A 2 38.770 -16.898 14.797 1.00 13.99 C ATOM 74 C GLU A 2 37.643 -17.183 13.805 1.00 11.10 C ATOM 75 O GLU A 2 36.773 -16.336 13.549 1.00 11.02 O ATOM 76 CB GLU A 2 38.204 -17.101 16.192 1.00 13.54 C ATOM 77 CG GLU A 2 39.231 -17.173 17.308 1.00 14.80 C ATOM 78 CD GLU A 2 39.838 -18.502 17.459 1.00 20.97 C ATOM 79 OE1 GLU A 2 39.693 -19.342 16.547 1.00 21.38 O ATOM 80 OE2 GLU A 2 40.445 -18.754 18.535 1.00 19.76 O ATOM 0 H GLU A 2 39.279 -15.064 15.353 1.00 11.44 H new ATOM 0 HA GLU A 2 39.512 -17.502 14.634 1.00 13.99 H new ATOM 0 HB2 GLU A 2 37.590 -16.375 16.384 1.00 13.54 H new ATOM 0 HB3 GLU A 2 37.685 -17.920 16.198 1.00 13.54 H new ATOM 0 HG2 GLU A 2 39.930 -16.523 17.137 1.00 14.80 H new ATOM 0 HG3 GLU A 2 38.808 -16.921 18.144 1.00 14.80 H new ATOM 87 N ARG A 3 37.595 -18.428 13.311 1.00 12.37 N ATOM 88 CA ARG A 3 36.498 -18.810 12.422 1.00 11.11 C ATOM 89 C ARG A 3 35.141 -18.509 13.038 1.00 10.49 C ATOM 90 O ARG A 3 34.259 -17.958 12.375 1.00 11.14 O ATOM 91 CB ARG A 3 36.610 -20.305 12.081 1.00 12.23 C ATOM 92 CG ARG A 3 35.654 -20.776 11.047 1.00 12.38 C ATOM 93 CD ARG A 3 35.802 -22.299 10.871 1.00 15.73 C ATOM 94 NE ARG A 3 35.058 -22.761 9.723 1.00 13.69 N ATOM 95 CZ ARG A 3 33.745 -22.961 9.682 1.00 15.11 C ATOM 96 NH1 ARG A 3 33.000 -22.777 10.737 1.00 16.16 N ATOM 97 NH2 ARG A 3 33.170 -23.382 8.540 1.00 16.10 N ATOM 0 H ARG A 3 38.170 -19.046 13.474 1.00 12.37 H new ATOM 0 HA ARG A 3 36.570 -18.284 11.610 1.00 11.11 H new ATOM 0 HB2 ARG A 3 37.513 -20.489 11.778 1.00 12.23 H new ATOM 0 HB3 ARG A 3 36.472 -20.821 12.891 1.00 12.23 H new ATOM 0 HG2 ARG A 3 34.746 -20.557 11.308 1.00 12.38 H new ATOM 0 HG3 ARG A 3 35.824 -20.325 10.205 1.00 12.38 H new ATOM 0 HD2 ARG A 3 36.739 -22.526 10.766 1.00 15.73 H new ATOM 0 HD3 ARG A 3 35.487 -22.752 11.669 1.00 15.73 H new ATOM 0 HE ARG A 3 35.503 -22.920 9.004 1.00 13.69 H new ATOM 0 HH11 ARG A 3 33.357 -22.522 11.476 1.00 16.16 H new ATOM 0 HH12 ARG A 3 32.152 -22.911 10.693 1.00 16.16 H new ATOM 0 HH21 ARG A 3 33.652 -23.520 7.841 1.00 16.10 H new ATOM 0 HH22 ARG A 3 32.321 -23.513 8.509 1.00 16.10 H new ATOM 111 N ALA A 4 34.942 -18.880 14.309 1.00 10.57 N ATOM 112 CA ALA A 4 33.634 -18.674 14.931 1.00 9.01 C ATOM 113 C ALA A 4 33.304 -17.199 15.049 1.00 10.63 C ATOM 114 O ALA A 4 32.139 -16.836 14.914 1.00 11.78 O ATOM 115 CB ALA A 4 33.576 -19.337 16.297 1.00 12.53 C ATOM 0 H ALA A 4 35.536 -19.243 14.814 1.00 10.57 H new ATOM 0 HA ALA A 4 32.970 -19.086 14.357 1.00 9.01 H new ATOM 0 HB1 ALA A 4 32.702 -19.189 16.692 1.00 12.53 H new ATOM 0 HB2 ALA A 4 33.730 -20.290 16.201 1.00 12.53 H new ATOM 0 HB3 ALA A 4 34.259 -18.956 16.871 1.00 12.53 H new ATOM 121 N SER A 5 34.306 -16.356 15.301 1.00 11.68 N ATOM 122 CA SER A 5 34.090 -14.913 15.377 1.00 11.33 C ATOM 123 C SER A 5 33.706 -14.331 14.029 1.00 11.45 C ATOM 124 O SER A 5 32.869 -13.423 13.960 1.00 11.58 O ATOM 125 CB SER A 5 35.357 -14.239 15.896 1.00 12.82 C ATOM 126 OG SER A 5 35.655 -14.701 17.215 1.00 14.29 O ATOM 0 H SER A 5 35.120 -16.602 15.431 1.00 11.68 H new ATOM 0 HA SER A 5 33.354 -14.748 15.986 1.00 11.33 H new ATOM 0 HB2 SER A 5 36.100 -14.431 15.303 1.00 12.82 H new ATOM 0 HB3 SER A 5 35.240 -13.276 15.902 1.00 12.82 H new ATOM 0 HG SER A 5 35.105 -15.297 17.434 1.00 14.29 H new ATOM 132 N LEU A 6 34.326 -14.830 12.948 1.00 11.61 N ATOM 133 CA LEU A 6 33.964 -14.401 11.603 1.00 12.84 C ATOM 134 C LEU A 6 32.508 -14.725 11.303 1.00 9.96 C ATOM 135 O LEU A 6 31.775 -13.883 10.759 1.00 10.62 O ATOM 136 CB LEU A 6 34.895 -15.041 10.566 1.00 11.00 C ATOM 137 CG LEU A 6 36.350 -14.543 10.661 1.00 11.54 C ATOM 138 CD1 LEU A 6 37.255 -15.499 9.919 1.00 12.50 C ATOM 139 CD2 LEU A 6 36.442 -13.115 10.051 1.00 11.75 C ATOM 0 H LEU A 6 34.955 -15.415 12.980 1.00 11.61 H new ATOM 0 HA LEU A 6 34.070 -13.438 11.551 1.00 12.84 H new ATOM 0 HB2 LEU A 6 34.882 -16.004 10.680 1.00 11.00 H new ATOM 0 HB3 LEU A 6 34.554 -14.856 9.677 1.00 11.00 H new ATOM 0 HG LEU A 6 36.631 -14.506 11.589 1.00 11.54 H new ATOM 0 HD11 LEU A 6 38.172 -15.188 9.977 1.00 12.50 H new ATOM 0 HD12 LEU A 6 37.188 -16.382 10.315 1.00 12.50 H new ATOM 0 HD13 LEU A 6 36.987 -15.542 8.988 1.00 12.50 H new ATOM 0 HD21 LEU A 6 37.356 -12.797 10.108 1.00 11.75 H new ATOM 0 HD22 LEU A 6 36.167 -13.142 9.121 1.00 11.75 H new ATOM 0 HD23 LEU A 6 35.860 -12.515 10.543 1.00 11.75 H new ATOM 151 N ILE A 7 32.055 -15.916 11.686 1.00 10.84 N ATOM 152 CA AILE A 7 30.674 -16.305 11.437 0.60 9.97 C ATOM 153 CA BILE A 7 30.673 -16.285 11.419 0.40 10.06 C ATOM 154 C ILE A 7 29.726 -15.453 12.268 1.00 9.13 C ATOM 155 O ILE A 7 28.698 -14.990 11.777 1.00 10.45 O ATOM 156 CB AILE A 7 30.491 -17.810 11.717 0.60 12.78 C ATOM 157 CB BILE A 7 30.482 -17.799 11.626 0.40 12.68 C ATOM 158 CG1AILE A 7 31.387 -18.677 10.807 0.60 14.41 C ATOM 159 CG1BILE A 7 31.240 -18.562 10.526 0.40 16.35 C ATOM 160 CG2AILE A 7 29.020 -18.193 11.552 0.60 14.02 C ATOM 161 CG2BILE A 7 29.007 -18.152 11.616 0.40 14.06 C ATOM 162 CD1AILE A 7 31.069 -18.567 9.334 0.60 9.93 C ATOM 163 CD1BILE A 7 31.543 -19.968 10.837 0.40 12.31 C ATOM 0 H AILE A 7 32.530 -16.509 12.089 0.60 10.84 H new ATOM 0 H BILE A 7 32.522 -16.512 12.093 0.40 10.84 H new ATOM 0 HA AILE A 7 30.459 -16.150 10.504 0.60 10.06 H new ATOM 0 HA BILE A 7 30.459 -16.093 10.493 0.40 10.06 H new ATOM 0 HB AILE A 7 30.765 -17.981 12.632 0.60 12.68 H new ATOM 0 HB BILE A 7 30.841 -18.056 12.490 0.40 12.68 H new ATOM 0 HG12AILE A 7 32.313 -18.424 10.947 0.60 16.35 H new ATOM 0 HG12BILE A 7 30.716 -18.531 9.711 0.40 16.35 H new ATOM 0 HG13AILE A 7 31.302 -19.605 11.077 0.60 16.35 H new ATOM 0 HG13BILE A 7 32.073 -18.098 10.345 0.40 16.35 H new ATOM 0 HG21AILE A 7 28.910 -19.140 11.729 0.60 14.06 H new ATOM 0 HG21BILE A 7 28.902 -19.107 11.747 0.40 14.06 H new ATOM 0 HG22AILE A 7 28.481 -17.683 12.176 0.60 14.06 H new ATOM 0 HG22BILE A 7 28.555 -17.676 12.331 0.40 14.06 H new ATOM 0 HG23AILE A 7 28.735 -17.999 10.645 0.60 14.06 H new ATOM 0 HG23BILE A 7 28.619 -17.899 10.764 0.40 14.06 H new ATOM 0 HD11AILE A 7 31.670 -19.137 8.830 0.60 12.31 H new ATOM 0 HD11BILE A 7 32.019 -20.369 10.093 0.40 12.31 H new ATOM 0 HD12AILE A 7 30.153 -18.846 9.179 0.60 12.31 H new ATOM 0 HD12BILE A 7 32.094 -20.012 11.634 0.40 12.31 H new ATOM 0 HD13AILE A 7 31.179 -17.647 9.047 0.60 12.31 H new ATOM 0 HD13BILE A 7 30.716 -20.451 10.989 0.40 12.31 H new ATOM 186 N GLN A 8 30.072 -15.215 13.546 1.00 9.66 N ATOM 187 CA AGLN A 8 29.251 -14.352 14.399 0.73 11.41 C ATOM 188 CA BGLN A 8 29.238 -14.356 14.385 0.27 11.55 C ATOM 189 C GLN A 8 29.125 -12.946 13.809 1.00 9.77 C ATOM 190 O GLN A 8 28.020 -12.390 13.731 1.00 12.23 O ATOM 191 CB AGLN A 8 29.837 -14.319 15.806 0.73 13.46 C ATOM 192 CB BGLN A 8 29.787 -14.309 15.806 0.27 13.37 C ATOM 193 CG AGLN A 8 29.031 -13.531 16.780 0.73 14.48 C ATOM 194 CG BGLN A 8 29.543 -15.565 16.603 0.27 9.70 C ATOM 195 CD AGLN A 8 29.658 -13.463 18.167 0.73 22.04 C ATOM 196 CD BGLN A 8 29.854 -15.391 18.072 0.27 18.54 C ATOM 197 OE1AGLN A 8 30.666 -14.108 18.435 0.73 22.26 O ATOM 198 OE1BGLN A 8 29.131 -15.896 18.936 0.27 42.37 O ATOM 199 NE2AGLN A 8 29.064 -12.683 19.046 0.73 16.47 N ATOM 200 NE2BGLN A 8 30.934 -14.687 18.367 0.27 11.60 N ATOM 0 H AGLN A 8 30.770 -15.541 13.929 0.73 9.66 H new ATOM 0 H BGLN A 8 30.770 -15.536 13.932 0.27 9.66 H new ATOM 0 HA AGLN A 8 28.354 -14.718 14.446 0.73 11.55 H new ATOM 0 HA BGLN A 8 28.346 -14.737 14.404 0.27 11.55 H new ATOM 0 HB2AGLN A 8 29.923 -15.229 16.132 0.73 13.37 H new ATOM 0 HB2BGLN A 8 30.742 -14.142 15.768 0.27 13.37 H new ATOM 0 HB3AGLN A 8 30.732 -13.947 15.765 0.73 13.37 H new ATOM 0 HB3BGLN A 8 29.386 -13.559 16.272 0.27 13.37 H new ATOM 0 HG2AGLN A 8 28.915 -12.630 16.440 0.73 9.70 H new ATOM 0 HG2BGLN A 8 28.616 -15.833 16.502 0.27 9.70 H new ATOM 0 HG3AGLN A 8 28.147 -13.923 16.851 0.73 9.70 H new ATOM 0 HG3BGLN A 8 30.087 -16.283 16.243 0.27 9.70 H new ATOM 0 HE21AGLN A 8 28.358 -12.245 18.824 0.73 11.60 H new ATOM 0 HE21BGLN A 8 31.413 -14.350 17.737 0.27 11.60 H new ATOM 0 HE22AGLN A 8 29.382 -12.612 19.842 0.73 11.60 H new ATOM 0 HE22BGLN A 8 31.157 -14.566 19.189 0.27 11.60 H new ATOM 217 N LYS A 9 30.238 -12.373 13.359 1.00 11.21 N ATOM 218 CA LYS A 9 30.208 -11.037 12.769 1.00 8.61 C ATOM 219 C LYS A 9 29.486 -11.018 11.427 1.00 10.81 C ATOM 220 O LYS A 9 28.848 -10.022 11.086 1.00 11.43 O ATOM 221 CB LYS A 9 31.632 -10.512 12.671 1.00 12.35 C ATOM 222 CG LYS A 9 32.233 -10.240 14.053 1.00 9.84 C ATOM 223 CD LYS A 9 33.607 -9.633 13.970 1.00 10.85 C ATOM 224 CE LYS A 9 34.229 -9.411 15.353 1.00 14.43 C ATOM 225 NZ LYS A 9 35.611 -8.957 15.247 1.00 15.07 N ATOM 0 H LYS A 9 31.016 -12.738 13.385 1.00 11.21 H new ATOM 0 HA LYS A 9 29.696 -10.446 13.343 1.00 8.61 H new ATOM 0 HB2 LYS A 9 32.183 -11.156 12.200 1.00 12.35 H new ATOM 0 HB3 LYS A 9 31.641 -9.695 12.148 1.00 12.35 H new ATOM 0 HG2 LYS A 9 31.648 -9.644 14.546 1.00 9.84 H new ATOM 0 HG3 LYS A 9 32.278 -11.070 14.553 1.00 9.84 H new ATOM 0 HD2 LYS A 9 34.183 -10.213 13.448 1.00 10.85 H new ATOM 0 HD3 LYS A 9 33.556 -8.786 13.501 1.00 10.85 H new ATOM 0 HE2 LYS A 9 33.708 -8.756 15.843 1.00 14.43 H new ATOM 0 HE3 LYS A 9 34.196 -10.237 15.861 1.00 14.43 H new ATOM 0 HZ1 LYS A 9 35.947 -8.836 16.062 1.00 15.07 H new ATOM 0 HZ2 LYS A 9 36.092 -9.569 14.816 1.00 15.07 H new ATOM 0 HZ3 LYS A 9 35.638 -8.189 14.799 1.00 15.07 H new ATOM 239 N ALA A 10 29.567 -12.100 10.647 1.00 9.64 N ATOM 240 CA ALA A 10 28.804 -12.153 9.406 1.00 7.92 C ATOM 241 C ALA A 10 27.324 -12.022 9.720 1.00 10.07 C ATOM 242 O ALA A 10 26.594 -11.306 9.036 1.00 12.04 O ATOM 243 CB ALA A 10 29.105 -13.473 8.678 1.00 10.47 C ATOM 0 H ALA A 10 30.046 -12.794 10.815 1.00 9.64 H new ATOM 0 HA ALA A 10 29.058 -11.420 8.824 1.00 7.92 H new ATOM 0 HB1 ALA A 10 28.598 -13.510 7.852 1.00 10.47 H new ATOM 0 HB2 ALA A 10 30.053 -13.524 8.478 1.00 10.47 H new ATOM 0 HB3 ALA A 10 28.854 -14.220 9.244 1.00 10.47 H new ATOM 249 N LYS A 11 26.855 -12.704 10.779 1.00 10.79 N ATOM 250 CA LYS A 11 25.445 -12.600 11.140 1.00 11.56 C ATOM 251 C LYS A 11 25.100 -11.198 11.630 1.00 9.36 C ATOM 252 O LYS A 11 23.996 -10.703 11.374 1.00 14.09 O ATOM 253 CB LYS A 11 25.107 -13.670 12.183 1.00 12.27 C ATOM 254 CG LYS A 11 25.176 -15.100 11.673 1.00 12.74 C ATOM 255 CD LYS A 11 25.042 -16.063 12.836 1.00 17.16 C ATOM 256 CE LYS A 11 25.157 -17.504 12.334 1.00 23.28 C ATOM 257 NZ LYS A 11 25.190 -18.487 13.457 1.00 30.45 N ATOM 0 H LYS A 11 27.327 -13.216 11.283 1.00 10.79 H new ATOM 0 HA LYS A 11 24.902 -12.757 10.351 1.00 11.56 H new ATOM 0 HB2 LYS A 11 25.716 -13.577 12.932 1.00 12.27 H new ATOM 0 HB3 LYS A 11 24.213 -13.503 12.521 1.00 12.27 H new ATOM 0 HG2 LYS A 11 24.469 -15.257 11.028 1.00 12.74 H new ATOM 0 HG3 LYS A 11 26.017 -15.249 11.213 1.00 12.74 H new ATOM 0 HD2 LYS A 11 25.732 -15.885 13.495 1.00 17.16 H new ATOM 0 HD3 LYS A 11 24.188 -15.933 13.277 1.00 17.16 H new ATOM 0 HE2 LYS A 11 24.407 -17.704 11.752 1.00 23.28 H new ATOM 0 HE3 LYS A 11 25.962 -17.596 11.801 1.00 23.28 H new ATOM 0 HZ1 LYS A 11 25.315 -19.306 13.132 1.00 30.45 H new ATOM 0 HZ2 LYS A 11 25.856 -18.283 14.011 1.00 30.45 H new ATOM 0 HZ3 LYS A 11 24.418 -18.459 13.899 1.00 30.45 H new ATOM 271 N LEU A 12 26.007 -10.555 12.359 1.00 11.80 N ATOM 272 CA LEU A 12 25.766 -9.172 12.791 1.00 12.27 C ATOM 273 C LEU A 12 25.698 -8.244 11.585 1.00 11.06 C ATOM 274 O LEU A 12 24.813 -7.383 11.489 1.00 11.90 O ATOM 275 CB LEU A 12 26.868 -8.714 13.737 1.00 12.17 C ATOM 276 CG LEU A 12 26.919 -9.397 15.113 1.00 12.42 C ATOM 277 CD1 LEU A 12 28.182 -9.006 15.826 1.00 14.70 C ATOM 278 CD2 LEU A 12 25.672 -9.089 15.906 1.00 17.28 C ATOM 0 H LEU A 12 26.757 -10.890 12.613 1.00 11.80 H new ATOM 0 HA LEU A 12 24.917 -9.140 13.259 1.00 12.27 H new ATOM 0 HB2 LEU A 12 27.722 -8.852 13.298 1.00 12.17 H new ATOM 0 HB3 LEU A 12 26.771 -7.759 13.876 1.00 12.17 H new ATOM 0 HG LEU A 12 26.939 -10.360 15.002 1.00 12.42 H new ATOM 0 HD11 LEU A 12 28.211 -9.439 16.694 1.00 14.70 H new ATOM 0 HD12 LEU A 12 28.949 -9.283 15.301 1.00 14.70 H new ATOM 0 HD13 LEU A 12 28.202 -8.043 15.944 1.00 14.70 H new ATOM 0 HD21 LEU A 12 25.721 -9.527 16.770 1.00 17.28 H new ATOM 0 HD22 LEU A 12 25.598 -8.130 16.034 1.00 17.28 H new ATOM 0 HD23 LEU A 12 24.894 -9.411 15.424 1.00 17.28 H new ATOM 290 N ALA A 13 26.616 -8.434 10.625 1.00 11.25 N ATOM 291 CA ALA A 13 26.637 -7.600 9.435 1.00 10.36 C ATOM 292 C ALA A 13 25.354 -7.761 8.641 1.00 12.28 C ATOM 293 O ALA A 13 24.827 -6.766 8.120 1.00 14.39 O ATOM 294 CB ALA A 13 27.865 -7.927 8.577 1.00 11.91 C ATOM 0 H ALA A 13 27.227 -9.038 10.652 1.00 11.25 H new ATOM 0 HA ALA A 13 26.698 -6.672 9.709 1.00 10.36 H new ATOM 0 HB1 ALA A 13 27.867 -7.364 7.787 1.00 11.91 H new ATOM 0 HB2 ALA A 13 28.672 -7.765 9.091 1.00 11.91 H new ATOM 0 HB3 ALA A 13 27.834 -8.859 8.310 1.00 11.91 H new ATOM 300 N GLU A 14 24.831 -8.993 8.544 1.00 10.82 N ATOM 301 CA GLU A 14 23.543 -9.200 7.904 1.00 12.93 C ATOM 302 C GLU A 14 22.441 -8.382 8.589 1.00 14.89 C ATOM 303 O GLU A 14 21.646 -7.705 7.920 1.00 18.88 O ATOM 304 CB GLU A 14 23.186 -10.676 7.890 1.00 16.17 C ATOM 305 CG GLU A 14 21.913 -10.948 7.116 1.00 16.66 C ATOM 306 CD GLU A 14 21.516 -12.418 7.116 1.00 22.28 C ATOM 307 OE1 GLU A 14 21.993 -13.169 8.000 1.00 24.61 O ATOM 308 OE2 GLU A 14 20.730 -12.804 6.221 1.00 26.71 O ATOM 0 H GLU A 14 25.207 -9.707 8.841 1.00 10.82 H new ATOM 0 HA GLU A 14 23.613 -8.891 6.987 1.00 12.93 H new ATOM 0 HB2 GLU A 14 23.916 -11.180 7.497 1.00 16.17 H new ATOM 0 HB3 GLU A 14 23.082 -10.991 8.802 1.00 16.17 H new ATOM 0 HG2 GLU A 14 21.191 -10.424 7.497 1.00 16.66 H new ATOM 0 HG3 GLU A 14 22.028 -10.650 6.200 1.00 16.66 H new ATOM 315 N GLN A 15 22.373 -8.440 9.916 1.00 16.18 N ATOM 316 CA GLN A 15 21.353 -7.678 10.627 1.00 16.75 C ATOM 317 C GLN A 15 21.490 -6.186 10.372 1.00 14.79 C ATOM 318 O GLN A 15 20.483 -5.451 10.348 1.00 19.46 O ATOM 319 CB GLN A 15 21.448 -7.930 12.123 1.00 19.37 C ATOM 320 CG GLN A 15 21.083 -9.346 12.526 1.00 19.60 C ATOM 321 CD GLN A 15 21.306 -9.595 13.997 1.00 39.18 C ATOM 322 OE1 GLN A 15 22.315 -10.180 14.404 1.00 40.87 O ATOM 323 NE2 GLN A 15 20.373 -9.136 14.806 1.00 29.85 N ATOM 0 H GLN A 15 22.897 -8.905 10.415 1.00 16.18 H new ATOM 0 HA GLN A 15 20.491 -7.975 10.295 1.00 16.75 H new ATOM 0 HB2 GLN A 15 22.352 -7.741 12.418 1.00 19.37 H new ATOM 0 HB3 GLN A 15 20.863 -7.309 12.585 1.00 19.37 H new ATOM 0 HG2 GLN A 15 20.152 -9.513 12.309 1.00 19.60 H new ATOM 0 HG3 GLN A 15 21.612 -9.974 12.009 1.00 19.60 H new ATOM 0 HE21 GLN A 15 19.684 -8.734 14.484 1.00 29.85 H new ATOM 0 HE22 GLN A 15 20.453 -9.239 15.656 1.00 29.85 H new ATOM 332 N ALA A 16 22.725 -5.717 10.221 1.00 14.18 N ATOM 333 CA ALA A 16 23.007 -4.312 9.965 1.00 12.34 C ATOM 334 C ALA A 16 22.937 -3.950 8.487 1.00 15.85 C ATOM 335 O ALA A 16 23.158 -2.777 8.154 1.00 16.98 O ATOM 336 CB ALA A 16 24.382 -3.956 10.527 1.00 15.18 C ATOM 0 H ALA A 16 23.428 -6.211 10.265 1.00 14.18 H new ATOM 0 HA ALA A 16 22.317 -3.796 10.410 1.00 12.34 H new ATOM 0 HB1 ALA A 16 24.569 -3.020 10.356 1.00 15.18 H new ATOM 0 HB2 ALA A 16 24.393 -4.118 11.483 1.00 15.18 H new ATOM 0 HB3 ALA A 16 25.058 -4.504 10.099 1.00 15.18 H new ATOM 342 N GLU A 17 22.647 -4.920 7.618 1.00 15.91 N ATOM 343 CA AGLU A 17 22.613 -4.707 6.169 0.54 18.34 C ATOM 344 CA BGLU A 17 22.616 -4.712 6.168 0.46 18.30 C ATOM 345 C GLU A 17 23.947 -4.173 5.642 1.00 16.74 C ATOM 346 O GLU A 17 23.997 -3.391 4.684 1.00 19.68 O ATOM 347 CB AGLU A 17 21.446 -3.786 5.800 0.54 18.53 C ATOM 348 CB BGLU A 17 21.448 -3.802 5.787 0.46 18.67 C ATOM 349 CG AGLU A 17 20.092 -4.342 6.241 0.54 27.47 C ATOM 350 CG BGLU A 17 20.118 -4.549 5.707 0.46 28.33 C ATOM 351 CD AGLU A 17 18.907 -3.527 5.741 0.54 32.08 C ATOM 352 CD BGLU A 17 18.936 -3.625 5.462 0.46 29.40 C ATOM 353 OE1AGLU A 17 19.068 -2.742 4.779 0.54 32.61 O ATOM 354 OE1BGLU A 17 18.915 -2.516 6.044 0.46 43.23 O ATOM 355 OE2AGLU A 17 17.808 -3.679 6.317 0.54 34.11 O ATOM 356 OE2BGLU A 17 18.038 -4.010 4.687 0.46 31.93 O ATOM 0 H AGLU A 17 22.463 -5.726 7.855 0.54 15.91 H new ATOM 0 H BGLU A 17 22.461 -5.725 7.856 0.46 15.91 H new ATOM 0 HA AGLU A 17 22.471 -5.565 5.739 0.54 18.30 H new ATOM 0 HA BGLU A 17 22.480 -5.574 5.744 0.46 18.30 H new ATOM 0 HB2AGLU A 17 21.583 -2.917 6.209 0.54 18.67 H new ATOM 0 HB2BGLU A 17 21.374 -3.087 6.439 0.46 18.67 H new ATOM 0 HB3AGLU A 17 21.438 -3.650 4.840 0.54 18.67 H new ATOM 0 HB3BGLU A 17 21.633 -3.387 4.930 0.46 18.67 H new ATOM 0 HG2AGLU A 17 20.006 -5.254 5.922 0.54 28.33 H new ATOM 0 HG2BGLU A 17 20.163 -5.205 4.994 0.46 28.33 H new ATOM 0 HG3AGLU A 17 20.065 -4.377 7.210 0.54 28.33 H new ATOM 0 HG3BGLU A 17 19.976 -5.037 6.533 0.46 28.33 H new ATOM 369 N ARG A 18 25.034 -4.659 6.233 1.00 12.72 N ATOM 370 CA ARG A 18 26.387 -4.338 5.835 1.00 9.76 C ATOM 371 C ARG A 18 26.975 -5.505 5.038 1.00 13.35 C ATOM 372 O ARG A 18 27.783 -6.298 5.521 1.00 11.15 O ATOM 373 CB ARG A 18 27.229 -4.022 7.072 1.00 15.00 C ATOM 374 CG ARG A 18 26.780 -2.769 7.805 1.00 13.25 C ATOM 375 CD ARG A 18 27.532 -1.575 7.269 1.00 15.13 C ATOM 376 NE ARG A 18 28.950 -1.681 7.559 1.00 16.94 N ATOM 377 CZ ARG A 18 29.832 -0.708 7.443 1.00 22.83 C ATOM 378 NH1 ARG A 18 29.435 0.496 7.037 1.00 20.90 N ATOM 379 NH2 ARG A 18 31.091 -0.931 7.741 1.00 18.57 N ATOM 0 H ARG A 18 24.996 -5.202 6.898 1.00 12.72 H new ATOM 0 HA ARG A 18 26.388 -3.552 5.266 1.00 9.76 H new ATOM 0 HB2 ARG A 18 27.192 -4.776 7.681 1.00 15.00 H new ATOM 0 HB3 ARG A 18 28.156 -3.918 6.806 1.00 15.00 H new ATOM 0 HG2 ARG A 18 25.825 -2.640 7.690 1.00 13.25 H new ATOM 0 HG3 ARG A 18 26.941 -2.864 8.757 1.00 13.25 H new ATOM 0 HD2 ARG A 18 27.399 -1.508 6.311 1.00 15.13 H new ATOM 0 HD3 ARG A 18 27.178 -0.762 7.662 1.00 15.13 H new ATOM 0 HE ARG A 18 29.240 -2.444 7.830 1.00 16.94 H new ATOM 0 HH11 ARG A 18 28.607 0.636 6.852 1.00 20.90 H new ATOM 0 HH12 ARG A 18 30.007 1.134 6.960 1.00 20.90 H new ATOM 0 HH21 ARG A 18 31.338 -1.709 8.011 1.00 18.57 H new ATOM 0 HH22 ARG A 18 31.669 -0.299 7.666 1.00 18.57 H new ATOM 393 N TYR A 19 26.498 -5.634 3.794 1.00 12.25 N ATOM 394 CA TYR A 19 26.763 -6.869 3.053 1.00 13.43 C ATOM 395 C TYR A 19 28.204 -6.976 2.569 1.00 9.60 C ATOM 396 O TYR A 19 28.722 -8.089 2.449 1.00 11.99 O ATOM 397 CB TYR A 19 25.779 -6.993 1.898 1.00 12.69 C ATOM 398 CG TYR A 19 24.386 -7.208 2.426 1.00 15.29 C ATOM 399 CD1 TYR A 19 24.035 -8.395 3.058 1.00 16.61 C ATOM 400 CD2 TYR A 19 23.424 -6.208 2.329 1.00 20.49 C ATOM 401 CE1 TYR A 19 22.767 -8.597 3.551 1.00 18.56 C ATOM 402 CE2 TYR A 19 22.149 -6.416 2.815 1.00 24.34 C ATOM 403 CZ TYR A 19 21.830 -7.591 3.420 1.00 19.67 C ATOM 404 OH TYR A 19 20.560 -7.818 3.898 1.00 31.55 O ATOM 0 H TYR A 19 26.036 -5.041 3.376 1.00 12.25 H new ATOM 0 HA TYR A 19 26.636 -7.611 3.665 1.00 13.43 H new ATOM 0 HB2 TYR A 19 25.806 -6.191 1.353 1.00 12.69 H new ATOM 0 HB3 TYR A 19 26.033 -7.733 1.325 1.00 12.69 H new ATOM 0 HD1 TYR A 19 24.671 -9.067 3.150 1.00 16.61 H new ATOM 0 HD2 TYR A 19 23.641 -5.394 1.934 1.00 20.49 H new ATOM 0 HE1 TYR A 19 22.544 -9.399 3.966 1.00 18.56 H new ATOM 0 HE2 TYR A 19 21.506 -5.750 2.728 1.00 24.34 H new ATOM 0 HH TYR A 19 20.084 -7.139 3.763 1.00 31.55 H new ATOM 414 N GLU A 20 28.874 -5.857 2.278 1.00 11.88 N ATOM 415 CA AGLU A 20 30.295 -5.930 1.957 0.47 9.69 C ATOM 416 CA BGLU A 20 30.296 -5.918 1.959 0.53 9.68 C ATOM 417 C GLU A 20 31.087 -6.468 3.141 1.00 10.91 C ATOM 418 O GLU A 20 31.961 -7.328 2.975 1.00 9.99 O ATOM 419 CB AGLU A 20 30.822 -4.553 1.521 0.47 13.49 C ATOM 420 CB BGLU A 20 30.816 -4.527 1.543 0.53 13.46 C ATOM 421 CG AGLU A 20 30.262 -4.078 0.204 0.47 10.08 C ATOM 422 CG BGLU A 20 32.271 -4.542 1.140 0.53 13.59 C ATOM 423 CD AGLU A 20 31.023 -2.889 -0.368 0.47 27.46 C ATOM 424 CD BGLU A 20 32.845 -3.173 0.807 0.53 29.50 C ATOM 425 OE1AGLU A 20 30.821 -2.574 -1.561 0.47 47.24 O ATOM 426 OE1BGLU A 20 32.687 -2.239 1.619 0.53 37.52 O ATOM 427 OE2AGLU A 20 31.835 -2.287 0.364 0.47 27.13 O ATOM 428 OE2BGLU A 20 33.464 -3.046 -0.263 0.53 32.01 O ATOM 0 H AGLU A 20 28.533 -5.068 2.262 0.47 11.88 H new ATOM 0 H BGLU A 20 28.529 -5.069 2.261 0.53 11.88 H new ATOM 0 HA AGLU A 20 30.411 -6.545 1.216 0.47 9.68 H new ATOM 0 HA BGLU A 20 30.419 -6.521 1.210 0.53 9.68 H new ATOM 0 HB2AGLU A 20 30.609 -3.902 2.208 0.47 13.46 H new ATOM 0 HB2BGLU A 20 30.283 -4.195 0.803 0.53 13.46 H new ATOM 0 HB3AGLU A 20 31.789 -4.591 1.457 0.47 13.46 H new ATOM 0 HB3BGLU A 20 30.695 -3.908 2.280 0.53 13.46 H new ATOM 0 HG2AGLU A 20 30.284 -4.808 -0.434 0.47 13.59 H new ATOM 0 HG2BGLU A 20 32.791 -4.932 1.860 0.53 13.59 H new ATOM 0 HG3AGLU A 20 29.331 -3.834 0.323 0.47 13.59 H new ATOM 0 HG3BGLU A 20 32.376 -5.121 0.369 0.53 13.59 H new ATOM 441 N ASP A 21 30.798 -5.975 4.345 1.00 11.10 N ATOM 442 CA ASP A 21 31.427 -6.524 5.543 1.00 9.04 C ATOM 443 C ASP A 21 31.109 -8.018 5.680 1.00 11.03 C ATOM 444 O ASP A 21 31.988 -8.858 5.941 1.00 10.43 O ATOM 445 CB ASP A 21 30.932 -5.812 6.796 1.00 11.72 C ATOM 446 CG ASP A 21 31.498 -4.422 6.992 1.00 16.18 C ATOM 447 OD1 ASP A 21 32.415 -4.008 6.250 1.00 17.73 O ATOM 448 OD2 ASP A 21 30.960 -3.731 7.907 1.00 18.15 O ATOM 0 H ASP A 21 30.247 -5.330 4.488 1.00 11.10 H new ATOM 0 HA ASP A 21 32.384 -6.394 5.452 1.00 9.04 H new ATOM 0 HB2 ASP A 21 29.964 -5.753 6.760 1.00 11.72 H new ATOM 0 HB3 ASP A 21 31.155 -6.352 7.571 1.00 11.72 H new ATOM 453 N MET A 22 29.839 -8.361 5.508 1.00 10.36 N ATOM 454 CA MET A 22 29.400 -9.751 5.617 1.00 10.39 C ATOM 455 C MET A 22 30.193 -10.658 4.697 1.00 10.89 C ATOM 456 O MET A 22 30.611 -11.767 5.096 1.00 10.79 O ATOM 457 CB MET A 22 27.916 -9.834 5.294 1.00 11.01 C ATOM 458 CG MET A 22 27.295 -11.164 5.652 1.00 10.89 C ATOM 459 SD MET A 22 25.615 -11.274 5.104 1.00 12.67 S ATOM 460 CE MET A 22 25.158 -12.912 5.669 1.00 9.78 C ATOM 0 H MET A 22 29.211 -7.803 5.326 1.00 10.36 H new ATOM 0 HA MET A 22 29.555 -10.054 6.525 1.00 10.39 H new ATOM 0 HB2 MET A 22 27.449 -9.129 5.769 1.00 11.01 H new ATOM 0 HB3 MET A 22 27.789 -9.670 4.346 1.00 11.01 H new ATOM 0 HG2 MET A 22 27.813 -11.881 5.253 1.00 10.89 H new ATOM 0 HG3 MET A 22 27.331 -11.289 6.613 1.00 10.89 H new ATOM 0 HE1 MET A 22 24.233 -13.088 5.437 1.00 9.78 H new ATOM 0 HE2 MET A 22 25.729 -13.572 5.245 1.00 9.78 H new ATOM 0 HE3 MET A 22 25.265 -12.964 6.632 1.00 9.78 H new ATOM 470 N ALA A 23 30.388 -10.208 3.445 1.00 8.71 N ATOM 471 CA ALA A 23 31.120 -10.996 2.472 1.00 9.50 C ATOM 472 C ALA A 23 32.576 -11.153 2.863 1.00 9.93 C ATOM 473 O ALA A 23 33.136 -12.242 2.733 1.00 10.80 O ATOM 474 CB ALA A 23 31.025 -10.368 1.093 1.00 11.34 C ATOM 0 H ALA A 23 30.101 -9.452 3.152 1.00 8.71 H new ATOM 0 HA ALA A 23 30.714 -11.877 2.451 1.00 9.50 H new ATOM 0 HB1 ALA A 23 31.520 -10.908 0.457 1.00 11.34 H new ATOM 0 HB2 ALA A 23 30.095 -10.321 0.822 1.00 11.34 H new ATOM 0 HB3 ALA A 23 31.400 -9.474 1.118 1.00 11.34 H new ATOM 480 N ALA A 24 33.200 -10.091 3.356 1.00 9.51 N ATOM 481 CA ALA A 24 34.583 -10.193 3.794 1.00 11.44 C ATOM 482 C ALA A 24 34.725 -11.152 4.973 1.00 11.37 C ATOM 483 O ALA A 24 35.685 -11.940 5.020 1.00 11.00 O ATOM 484 CB ALA A 24 35.124 -8.810 4.143 1.00 11.83 C ATOM 0 H ALA A 24 32.846 -9.312 3.444 1.00 9.51 H new ATOM 0 HA ALA A 24 35.108 -10.556 3.064 1.00 11.44 H new ATOM 0 HB1 ALA A 24 36.046 -8.887 4.434 1.00 11.83 H new ATOM 0 HB2 ALA A 24 35.079 -8.238 3.361 1.00 11.83 H new ATOM 0 HB3 ALA A 24 34.592 -8.425 4.856 1.00 11.83 H new ATOM 490 N PHE A 25 33.764 -11.127 5.909 1.00 9.59 N ATOM 491 CA PHE A 25 33.813 -12.049 7.038 1.00 10.96 C ATOM 492 C PHE A 25 33.684 -13.502 6.549 1.00 11.62 C ATOM 493 O PHE A 25 34.426 -14.392 6.995 1.00 9.27 O ATOM 494 CB PHE A 25 32.710 -11.724 8.056 1.00 11.65 C ATOM 495 CG PHE A 25 32.922 -10.423 8.821 1.00 9.12 C ATOM 496 CD1 PHE A 25 31.856 -9.594 9.103 1.00 9.97 C ATOM 497 CD2 PHE A 25 34.179 -10.068 9.289 1.00 12.24 C ATOM 498 CE1 PHE A 25 32.034 -8.392 9.784 1.00 10.80 C ATOM 499 CE2 PHE A 25 34.354 -8.906 10.029 1.00 10.49 C ATOM 500 CZ PHE A 25 33.276 -8.059 10.230 1.00 11.41 C ATOM 0 H PHE A 25 33.090 -10.592 5.904 1.00 9.59 H new ATOM 0 HA PHE A 25 34.671 -11.946 7.479 1.00 10.96 H new ATOM 0 HB2 PHE A 25 31.860 -11.678 7.591 1.00 11.65 H new ATOM 0 HB3 PHE A 25 32.647 -12.454 8.692 1.00 11.65 H new ATOM 0 HD1 PHE A 25 31.001 -9.843 8.833 1.00 9.97 H new ATOM 0 HD2 PHE A 25 34.910 -10.613 9.106 1.00 12.24 H new ATOM 0 HE1 PHE A 25 31.313 -7.824 9.932 1.00 10.80 H new ATOM 0 HE2 PHE A 25 35.187 -8.698 10.386 1.00 10.49 H new ATOM 0 HZ PHE A 25 33.403 -7.253 10.675 1.00 11.41 H new ATOM 510 N MET A 26 32.737 -13.756 5.639 1.00 9.61 N ATOM 511 CA MET A 26 32.517 -15.117 5.159 1.00 9.88 C ATOM 512 C MET A 26 33.668 -15.605 4.287 1.00 10.38 C ATOM 513 O MET A 26 34.022 -16.795 4.327 1.00 12.19 O ATOM 514 CB MET A 26 31.191 -15.212 4.415 1.00 12.81 C ATOM 515 CG MET A 26 29.950 -15.136 5.314 1.00 12.14 C ATOM 516 SD MET A 26 30.046 -16.213 6.740 1.00 12.65 S ATOM 517 CE MET A 26 30.203 -17.832 5.939 1.00 10.93 C ATOM 0 H MET A 26 32.220 -13.161 5.294 1.00 9.61 H new ATOM 0 HA MET A 26 32.479 -15.699 5.934 1.00 9.88 H new ATOM 0 HB2 MET A 26 31.148 -14.496 3.762 1.00 12.81 H new ATOM 0 HB3 MET A 26 31.169 -16.047 3.922 1.00 12.81 H new ATOM 0 HG2 MET A 26 29.831 -14.221 5.614 1.00 12.14 H new ATOM 0 HG3 MET A 26 29.166 -15.368 4.793 1.00 12.14 H new ATOM 0 HE1 MET A 26 30.060 -18.533 6.594 1.00 10.93 H new ATOM 0 HE2 MET A 26 29.542 -17.910 5.234 1.00 10.93 H new ATOM 0 HE3 MET A 26 31.091 -17.921 5.560 1.00 10.93 H new ATOM 527 N LYS A 27 34.241 -14.729 3.453 1.00 11.68 N ATOM 528 CA LYS A 27 35.470 -15.083 2.753 1.00 11.35 C ATOM 529 C LYS A 27 36.547 -15.521 3.757 1.00 12.75 C ATOM 530 O LYS A 27 37.213 -16.548 3.581 1.00 11.85 O ATOM 531 CB LYS A 27 35.934 -13.899 1.890 1.00 12.18 C ATOM 532 CG LYS A 27 37.237 -14.196 1.116 1.00 12.10 C ATOM 533 CD LYS A 27 37.603 -13.021 0.236 1.00 16.84 C ATOM 534 CE LYS A 27 38.796 -13.339 -0.677 1.00 25.71 C ATOM 535 NZ LYS A 27 40.085 -13.278 0.073 1.00 28.06 N ATOM 0 H LYS A 27 33.938 -13.942 3.284 1.00 11.68 H new ATOM 0 HA LYS A 27 35.305 -15.835 2.162 1.00 11.35 H new ATOM 0 HB2 LYS A 27 35.233 -13.670 1.259 1.00 12.18 H new ATOM 0 HB3 LYS A 27 36.069 -13.124 2.458 1.00 12.18 H new ATOM 0 HG2 LYS A 27 37.957 -14.378 1.740 1.00 12.10 H new ATOM 0 HG3 LYS A 27 37.124 -14.992 0.573 1.00 12.10 H new ATOM 0 HD2 LYS A 27 36.838 -12.773 -0.307 1.00 16.84 H new ATOM 0 HD3 LYS A 27 37.817 -12.255 0.792 1.00 16.84 H new ATOM 0 HE2 LYS A 27 38.685 -14.222 -1.062 1.00 25.71 H new ATOM 0 HE3 LYS A 27 38.818 -12.709 -1.414 1.00 25.71 H new ATOM 0 HZ1 LYS A 27 40.660 -12.759 -0.366 1.00 28.06 H new ATOM 0 HZ2 LYS A 27 39.941 -12.941 0.884 1.00 28.06 H new ATOM 0 HZ3 LYS A 27 40.424 -14.097 0.148 1.00 28.06 H new ATOM 549 N GLY A 28 36.708 -14.778 4.847 1.00 11.97 N ATOM 550 CA GLY A 28 37.690 -15.167 5.843 1.00 11.48 C ATOM 551 C GLY A 28 37.384 -16.519 6.430 1.00 11.27 C ATOM 552 O GLY A 28 38.289 -17.320 6.656 1.00 13.13 O ATOM 0 H GLY A 28 36.268 -14.061 5.024 1.00 11.97 H new ATOM 0 HA2 GLY A 28 38.572 -15.181 5.439 1.00 11.48 H new ATOM 0 HA3 GLY A 28 37.713 -14.504 6.551 1.00 11.48 H new ATOM 556 N ALA A 29 36.098 -16.799 6.662 1.00 9.95 N ATOM 557 CA ALA A 29 35.711 -18.086 7.219 1.00 10.38 C ATOM 558 C ALA A 29 36.039 -19.200 6.241 1.00 10.30 C ATOM 559 O ALA A 29 36.577 -20.239 6.627 1.00 11.53 O ATOM 560 CB ALA A 29 34.217 -18.091 7.566 1.00 12.61 C ATOM 0 H ALA A 29 35.446 -16.261 6.504 1.00 9.95 H new ATOM 0 HA ALA A 29 36.213 -18.237 8.035 1.00 10.38 H new ATOM 0 HB1 ALA A 29 33.973 -18.954 7.936 1.00 12.61 H new ATOM 0 HB2 ALA A 29 34.034 -17.397 8.218 1.00 12.61 H new ATOM 0 HB3 ALA A 29 33.698 -17.925 6.764 1.00 12.61 H new ATOM 566 N VAL A 30 35.694 -19.015 4.967 1.00 11.86 N ATOM 567 CA VAL A 30 36.032 -20.022 3.963 1.00 11.99 C ATOM 568 C VAL A 30 37.533 -20.283 3.937 1.00 11.13 C ATOM 569 O VAL A 30 37.975 -21.438 3.838 1.00 12.57 O ATOM 570 CB VAL A 30 35.526 -19.609 2.567 1.00 13.01 C ATOM 571 CG1 VAL A 30 36.129 -20.567 1.493 1.00 13.52 C ATOM 572 CG2 VAL A 30 34.019 -19.606 2.541 1.00 12.51 C ATOM 0 H VAL A 30 35.272 -18.328 4.668 1.00 11.86 H new ATOM 0 HA VAL A 30 35.585 -20.847 4.211 1.00 11.99 H new ATOM 0 HB VAL A 30 35.818 -18.707 2.362 1.00 13.01 H new ATOM 0 HG11 VAL A 30 35.811 -20.308 0.614 1.00 13.52 H new ATOM 0 HG12 VAL A 30 37.097 -20.511 1.516 1.00 13.52 H new ATOM 0 HG13 VAL A 30 35.854 -21.478 1.681 1.00 13.52 H new ATOM 0 HG21 VAL A 30 33.711 -19.345 1.659 1.00 12.51 H new ATOM 0 HG22 VAL A 30 33.690 -20.495 2.748 1.00 12.51 H new ATOM 0 HG23 VAL A 30 33.685 -18.976 3.199 1.00 12.51 H new ATOM 582 N GLU A 31 38.339 -19.231 4.037 1.00 11.32 N ATOM 583 CA GLU A 31 39.788 -19.368 3.932 1.00 11.90 C ATOM 584 C GLU A 31 40.397 -20.063 5.139 1.00 14.56 C ATOM 585 O GLU A 31 41.572 -20.419 5.092 1.00 14.67 O ATOM 586 CB GLU A 31 40.431 -17.995 3.677 1.00 11.81 C ATOM 587 CG GLU A 31 40.133 -17.448 2.287 1.00 13.47 C ATOM 588 CD GLU A 31 40.623 -16.028 2.027 1.00 19.56 C ATOM 589 OE1 GLU A 31 40.953 -15.322 2.983 1.00 26.93 O ATOM 590 OE2 GLU A 31 40.656 -15.645 0.834 1.00 29.46 O ATOM 0 H GLU A 31 38.066 -18.426 4.166 1.00 11.32 H new ATOM 0 HA GLU A 31 39.977 -19.942 3.173 1.00 11.90 H new ATOM 0 HB2 GLU A 31 40.112 -17.365 4.342 1.00 11.81 H new ATOM 0 HB3 GLU A 31 41.391 -18.067 3.792 1.00 11.81 H new ATOM 0 HG2 GLU A 31 40.535 -18.038 1.630 1.00 13.47 H new ATOM 0 HG3 GLU A 31 39.174 -17.475 2.144 1.00 13.47 H new ATOM 597 N LYS A 32 39.625 -20.330 6.196 1.00 13.57 N ATOM 598 CA LYS A 32 40.136 -21.165 7.268 1.00 12.54 C ATOM 599 C LYS A 32 40.360 -22.604 6.832 1.00 12.79 C ATOM 600 O LYS A 32 41.076 -23.340 7.520 1.00 13.23 O ATOM 601 CB LYS A 32 39.194 -21.162 8.461 1.00 12.57 C ATOM 602 CG LYS A 32 38.969 -19.760 9.046 1.00 12.88 C ATOM 603 CD LYS A 32 40.257 -19.137 9.509 1.00 12.54 C ATOM 604 CE LYS A 32 40.011 -17.750 10.080 1.00 12.80 C ATOM 605 NZ LYS A 32 41.262 -16.987 10.402 1.00 17.76 N ATOM 0 H LYS A 32 38.822 -20.042 6.305 1.00 13.57 H new ATOM 0 HA LYS A 32 40.991 -20.782 7.517 1.00 12.54 H new ATOM 0 HB2 LYS A 32 38.340 -21.536 8.193 1.00 12.57 H new ATOM 0 HB3 LYS A 32 39.553 -21.741 9.151 1.00 12.57 H new ATOM 0 HG2 LYS A 32 38.557 -19.192 8.376 1.00 12.88 H new ATOM 0 HG3 LYS A 32 38.350 -19.815 9.791 1.00 12.88 H new ATOM 0 HD2 LYS A 32 40.670 -19.700 10.182 1.00 12.54 H new ATOM 0 HD3 LYS A 32 40.879 -19.080 8.767 1.00 12.54 H new ATOM 0 HE2 LYS A 32 39.486 -17.238 9.445 1.00 12.80 H new ATOM 0 HE3 LYS A 32 39.478 -17.833 10.886 1.00 12.80 H new ATOM 0 HZ1 LYS A 32 41.203 -16.653 11.225 1.00 17.76 H new ATOM 0 HZ2 LYS A 32 41.963 -17.533 10.354 1.00 17.76 H new ATOM 0 HZ3 LYS A 32 41.363 -16.322 9.819 1.00 17.76 H new ATOM 619 N GLY A 33 39.727 -23.026 5.732 1.00 12.88 N ATOM 620 CA GLY A 33 39.992 -24.302 5.139 1.00 10.90 C ATOM 621 C GLY A 33 39.058 -25.408 5.549 1.00 15.54 C ATOM 622 O GLY A 33 39.140 -26.512 4.974 1.00 18.67 O ATOM 0 H GLY A 33 39.131 -22.564 5.319 1.00 12.88 H new ATOM 0 HA2 GLY A 33 39.954 -24.208 4.174 1.00 10.90 H new ATOM 0 HA3 GLY A 33 40.899 -24.564 5.363 1.00 10.90 H new ATOM 626 N GLU A 34 38.190 -25.182 6.530 1.00 14.50 N ATOM 627 CA GLU A 34 37.196 -26.179 6.912 1.00 13.55 C ATOM 628 C GLU A 34 35.957 -26.101 6.010 1.00 17.30 C ATOM 629 O GLU A 34 35.617 -25.054 5.445 1.00 16.85 O ATOM 630 CB GLU A 34 36.777 -26.016 8.379 1.00 20.00 C ATOM 631 CG GLU A 34 37.946 -26.032 9.356 1.00 22.86 C ATOM 632 CD GLU A 34 38.569 -27.415 9.498 1.00 52.92 C ATOM 633 OE1 GLU A 34 39.708 -27.502 10.003 1.00 62.41 O ATOM 634 OE2 GLU A 34 37.924 -28.419 9.106 1.00 48.01 O ATOM 0 H GLU A 34 38.160 -24.455 6.988 1.00 14.50 H new ATOM 0 HA GLU A 34 37.609 -27.050 6.802 1.00 13.55 H new ATOM 0 HB2 GLU A 34 36.295 -25.180 8.478 1.00 20.00 H new ATOM 0 HB3 GLU A 34 36.161 -26.728 8.612 1.00 20.00 H new ATOM 0 HG2 GLU A 34 38.623 -25.405 9.056 1.00 22.86 H new ATOM 0 HG3 GLU A 34 37.642 -25.727 10.225 1.00 22.86 H new ATOM 641 N GLU A 35 35.292 -27.237 5.840 1.00 15.24 N ATOM 642 CA GLU A 35 34.023 -27.239 5.118 1.00 12.48 C ATOM 643 C GLU A 35 33.002 -26.372 5.859 1.00 19.00 C ATOM 644 O GLU A 35 33.123 -26.080 7.059 1.00 17.57 O ATOM 645 CB GLU A 35 33.533 -28.682 4.934 1.00 15.63 C ATOM 646 CG GLU A 35 34.543 -29.499 4.068 1.00 16.41 C ATOM 647 CD GLU A 35 34.090 -30.914 3.736 1.00 36.12 C ATOM 648 OE1 GLU A 35 34.973 -31.785 3.528 1.00 23.57 O ATOM 649 OE2 GLU A 35 32.868 -31.164 3.653 1.00 36.67 O ATOM 0 H GLU A 35 35.551 -28.005 6.128 1.00 15.24 H new ATOM 0 HA GLU A 35 34.143 -26.856 4.235 1.00 12.48 H new ATOM 0 HB2 GLU A 35 33.426 -29.105 5.800 1.00 15.63 H new ATOM 0 HB3 GLU A 35 32.661 -28.681 4.509 1.00 15.63 H new ATOM 0 HG2 GLU A 35 34.703 -29.020 3.240 1.00 16.41 H new ATOM 0 HG3 GLU A 35 35.391 -29.545 4.537 1.00 16.41 H new ATOM 656 N LEU A 36 32.028 -25.896 5.109 1.00 13.63 N ATOM 657 CA LEU A 36 30.974 -25.042 5.640 1.00 13.07 C ATOM 658 C LEU A 36 29.737 -25.870 5.930 1.00 15.97 C ATOM 659 O LEU A 36 29.363 -26.749 5.158 1.00 14.71 O ATOM 660 CB LEU A 36 30.585 -23.932 4.665 1.00 12.59 C ATOM 661 CG LEU A 36 31.649 -22.938 4.182 1.00 24.63 C ATOM 662 CD1 LEU A 36 30.966 -21.754 3.479 1.00 17.77 C ATOM 663 CD2 LEU A 36 32.470 -22.446 5.289 1.00 19.65 C ATOM 0 H LEU A 36 31.955 -26.058 4.268 1.00 13.63 H new ATOM 0 HA LEU A 36 31.320 -24.637 6.450 1.00 13.07 H new ATOM 0 HB2 LEU A 36 30.206 -24.356 3.879 1.00 12.59 H new ATOM 0 HB3 LEU A 36 29.875 -23.418 5.080 1.00 12.59 H new ATOM 0 HG LEU A 36 32.232 -23.402 3.561 1.00 24.63 H new ATOM 0 HD11 LEU A 36 31.640 -21.126 3.174 1.00 17.77 H new ATOM 0 HD12 LEU A 36 30.459 -22.078 2.718 1.00 17.77 H new ATOM 0 HD13 LEU A 36 30.368 -21.310 4.100 1.00 17.77 H new ATOM 0 HD21 LEU A 36 33.130 -21.822 4.950 1.00 19.65 H new ATOM 0 HD22 LEU A 36 31.905 -21.997 5.937 1.00 19.65 H new ATOM 0 HD23 LEU A 36 32.920 -23.192 5.715 1.00 19.65 H new ATOM 675 N SER A 37 29.071 -25.553 7.016 1.00 13.81 N ATOM 676 CA SER A 37 27.763 -26.107 7.313 1.00 14.93 C ATOM 677 C SER A 37 26.706 -25.487 6.392 1.00 11.93 C ATOM 678 O SER A 37 26.956 -24.504 5.694 1.00 11.07 O ATOM 679 CB SER A 37 27.401 -25.792 8.768 1.00 13.42 C ATOM 680 OG SER A 37 27.180 -24.396 8.947 1.00 14.39 O ATOM 0 H SER A 37 29.364 -25.005 7.611 1.00 13.81 H new ATOM 0 HA SER A 37 27.787 -27.067 7.173 1.00 14.93 H new ATOM 0 HB2 SER A 37 26.604 -26.284 9.021 1.00 13.42 H new ATOM 0 HB3 SER A 37 28.115 -26.088 9.354 1.00 13.42 H new ATOM 0 HG SER A 37 26.841 -24.261 9.703 1.00 14.39 H new ATOM 686 N CYS A 38 25.485 -26.029 6.443 1.00 11.77 N ATOM 687 CA CYS A 38 24.387 -25.504 5.632 1.00 13.92 C ATOM 688 C CYS A 38 24.126 -24.032 5.934 1.00 12.16 C ATOM 689 O CYS A 38 24.026 -23.191 5.017 1.00 14.09 O ATOM 690 CB CYS A 38 23.121 -26.337 5.885 1.00 17.33 C ATOM 691 SG CYS A 38 21.704 -25.788 4.951 1.00 26.43 S ATOM 0 H CYS A 38 25.275 -26.699 6.940 1.00 11.77 H new ATOM 0 HA CYS A 38 24.636 -25.569 4.697 1.00 13.92 H new ATOM 0 HB2 CYS A 38 23.304 -27.264 5.665 1.00 17.33 H new ATOM 0 HB3 CYS A 38 22.907 -26.307 6.831 1.00 17.33 H new ATOM 0 HG CYS A 38 20.763 -26.488 5.203 1.00 26.43 H new ATOM 697 N GLU A 39 24.068 -23.687 7.223 1.00 12.05 N ATOM 698 CA GLU A 39 23.827 -22.301 7.599 1.00 12.54 C ATOM 699 C GLU A 39 24.944 -21.407 7.101 1.00 11.52 C ATOM 700 O GLU A 39 24.690 -20.302 6.621 1.00 11.70 O ATOM 701 CB GLU A 39 23.675 -22.186 9.120 1.00 14.48 C ATOM 702 CG GLU A 39 23.466 -20.775 9.599 1.00 21.10 C ATOM 703 CD GLU A 39 23.292 -20.691 11.109 1.00 34.45 C ATOM 704 OE1 GLU A 39 23.538 -21.707 11.798 1.00 31.89 O ATOM 705 OE2 GLU A 39 22.891 -19.613 11.595 1.00 33.13 O ATOM 0 H GLU A 39 24.164 -24.232 7.881 1.00 12.05 H new ATOM 0 HA GLU A 39 23.002 -22.007 7.183 1.00 12.54 H new ATOM 0 HB2 GLU A 39 22.925 -22.731 9.405 1.00 14.48 H new ATOM 0 HB3 GLU A 39 24.467 -22.550 9.545 1.00 14.48 H new ATOM 0 HG2 GLU A 39 24.224 -20.231 9.333 1.00 21.10 H new ATOM 0 HG3 GLU A 39 22.683 -20.402 9.165 1.00 21.10 H new ATOM 712 N GLU A 40 26.187 -21.875 7.181 1.00 10.97 N ATOM 713 CA GLU A 40 27.322 -21.058 6.757 1.00 11.24 C ATOM 714 C GLU A 40 27.347 -20.870 5.243 1.00 11.98 C ATOM 715 O GLU A 40 27.684 -19.778 4.754 1.00 11.74 O ATOM 716 CB GLU A 40 28.617 -21.683 7.234 1.00 10.41 C ATOM 717 CG GLU A 40 28.766 -21.660 8.777 1.00 13.26 C ATOM 718 CD GLU A 40 29.789 -22.671 9.304 1.00 17.96 C ATOM 719 OE1 GLU A 40 30.393 -23.472 8.544 1.00 14.97 O ATOM 720 OE2 GLU A 40 30.000 -22.689 10.546 1.00 16.39 O ATOM 0 H GLU A 40 26.394 -22.656 7.475 1.00 10.97 H new ATOM 0 HA GLU A 40 27.224 -20.180 7.158 1.00 11.24 H new ATOM 0 HB2 GLU A 40 28.662 -22.601 6.923 1.00 10.41 H new ATOM 0 HB3 GLU A 40 29.365 -21.212 6.834 1.00 10.41 H new ATOM 0 HG2 GLU A 40 29.028 -20.769 9.057 1.00 13.26 H new ATOM 0 HG3 GLU A 40 27.903 -21.842 9.181 1.00 13.26 H new ATOM 727 N ARG A 41 26.974 -21.908 4.497 1.00 10.86 N ATOM 728 CA ARG A 41 26.888 -21.803 3.051 1.00 9.61 C ATOM 729 C ARG A 41 25.848 -20.760 2.683 1.00 12.40 C ATOM 730 O ARG A 41 26.055 -19.944 1.776 1.00 12.88 O ATOM 731 CB ARG A 41 26.524 -23.143 2.392 1.00 12.50 C ATOM 732 CG ARG A 41 27.563 -24.155 2.486 1.00 19.38 C ATOM 733 CD ARG A 41 27.237 -25.369 1.615 1.00 19.43 C ATOM 734 NE ARG A 41 26.033 -26.093 1.959 1.00 15.59 N ATOM 735 CZ ARG A 41 25.986 -27.124 2.802 1.00 18.71 C ATOM 736 NH1 ARG A 41 27.066 -27.516 3.469 1.00 20.18 N ATOM 737 NH2 ARG A 41 24.835 -27.758 2.999 1.00 20.31 N ATOM 0 H ARG A 41 26.767 -22.681 4.813 1.00 10.86 H new ATOM 0 HA ARG A 41 27.763 -21.542 2.722 1.00 9.61 H new ATOM 0 HB2 ARG A 41 25.715 -23.485 2.804 1.00 12.50 H new ATOM 0 HB3 ARG A 41 26.322 -22.987 1.456 1.00 12.50 H new ATOM 0 HG2 ARG A 41 28.412 -23.776 2.211 1.00 19.38 H new ATOM 0 HG3 ARG A 41 27.663 -24.434 3.410 1.00 19.38 H new ATOM 0 HD2 ARG A 41 27.163 -25.073 0.694 1.00 19.43 H new ATOM 0 HD3 ARG A 41 27.986 -25.984 1.656 1.00 19.43 H new ATOM 0 HE ARG A 41 25.296 -25.841 1.594 1.00 15.59 H new ATOM 0 HH11 ARG A 41 27.812 -27.102 3.360 1.00 20.18 H new ATOM 0 HH12 ARG A 41 27.019 -28.183 4.009 1.00 20.18 H new ATOM 0 HH21 ARG A 41 24.127 -27.502 2.584 1.00 20.31 H new ATOM 0 HH22 ARG A 41 24.798 -28.424 3.542 1.00 20.31 H new ATOM 751 N ASN A 42 24.727 -20.758 3.402 1.00 11.37 N ATOM 752 CA ASN A 42 23.702 -19.755 3.142 1.00 10.50 C ATOM 753 C ASN A 42 24.188 -18.353 3.496 1.00 14.19 C ATOM 754 O ASN A 42 23.871 -17.402 2.782 1.00 12.84 O ATOM 755 CB ASN A 42 22.431 -20.097 3.893 1.00 12.56 C ATOM 756 CG ASN A 42 21.627 -21.183 3.215 1.00 16.77 C ATOM 757 OD1 ASN A 42 21.552 -21.238 1.984 1.00 17.96 O ATOM 758 ND2 ASN A 42 20.977 -22.013 4.003 1.00 25.12 N ATOM 0 H ASN A 42 24.544 -21.316 4.031 1.00 11.37 H new ATOM 0 HA ASN A 42 23.510 -19.760 2.191 1.00 10.50 H new ATOM 0 HB2 ASN A 42 22.658 -20.381 4.792 1.00 12.56 H new ATOM 0 HB3 ASN A 42 21.885 -19.300 3.977 1.00 12.56 H new ATOM 0 HD21 ASN A 42 20.476 -22.624 3.664 1.00 25.12 H new ATOM 0 HD22 ASN A 42 21.054 -21.944 4.857 1.00 25.12 H new ATOM 765 N LEU A 43 24.981 -18.195 4.567 1.00 11.33 N ATOM 766 CA LEU A 43 25.521 -16.872 4.862 1.00 10.97 C ATOM 767 C LEU A 43 26.440 -16.389 3.749 1.00 9.73 C ATOM 768 O LEU A 43 26.429 -15.202 3.383 1.00 10.90 O ATOM 769 CB LEU A 43 26.296 -16.862 6.187 1.00 10.89 C ATOM 770 CG LEU A 43 25.421 -17.055 7.433 1.00 12.67 C ATOM 771 CD1 LEU A 43 26.337 -17.375 8.613 1.00 13.01 C ATOM 772 CD2 LEU A 43 24.564 -15.855 7.684 1.00 15.77 C ATOM 0 H LEU A 43 25.208 -18.819 5.113 1.00 11.33 H new ATOM 0 HA LEU A 43 24.762 -16.273 4.934 1.00 10.97 H new ATOM 0 HB2 LEU A 43 26.965 -17.564 6.163 1.00 10.89 H new ATOM 0 HB3 LEU A 43 26.771 -16.020 6.265 1.00 10.89 H new ATOM 0 HG LEU A 43 24.807 -17.794 7.301 1.00 12.67 H new ATOM 0 HD11 LEU A 43 25.803 -17.501 9.413 1.00 13.01 H new ATOM 0 HD12 LEU A 43 26.835 -18.186 8.426 1.00 13.01 H new ATOM 0 HD13 LEU A 43 26.956 -16.641 8.751 1.00 13.01 H new ATOM 0 HD21 LEU A 43 24.023 -16.003 8.475 1.00 15.77 H new ATOM 0 HD22 LEU A 43 25.128 -15.077 7.820 1.00 15.77 H new ATOM 0 HD23 LEU A 43 23.985 -15.705 6.920 1.00 15.77 H new ATOM 784 N LEU A 44 27.294 -17.282 3.242 1.00 9.41 N ATOM 785 CA LEU A 44 28.200 -16.923 2.166 1.00 10.26 C ATOM 786 C LEU A 44 27.422 -16.443 0.955 1.00 11.63 C ATOM 787 O LEU A 44 27.735 -15.410 0.369 1.00 10.06 O ATOM 788 CB LEU A 44 29.051 -18.133 1.791 1.00 10.53 C ATOM 789 CG LEU A 44 29.982 -17.979 0.608 1.00 9.01 C ATOM 790 CD1 LEU A 44 31.150 -17.026 0.943 1.00 12.94 C ATOM 791 CD2 LEU A 44 30.526 -19.328 0.159 1.00 13.25 C ATOM 0 H LEU A 44 27.359 -18.096 3.510 1.00 9.41 H new ATOM 0 HA LEU A 44 28.776 -16.203 2.467 1.00 10.26 H new ATOM 0 HB2 LEU A 44 29.584 -18.378 2.564 1.00 10.53 H new ATOM 0 HB3 LEU A 44 28.455 -18.876 1.610 1.00 10.53 H new ATOM 0 HG LEU A 44 29.467 -17.596 -0.119 1.00 9.01 H new ATOM 0 HD11 LEU A 44 31.732 -16.943 0.171 1.00 12.94 H new ATOM 0 HD12 LEU A 44 30.798 -16.153 1.177 1.00 12.94 H new ATOM 0 HD13 LEU A 44 31.654 -17.382 1.691 1.00 12.94 H new ATOM 0 HD21 LEU A 44 31.119 -19.202 -0.599 1.00 13.25 H new ATOM 0 HD22 LEU A 44 31.017 -19.738 0.888 1.00 13.25 H new ATOM 0 HD23 LEU A 44 29.790 -19.904 -0.099 1.00 13.25 H new ATOM 803 N SER A 45 26.378 -17.175 0.588 1.00 8.53 N ATOM 804 CA SER A 45 25.592 -16.824 -0.577 1.00 9.78 C ATOM 805 C SER A 45 24.820 -15.524 -0.381 1.00 10.24 C ATOM 806 O SER A 45 24.830 -14.652 -1.260 1.00 11.29 O ATOM 807 CB SER A 45 24.625 -17.956 -0.895 1.00 14.05 C ATOM 808 OG SER A 45 23.903 -17.623 -2.093 1.00 16.76 O ATOM 0 H SER A 45 26.111 -17.879 1.003 1.00 8.53 H new ATOM 0 HA SER A 45 26.204 -16.688 -1.317 1.00 9.78 H new ATOM 0 HB2 SER A 45 25.109 -18.788 -1.014 1.00 14.05 H new ATOM 0 HB3 SER A 45 24.009 -18.089 -0.157 1.00 14.05 H new ATOM 0 HG SER A 45 23.437 -18.280 -2.332 1.00 16.76 H new ATOM 814 N VAL A 46 24.198 -15.348 0.782 1.00 10.17 N ATOM 815 CA VAL A 46 23.479 -14.111 1.068 1.00 10.87 C ATOM 816 C VAL A 46 24.415 -12.908 0.940 1.00 12.61 C ATOM 817 O VAL A 46 24.061 -11.877 0.329 1.00 12.64 O ATOM 818 CB VAL A 46 22.845 -14.172 2.471 1.00 11.86 C ATOM 819 CG1 VAL A 46 22.430 -12.775 2.926 1.00 15.17 C ATOM 820 CG2 VAL A 46 21.644 -15.113 2.479 1.00 15.90 C ATOM 0 H VAL A 46 24.180 -15.929 1.415 1.00 10.17 H new ATOM 0 HA VAL A 46 22.766 -14.007 0.419 1.00 10.87 H new ATOM 0 HB VAL A 46 23.506 -14.517 3.091 1.00 11.86 H new ATOM 0 HG11 VAL A 46 22.033 -12.827 3.809 1.00 15.17 H new ATOM 0 HG12 VAL A 46 23.210 -12.199 2.956 1.00 15.17 H new ATOM 0 HG13 VAL A 46 21.783 -12.410 2.302 1.00 15.17 H new ATOM 0 HG21 VAL A 46 21.259 -15.139 3.369 1.00 15.90 H new ATOM 0 HG22 VAL A 46 20.979 -14.795 1.848 1.00 15.90 H new ATOM 0 HG23 VAL A 46 21.930 -16.005 2.225 1.00 15.90 H new ATOM 830 N ALA A 47 25.628 -13.029 1.479 1.00 10.24 N ATOM 831 CA ALA A 47 26.540 -11.898 1.485 1.00 7.68 C ATOM 832 C ALA A 47 26.906 -11.492 0.065 1.00 11.25 C ATOM 833 O ALA A 47 26.707 -10.334 -0.348 1.00 11.52 O ATOM 834 CB ALA A 47 27.802 -12.219 2.277 1.00 12.55 C ATOM 0 H ALA A 47 25.934 -13.747 1.840 1.00 10.24 H new ATOM 0 HA ALA A 47 26.087 -11.156 1.914 1.00 7.68 H new ATOM 0 HB1 ALA A 47 28.395 -11.451 2.267 1.00 12.55 H new ATOM 0 HB2 ALA A 47 27.564 -12.432 3.193 1.00 12.55 H new ATOM 0 HB3 ALA A 47 28.252 -12.979 1.876 1.00 12.55 H new ATOM 840 N TYR A 48 27.397 -12.448 -0.714 1.00 8.80 N ATOM 841 CA TYR A 48 27.861 -12.111 -2.058 1.00 8.55 C ATOM 842 C TYR A 48 26.709 -11.838 -3.003 1.00 11.53 C ATOM 843 O TYR A 48 26.838 -10.970 -3.856 1.00 11.61 O ATOM 844 CB TYR A 48 28.773 -13.198 -2.587 1.00 10.23 C ATOM 845 CG TYR A 48 30.185 -13.064 -2.047 1.00 11.19 C ATOM 846 CD1 TYR A 48 31.044 -12.082 -2.532 1.00 9.84 C ATOM 847 CD2 TYR A 48 30.674 -13.921 -1.066 1.00 11.52 C ATOM 848 CE1 TYR A 48 32.324 -11.956 -2.053 1.00 11.93 C ATOM 849 CE2 TYR A 48 31.982 -13.798 -0.600 1.00 12.88 C ATOM 850 CZ TYR A 48 32.786 -12.793 -1.079 1.00 12.90 C ATOM 851 OH TYR A 48 34.065 -12.659 -0.629 1.00 16.15 O ATOM 0 H TYR A 48 27.470 -13.276 -0.494 1.00 8.80 H new ATOM 0 HA TYR A 48 28.371 -11.288 -2.001 1.00 8.55 H new ATOM 0 HB2 TYR A 48 28.415 -14.066 -2.344 1.00 10.23 H new ATOM 0 HB3 TYR A 48 28.793 -13.160 -3.556 1.00 10.23 H new ATOM 0 HD1 TYR A 48 30.745 -11.500 -3.193 1.00 9.84 H new ATOM 0 HD2 TYR A 48 30.122 -14.583 -0.717 1.00 11.52 H new ATOM 0 HE1 TYR A 48 32.881 -11.295 -2.395 1.00 11.93 H new ATOM 0 HE2 TYR A 48 32.309 -14.395 0.034 1.00 12.88 H new ATOM 0 HH TYR A 48 34.566 -12.443 -1.268 1.00 16.15 H new ATOM 861 N LYS A 49 25.554 -12.469 -2.812 1.00 12.05 N ATOM 862 CA LYS A 49 24.422 -12.127 -3.660 1.00 11.41 C ATOM 863 C LYS A 49 24.010 -10.659 -3.498 1.00 11.00 C ATOM 864 O LYS A 49 23.659 -9.992 -4.478 1.00 12.34 O ATOM 865 CB LYS A 49 23.241 -13.031 -3.363 1.00 12.91 C ATOM 866 CG LYS A 49 22.148 -12.836 -4.430 1.00 27.70 C ATOM 867 CD LYS A 49 21.136 -13.947 -4.475 1.00 41.87 C ATOM 868 CE LYS A 49 20.386 -13.895 -5.799 1.00 27.23 C ATOM 869 NZ LYS A 49 20.063 -12.500 -6.246 1.00 20.47 N ATOM 0 H LYS A 49 25.409 -13.075 -2.220 1.00 12.05 H new ATOM 0 HA LYS A 49 24.702 -12.258 -4.579 1.00 11.41 H new ATOM 0 HB2 LYS A 49 23.528 -13.957 -3.349 1.00 12.91 H new ATOM 0 HB3 LYS A 49 22.884 -12.831 -2.483 1.00 12.91 H new ATOM 0 HG2 LYS A 49 21.689 -11.999 -4.261 1.00 27.70 H new ATOM 0 HG3 LYS A 49 22.568 -12.758 -5.301 1.00 27.70 H new ATOM 0 HD2 LYS A 49 21.578 -14.805 -4.376 1.00 41.87 H new ATOM 0 HD3 LYS A 49 20.514 -13.861 -3.736 1.00 41.87 H new ATOM 0 HE2 LYS A 49 20.919 -14.331 -6.482 1.00 27.23 H new ATOM 0 HE3 LYS A 49 19.562 -14.400 -5.716 1.00 27.23 H new ATOM 0 HZ1 LYS A 49 19.589 -12.531 -6.999 1.00 20.47 H new ATOM 0 HZ2 LYS A 49 19.590 -12.088 -5.615 1.00 20.47 H new ATOM 0 HZ3 LYS A 49 20.818 -12.052 -6.390 1.00 20.47 H new ATOM 883 N ASN A 50 24.038 -10.139 -2.266 1.00 10.42 N ATOM 884 CA ASN A 50 23.673 -8.756 -2.049 1.00 10.88 C ATOM 885 C ASN A 50 24.742 -7.808 -2.573 1.00 12.12 C ATOM 886 O ASN A 50 24.419 -6.746 -3.102 1.00 14.08 O ATOM 887 CB ASN A 50 23.407 -8.526 -0.569 1.00 10.97 C ATOM 888 CG ASN A 50 22.012 -8.924 -0.182 1.00 19.74 C ATOM 889 OD1 ASN A 50 21.079 -8.124 -0.301 1.00 21.77 O ATOM 890 ND2 ASN A 50 21.843 -10.164 0.255 1.00 21.19 N ATOM 0 H ASN A 50 24.264 -10.572 -1.558 1.00 10.42 H new ATOM 0 HA ASN A 50 22.862 -8.567 -2.547 1.00 10.88 H new ATOM 0 HB2 ASN A 50 24.045 -9.033 -0.043 1.00 10.97 H new ATOM 0 HB3 ASN A 50 23.546 -7.590 -0.358 1.00 10.97 H new ATOM 0 HD21 ASN A 50 21.058 -10.441 0.470 1.00 21.19 H new ATOM 0 HD22 ASN A 50 22.519 -10.691 0.324 1.00 21.19 H new ATOM 897 N VAL A 51 26.010 -8.152 -2.430 1.00 11.63 N ATOM 898 CA VAL A 51 27.063 -7.301 -2.975 1.00 9.03 C ATOM 899 C VAL A 51 26.931 -7.218 -4.485 1.00 13.95 C ATOM 900 O VAL A 51 26.866 -6.126 -5.054 1.00 13.09 O ATOM 901 CB VAL A 51 28.436 -7.822 -2.559 1.00 9.03 C ATOM 902 CG1 VAL A 51 29.533 -7.113 -3.302 1.00 12.50 C ATOM 903 CG2 VAL A 51 28.665 -7.591 -1.070 1.00 11.39 C ATOM 0 H VAL A 51 26.284 -8.861 -2.028 1.00 11.63 H new ATOM 0 HA VAL A 51 26.969 -6.405 -2.616 1.00 9.03 H new ATOM 0 HB VAL A 51 28.455 -8.770 -2.765 1.00 9.03 H new ATOM 0 HG11 VAL A 51 30.393 -7.462 -3.020 1.00 12.50 H new ATOM 0 HG12 VAL A 51 29.423 -7.256 -4.255 1.00 12.50 H new ATOM 0 HG13 VAL A 51 29.492 -6.163 -3.111 1.00 12.50 H new ATOM 0 HG21 VAL A 51 29.540 -7.927 -0.821 1.00 11.39 H new ATOM 0 HG22 VAL A 51 28.617 -6.641 -0.879 1.00 11.39 H new ATOM 0 HG23 VAL A 51 27.984 -8.058 -0.561 1.00 11.39 H new ATOM 913 N VAL A 52 26.882 -8.365 -5.163 1.00 11.79 N ATOM 914 CA AVAL A 52 26.835 -8.347 -6.627 0.67 9.87 C ATOM 915 CA BVAL A 52 26.842 -8.328 -6.623 0.33 9.99 C ATOM 916 C VAL A 52 25.503 -7.773 -7.083 1.00 13.53 C ATOM 917 O VAL A 52 25.410 -7.177 -8.157 1.00 13.08 O ATOM 918 CB AVAL A 52 27.107 -9.757 -7.202 0.67 11.06 C ATOM 919 CB BVAL A 52 27.121 -9.711 -7.253 0.33 11.08 C ATOM 920 CG1AVAL A 52 25.870 -10.634 -7.174 0.67 9.51 C ATOM 921 CG1BVAL A 52 28.524 -10.159 -6.912 0.33 6.73 C ATOM 922 CG2AVAL A 52 27.610 -9.674 -8.615 0.67 14.07 C ATOM 923 CG2BVAL A 52 26.083 -10.726 -6.820 0.33 15.31 C ATOM 0 H AVAL A 52 26.875 -9.147 -4.806 0.67 11.79 H new ATOM 0 H BVAL A 52 26.871 -9.149 -4.811 0.33 11.79 H new ATOM 0 HA AVAL A 52 27.537 -7.773 -6.971 0.67 9.99 H new ATOM 0 HA BVAL A 52 27.552 -7.742 -6.928 0.33 9.99 H new ATOM 0 HB AVAL A 52 27.784 -10.158 -6.634 0.67 11.08 H new ATOM 0 HB BVAL A 52 27.056 -9.636 -8.218 0.33 11.08 H new ATOM 0 HG11AVAL A 52 26.083 -11.506 -7.542 0.67 6.73 H new ATOM 0 HG11BVAL A 52 28.692 -11.027 -7.310 0.33 6.73 H new ATOM 0 HG12AVAL A 52 25.566 -10.735 -6.259 0.67 6.73 H new ATOM 0 HG12BVAL A 52 29.162 -9.516 -7.258 0.33 6.73 H new ATOM 0 HG13AVAL A 52 25.169 -10.222 -7.704 0.67 6.73 H new ATOM 0 HG13BVAL A 52 28.619 -10.222 -5.949 0.33 6.73 H new ATOM 0 HG21AVAL A 52 27.773 -10.568 -8.954 0.67 15.31 H new ATOM 0 HG21BVAL A 52 26.279 -11.584 -7.228 0.33 15.31 H new ATOM 0 HG22AVAL A 52 26.946 -9.235 -9.170 0.67 15.31 H new ATOM 0 HG22BVAL A 52 26.101 -10.816 -5.854 0.33 15.31 H new ATOM 0 HG23AVAL A 52 28.436 -9.165 -8.635 0.67 15.31 H new ATOM 0 HG23BVAL A 52 25.203 -10.429 -7.100 0.33 15.31 H new ATOM 942 N GLY A 53 24.458 -7.926 -6.266 1.00 12.56 N ATOM 943 CA GLY A 53 23.154 -7.407 -6.622 1.00 15.30 C ATOM 944 C GLY A 53 23.159 -5.901 -6.758 1.00 16.94 C ATOM 945 O GLY A 53 22.561 -5.357 -7.686 1.00 17.09 O ATOM 0 H GLY A 53 24.491 -8.327 -5.506 1.00 12.56 H new ATOM 0 HA2 GLY A 53 22.866 -7.805 -7.458 1.00 15.30 H new ATOM 0 HA3 GLY A 53 22.508 -7.667 -5.947 1.00 15.30 H new ATOM 949 N GLY A 54 23.854 -5.209 -5.849 1.00 13.90 N ATOM 950 CA GLY A 54 23.990 -3.768 -5.967 1.00 15.63 C ATOM 951 C GLY A 54 24.798 -3.371 -7.188 1.00 14.93 C ATOM 952 O GLY A 54 24.492 -2.367 -7.856 1.00 15.67 O ATOM 0 H GLY A 54 24.247 -5.556 -5.167 1.00 13.90 H new ATOM 0 HA2 GLY A 54 23.110 -3.364 -6.018 1.00 15.63 H new ATOM 0 HA3 GLY A 54 24.417 -3.418 -5.170 1.00 15.63 H new ATOM 956 N GLN A 55 25.838 -4.133 -7.484 1.00 13.08 N ATOM 957 CA GLN A 55 26.664 -3.850 -8.653 1.00 12.64 C ATOM 958 C GLN A 55 25.892 -4.113 -9.946 1.00 13.39 C ATOM 959 O GLN A 55 26.017 -3.363 -10.917 1.00 12.41 O ATOM 960 CB GLN A 55 27.924 -4.694 -8.631 1.00 13.69 C ATOM 961 CG GLN A 55 28.818 -4.418 -7.406 1.00 16.06 C ATOM 962 CD GLN A 55 29.918 -5.424 -7.314 1.00 20.03 C ATOM 963 OE1 GLN A 55 29.707 -6.616 -7.543 1.00 18.08 O ATOM 964 NE2 GLN A 55 31.096 -4.966 -6.983 1.00 21.44 N ATOM 0 H GLN A 55 26.085 -4.817 -7.025 1.00 13.08 H new ATOM 0 HA GLN A 55 26.908 -2.912 -8.622 1.00 12.64 H new ATOM 0 HB2 GLN A 55 27.678 -5.632 -8.640 1.00 13.69 H new ATOM 0 HB3 GLN A 55 28.433 -4.526 -9.440 1.00 13.69 H new ATOM 0 HG2 GLN A 55 29.194 -3.526 -7.469 1.00 16.06 H new ATOM 0 HG3 GLN A 55 28.283 -4.443 -6.598 1.00 16.06 H new ATOM 0 HE21 GLN A 55 31.204 -4.126 -6.831 1.00 21.44 H new ATOM 0 HE22 GLN A 55 31.764 -5.504 -6.917 1.00 21.44 H new ATOM 973 N ARG A 56 25.108 -5.197 -9.987 1.00 10.90 N ATOM 974 CA ARG A 56 24.329 -5.496 -11.186 1.00 9.29 C ATOM 975 C ARG A 56 23.293 -4.418 -11.447 1.00 11.22 C ATOM 976 O ARG A 56 23.119 -3.999 -12.596 1.00 12.49 O ATOM 977 CB ARG A 56 23.661 -6.861 -11.028 1.00 11.73 C ATOM 978 CG ARG A 56 24.635 -8.045 -11.068 1.00 13.12 C ATOM 979 CD ARG A 56 23.943 -9.273 -10.511 1.00 13.63 C ATOM 980 NE ARG A 56 23.015 -9.860 -11.473 1.00 11.96 N ATOM 981 CZ ARG A 56 21.990 -10.632 -11.121 1.00 14.20 C ATOM 982 NH1 ARG A 56 21.756 -10.863 -9.846 1.00 12.24 N ATOM 983 NH2 ARG A 56 21.232 -11.175 -12.056 1.00 13.52 N ATOM 0 H ARG A 56 25.016 -5.759 -9.343 1.00 10.90 H new ATOM 0 HA ARG A 56 24.925 -5.518 -11.951 1.00 9.29 H new ATOM 0 HB2 ARG A 56 23.180 -6.879 -10.186 1.00 11.73 H new ATOM 0 HB3 ARG A 56 23.004 -6.972 -11.733 1.00 11.73 H new ATOM 0 HG2 ARG A 56 24.926 -8.209 -11.979 1.00 13.12 H new ATOM 0 HG3 ARG A 56 25.429 -7.843 -10.548 1.00 13.12 H new ATOM 0 HD2 ARG A 56 24.608 -9.933 -10.260 1.00 13.63 H new ATOM 0 HD3 ARG A 56 23.462 -9.034 -9.703 1.00 13.63 H new ATOM 0 HE ARG A 56 23.137 -9.699 -12.309 1.00 11.96 H new ATOM 0 HH11 ARG A 56 22.264 -10.516 -9.246 1.00 12.24 H new ATOM 0 HH12 ARG A 56 21.095 -11.361 -9.614 1.00 12.24 H new ATOM 0 HH21 ARG A 56 21.402 -11.029 -12.886 1.00 13.52 H new ATOM 0 HH22 ARG A 56 20.568 -11.675 -11.835 1.00 13.52 H new ATOM 997 N ALA A 57 22.644 -3.930 -10.383 1.00 11.98 N ATOM 998 CA ALA A 57 21.632 -2.898 -10.539 1.00 12.53 C ATOM 999 C ALA A 57 22.271 -1.612 -11.048 1.00 13.14 C ATOM 1000 O ALA A 57 21.743 -0.957 -11.963 1.00 13.75 O ATOM 1001 CB ALA A 57 20.909 -2.638 -9.219 1.00 13.78 C ATOM 0 H ALA A 57 22.778 -4.185 -9.573 1.00 11.98 H new ATOM 0 HA ALA A 57 20.980 -3.207 -11.187 1.00 12.53 H new ATOM 0 HB1 ALA A 57 20.240 -1.947 -9.347 1.00 13.78 H new ATOM 0 HB2 ALA A 57 20.478 -3.454 -8.920 1.00 13.78 H new ATOM 0 HB3 ALA A 57 21.549 -2.347 -8.551 1.00 13.78 H new ATOM 1007 N ALA A 58 23.427 -1.251 -10.492 1.00 13.06 N ATOM 1008 CA ALA A 58 24.143 -0.060 -10.963 1.00 14.13 C ATOM 1009 C ALA A 58 24.581 -0.205 -12.418 1.00 13.13 C ATOM 1010 O ALA A 58 24.451 0.730 -13.231 1.00 13.39 O ATOM 1011 CB ALA A 58 25.354 0.191 -10.065 1.00 12.16 C ATOM 0 H ALA A 58 23.811 -1.674 -9.849 1.00 13.06 H new ATOM 0 HA ALA A 58 23.539 0.698 -10.917 1.00 14.13 H new ATOM 0 HB1 ALA A 58 25.829 0.978 -10.375 1.00 12.16 H new ATOM 0 HB2 ALA A 58 25.057 0.331 -9.152 1.00 12.16 H new ATOM 0 HB3 ALA A 58 25.946 -0.577 -10.097 1.00 12.16 H new ATOM 1017 N TRP A 59 25.151 -1.362 -12.752 1.00 11.35 N ATOM 1018 CA TRP A 59 25.600 -1.607 -14.111 1.00 10.93 C ATOM 1019 C TRP A 59 24.452 -1.451 -15.096 1.00 14.54 C ATOM 1020 O TRP A 59 24.645 -0.896 -16.179 1.00 13.70 O ATOM 1021 CB TRP A 59 26.231 -2.990 -14.209 1.00 10.53 C ATOM 1022 CG TRP A 59 26.813 -3.277 -15.546 1.00 11.65 C ATOM 1023 CD1 TRP A 59 28.107 -3.091 -15.915 1.00 13.82 C ATOM 1024 CD2 TRP A 59 26.139 -3.811 -16.702 1.00 9.48 C ATOM 1025 NE1 TRP A 59 28.295 -3.488 -17.216 1.00 14.16 N ATOM 1026 CE2 TRP A 59 27.101 -3.906 -17.730 1.00 15.06 C ATOM 1027 CE3 TRP A 59 24.822 -4.188 -16.972 1.00 13.95 C ATOM 1028 CZ2 TRP A 59 26.803 -4.393 -19.006 1.00 13.74 C ATOM 1029 CZ3 TRP A 59 24.533 -4.696 -18.248 1.00 13.63 C ATOM 1030 CH2 TRP A 59 25.515 -4.778 -19.228 1.00 14.75 C ATOM 0 H TRP A 59 25.284 -2.013 -12.206 1.00 11.35 H new ATOM 0 HA TRP A 59 26.273 -0.948 -14.343 1.00 10.93 H new ATOM 0 HB2 TRP A 59 26.926 -3.070 -13.537 1.00 10.53 H new ATOM 0 HB3 TRP A 59 25.560 -3.660 -14.005 1.00 10.53 H new ATOM 0 HD1 TRP A 59 28.771 -2.744 -15.365 1.00 13.82 H new ATOM 0 HE1 TRP A 59 29.044 -3.475 -17.639 1.00 14.16 H new ATOM 0 HE3 TRP A 59 24.157 -4.105 -16.327 1.00 13.95 H new ATOM 0 HZ2 TRP A 59 27.451 -4.451 -19.670 1.00 13.74 H new ATOM 0 HZ3 TRP A 59 23.670 -4.983 -18.441 1.00 13.63 H new ATOM 0 HH2 TRP A 59 25.284 -5.108 -20.066 1.00 14.75 H new ATOM 1041 N ARG A 60 23.263 -1.952 -14.743 1.00 13.01 N ATOM 1042 CA AARG A 60 22.121 -1.859 -15.641 0.45 11.71 C ATOM 1043 CA BARG A 60 22.126 -1.857 -15.647 0.55 11.69 C ATOM 1044 C ARG A 60 21.721 -0.406 -15.867 1.00 15.37 C ATOM 1045 O ARG A 60 21.389 -0.018 -16.989 1.00 16.11 O ATOM 1046 CB AARG A 60 20.938 -2.649 -15.085 0.45 15.79 C ATOM 1047 CB BARG A 60 20.959 -2.668 -15.099 0.55 15.88 C ATOM 1048 CG AARG A 60 21.141 -4.171 -15.067 0.45 20.09 C ATOM 1049 CG BARG A 60 21.170 -4.180 -15.252 0.55 22.09 C ATOM 1050 CD AARG A 60 19.817 -4.901 -14.805 0.45 24.87 C ATOM 1051 CD BARG A 60 20.358 -4.968 -14.240 0.55 25.02 C ATOM 1052 NE AARG A 60 19.021 -4.224 -13.786 0.45 29.87 N ATOM 1053 NE BARG A 60 20.499 -6.408 -14.456 0.55 20.79 N ATOM 1054 CZ AARG A 60 18.903 -4.612 -12.519 0.45 30.18 C ATOM 1055 CZ BARG A 60 20.049 -7.338 -13.623 0.55 39.74 C ATOM 1056 NH1AARG A 60 19.524 -5.702 -12.086 0.45 35.44 N ATOM 1057 NH1BARG A 60 19.440 -6.988 -12.503 0.55 39.36 N ATOM 1058 NH2AARG A 60 18.156 -3.904 -11.682 0.45 14.53 N ATOM 1059 NH2BARG A 60 20.214 -8.619 -13.915 0.55 42.43 N ATOM 0 H AARG A 60 23.103 -2.345 -13.995 0.45 13.01 H new ATOM 0 H BARG A 60 23.101 -2.344 -13.995 0.55 13.01 H new ATOM 0 HA AARG A 60 22.380 -2.241 -16.494 0.45 11.69 H new ATOM 0 HA BARG A 60 22.384 -2.223 -16.507 0.55 11.69 H new ATOM 0 HB2AARG A 60 20.759 -2.347 -14.181 0.45 15.88 H new ATOM 0 HB2BARG A 60 20.834 -2.455 -14.161 0.55 15.88 H new ATOM 0 HB3AARG A 60 20.151 -2.445 -15.614 0.45 15.88 H new ATOM 0 HB3BARG A 60 20.145 -2.410 -15.560 0.55 15.88 H new ATOM 0 HG2AARG A 60 21.511 -4.461 -15.915 0.45 22.09 H new ATOM 0 HG2BARG A 60 20.921 -4.452 -16.149 0.55 22.09 H new ATOM 0 HG3AARG A 60 21.785 -4.406 -14.381 0.45 22.09 H new ATOM 0 HG3BARG A 60 22.111 -4.388 -15.144 0.55 22.09 H new ATOM 0 HD2AARG A 60 19.309 -4.956 -15.629 0.45 25.02 H new ATOM 0 HD2BARG A 60 20.649 -4.743 -13.342 0.55 25.02 H new ATOM 0 HD3AARG A 60 19.999 -5.811 -14.522 0.45 25.02 H new ATOM 0 HD3BARG A 60 19.423 -4.718 -14.306 0.55 25.02 H new ATOM 0 HE AARG A 60 18.593 -3.517 -14.024 0.45 20.79 H new ATOM 0 HE BARG A 60 20.900 -6.669 -15.170 0.55 20.79 H new ATOM 0 HH11AARG A 60 20.008 -6.164 -12.626 0.45 39.36 H new ATOM 0 HH11BARG A 60 19.335 -6.156 -12.313 0.55 39.36 H new ATOM 0 HH12AARG A 60 19.443 -5.946 -11.265 0.45 39.36 H new ATOM 0 HH12BARG A 60 19.149 -7.592 -11.965 0.55 39.36 H new ATOM 0 HH21AARG A 60 17.751 -3.198 -11.959 0.45 42.43 H new ATOM 0 HH21BARG A 60 20.612 -8.846 -14.643 0.55 42.43 H new ATOM 0 HH22AARG A 60 18.077 -4.151 -10.862 0.45 42.43 H new ATOM 0 HH22BARG A 60 19.923 -9.224 -13.377 0.55 42.43 H new ATOM 1086 N VAL A 61 21.744 0.404 -14.806 1.00 14.01 N ATOM 1087 CA VAL A 61 21.416 1.822 -14.937 1.00 17.08 C ATOM 1088 C VAL A 61 22.410 2.498 -15.868 1.00 17.30 C ATOM 1089 O VAL A 61 22.024 3.221 -16.796 1.00 15.01 O ATOM 1090 CB VAL A 61 21.406 2.503 -13.559 1.00 13.03 C ATOM 1091 CG1 VAL A 61 21.404 4.048 -13.689 1.00 14.77 C ATOM 1092 CG2 VAL A 61 20.218 2.081 -12.727 1.00 15.77 C ATOM 0 H VAL A 61 21.945 0.153 -14.008 1.00 14.01 H new ATOM 0 HA VAL A 61 20.528 1.906 -15.318 1.00 17.08 H new ATOM 0 HB VAL A 61 22.218 2.218 -13.112 1.00 13.03 H new ATOM 0 HG11 VAL A 61 21.398 4.447 -12.805 1.00 14.77 H new ATOM 0 HG12 VAL A 61 22.198 4.334 -14.167 1.00 14.77 H new ATOM 0 HG13 VAL A 61 20.615 4.331 -14.177 1.00 14.77 H new ATOM 0 HG21 VAL A 61 20.248 2.531 -11.868 1.00 15.77 H new ATOM 0 HG22 VAL A 61 19.399 2.320 -13.188 1.00 15.77 H new ATOM 0 HG23 VAL A 61 20.243 1.121 -12.590 1.00 15.77 H new ATOM 1102 N LEU A 62 23.708 2.264 -15.638 1.00 13.10 N ATOM 1103 CA LEU A 62 24.747 2.910 -16.427 1.00 12.50 C ATOM 1104 C LEU A 62 24.736 2.419 -17.872 1.00 15.03 C ATOM 1105 O LEU A 62 24.927 3.216 -18.804 1.00 14.64 O ATOM 1106 CB LEU A 62 26.106 2.692 -15.768 1.00 12.87 C ATOM 1107 CG LEU A 62 26.197 3.288 -14.388 1.00 11.29 C ATOM 1108 CD1 LEU A 62 27.511 2.859 -13.732 1.00 15.43 C ATOM 1109 CD2 LEU A 62 26.121 4.823 -14.414 1.00 14.90 C ATOM 0 H LEU A 62 24.001 1.733 -15.028 1.00 13.10 H new ATOM 0 HA LEU A 62 24.569 3.863 -16.455 1.00 12.50 H new ATOM 0 HB2 LEU A 62 26.285 1.740 -15.715 1.00 12.87 H new ATOM 0 HB3 LEU A 62 26.797 3.080 -16.328 1.00 12.87 H new ATOM 0 HG LEU A 62 25.439 2.962 -13.878 1.00 11.29 H new ATOM 0 HD11 LEU A 62 27.570 3.243 -12.843 1.00 15.43 H new ATOM 0 HD12 LEU A 62 27.540 1.892 -13.668 1.00 15.43 H new ATOM 0 HD13 LEU A 62 28.257 3.170 -14.268 1.00 15.43 H new ATOM 0 HD21 LEU A 62 26.183 5.166 -13.509 1.00 14.90 H new ATOM 0 HD22 LEU A 62 26.854 5.175 -14.943 1.00 14.90 H new ATOM 0 HD23 LEU A 62 25.278 5.099 -14.807 1.00 14.90 H new ATOM 1121 N SER A 63 24.505 1.114 -18.082 1.00 14.30 N ATOM 1122 CA ASER A 63 24.462 0.575 -19.435 0.69 15.96 C ATOM 1123 CA BSER A 63 24.466 0.583 -19.437 0.31 15.95 C ATOM 1124 C SER A 63 23.311 1.179 -20.224 1.00 15.16 C ATOM 1125 O SER A 63 23.445 1.450 -21.417 1.00 16.83 O ATOM 1126 CB ASER A 63 24.359 -0.955 -19.376 0.69 17.57 C ATOM 1127 CB BSER A 63 24.371 -0.942 -19.402 0.31 17.53 C ATOM 1128 OG ASER A 63 24.336 -1.518 -20.666 0.69 17.55 O ATOM 1129 OG BSER A 63 25.579 -1.496 -18.937 0.31 12.28 O ATOM 0 H ASER A 63 24.373 0.537 -17.458 0.69 14.30 H new ATOM 0 H BSER A 63 24.372 0.535 -17.460 0.31 14.30 H new ATOM 0 HA ASER A 63 25.281 0.812 -19.897 0.69 15.95 H new ATOM 0 HA BSER A 63 25.288 0.832 -19.887 0.31 15.95 H new ATOM 0 HB2ASER A 63 25.111 -1.313 -18.878 0.69 17.53 H new ATOM 0 HB2BSER A 63 23.640 -1.214 -18.825 0.31 17.53 H new ATOM 0 HB3ASER A 63 23.555 -1.209 -18.896 0.69 17.53 H new ATOM 0 HB3BSER A 63 24.173 -1.280 -20.289 0.31 17.53 H new ATOM 0 HG ASER A 63 24.581 -2.320 -20.626 0.69 12.28 H new ATOM 0 HG BSER A 63 25.503 -2.331 -18.886 0.31 12.28 H new ATOM 1140 N SER A 64 22.184 1.399 -19.573 1.00 13.59 N ATOM 1141 CA ASER A 64 21.040 2.016 -20.235 0.59 16.94 C ATOM 1142 CA BSER A 64 21.044 2.013 -20.245 0.41 17.01 C ATOM 1143 C SER A 64 21.349 3.453 -20.647 1.00 21.89 C ATOM 1144 O SER A 64 21.020 3.879 -21.769 1.00 20.14 O ATOM 1145 CB ASER A 64 19.823 1.978 -19.317 0.59 20.18 C ATOM 1146 CB BSER A 64 19.814 1.956 -19.343 0.41 20.15 C ATOM 1147 OG ASER A 64 18.716 2.637 -19.913 0.59 27.76 O ATOM 1148 OG BSER A 64 19.405 0.615 -19.132 0.41 31.31 O ATOM 0 H ASER A 64 22.056 1.200 -18.746 0.59 13.59 H new ATOM 0 H BSER A 64 22.054 1.203 -18.746 0.41 13.59 H new ATOM 0 HA ASER A 64 20.847 1.511 -21.040 0.59 17.01 H new ATOM 0 HA BSER A 64 20.863 1.513 -21.056 0.41 17.01 H new ATOM 0 HB2ASER A 64 19.589 1.057 -19.122 0.59 20.15 H new ATOM 0 HB2BSER A 64 20.013 2.376 -18.491 0.41 20.15 H new ATOM 0 HB3ASER A 64 20.038 2.401 -18.471 0.59 20.15 H new ATOM 0 HB3BSER A 64 19.089 2.460 -19.745 0.41 20.15 H new ATOM 0 HG ASER A 64 18.194 2.908 -19.313 0.59 31.31 H new ATOM 0 HG BSER A 64 19.814 0.298 -18.470 0.41 31.31 H new ATOM 1159 N ILE A 65 21.992 4.210 -19.759 1.00 15.02 N ATOM 1160 CA ILE A 65 22.397 5.579 -20.098 1.00 17.65 C ATOM 1161 C ILE A 65 23.371 5.550 -21.269 1.00 21.82 C ATOM 1162 O ILE A 65 23.259 6.335 -22.221 1.00 24.32 O ATOM 1163 CB ILE A 65 22.994 6.270 -18.861 1.00 14.70 C ATOM 1164 CG1 ILE A 65 21.950 6.407 -17.761 1.00 15.10 C ATOM 1165 CG2 ILE A 65 23.641 7.639 -19.253 1.00 18.48 C ATOM 1166 CD1 ILE A 65 22.529 6.799 -16.393 1.00 19.26 C ATOM 0 H ILE A 65 22.202 3.956 -18.965 1.00 15.02 H new ATOM 0 HA ILE A 65 21.624 6.096 -20.373 1.00 17.65 H new ATOM 0 HB ILE A 65 23.704 5.715 -18.503 1.00 14.70 H new ATOM 0 HG12 ILE A 65 21.298 7.073 -18.028 1.00 15.10 H new ATOM 0 HG13 ILE A 65 21.476 5.566 -17.672 1.00 15.10 H new ATOM 0 HG21 ILE A 65 24.012 8.060 -18.462 1.00 18.48 H new ATOM 0 HG22 ILE A 65 24.348 7.490 -19.901 1.00 18.48 H new ATOM 0 HG23 ILE A 65 22.965 8.217 -19.640 1.00 18.48 H new ATOM 0 HD11 ILE A 65 21.811 6.868 -15.745 1.00 19.26 H new ATOM 0 HD12 ILE A 65 23.162 6.123 -16.103 1.00 19.26 H new ATOM 0 HD13 ILE A 65 22.981 7.654 -16.466 1.00 19.26 H new ATOM 1178 N GLU A 66 24.314 4.612 -21.243 1.00 15.81 N ATOM 1179 CA GLU A 66 25.299 4.524 -22.304 1.00 14.78 C ATOM 1180 C GLU A 66 24.622 4.207 -23.632 1.00 23.66 C ATOM 1181 O GLU A 66 24.972 4.780 -24.673 1.00 27.59 O ATOM 1182 CB GLU A 66 26.342 3.468 -21.951 1.00 19.61 C ATOM 1183 CG GLU A 66 27.547 3.429 -22.866 1.00 18.03 C ATOM 1184 CD GLU A 66 28.549 2.383 -22.458 1.00 23.83 C ATOM 1185 OE1 GLU A 66 28.187 1.558 -21.596 1.00 28.09 O ATOM 1186 OE2 GLU A 66 29.680 2.358 -23.016 1.00 22.87 O ATOM 0 H GLU A 66 24.397 4.023 -20.622 1.00 15.81 H new ATOM 0 HA GLU A 66 25.747 5.379 -22.397 1.00 14.78 H new ATOM 0 HB2 GLU A 66 26.647 3.624 -21.043 1.00 19.61 H new ATOM 0 HB3 GLU A 66 25.917 2.596 -21.961 1.00 19.61 H new ATOM 0 HG2 GLU A 66 27.254 3.255 -23.774 1.00 18.03 H new ATOM 0 HG3 GLU A 66 27.976 4.299 -22.868 1.00 18.03 H new ATOM 1193 N GLN A 67 23.652 3.291 -23.624 1.00 22.08 N ATOM 1194 CA GLN A 67 22.993 2.915 -24.874 1.00 29.40 C ATOM 1195 C GLN A 67 22.186 4.077 -25.435 1.00 29.74 C ATOM 1196 O GLN A 67 22.173 4.299 -26.651 1.00 37.06 O ATOM 1197 CB GLN A 67 22.098 1.704 -24.660 1.00 29.42 C ATOM 1198 CG GLN A 67 22.862 0.409 -24.412 1.00 37.12 C ATOM 1199 CD GLN A 67 23.836 0.057 -25.530 1.00 85.81 C ATOM 1200 OE1 GLN A 67 23.444 -0.096 -26.689 1.00 92.64 O ATOM 1201 NE2 GLN A 67 25.117 -0.062 -25.184 1.00 71.59 N ATOM 0 H GLN A 67 23.366 2.884 -22.922 1.00 22.08 H new ATOM 0 HA GLN A 67 23.680 2.684 -25.519 1.00 29.40 H new ATOM 0 HB2 GLN A 67 21.513 1.874 -23.905 1.00 29.42 H new ATOM 0 HB3 GLN A 67 21.530 1.591 -25.438 1.00 29.42 H new ATOM 0 HG2 GLN A 67 23.351 0.485 -23.578 1.00 37.12 H new ATOM 0 HG3 GLN A 67 22.228 -0.317 -24.304 1.00 37.12 H new ATOM 0 HE21 GLN A 67 25.354 0.052 -24.365 1.00 71.59 H new ATOM 0 HE22 GLN A 67 25.707 -0.253 -25.780 1.00 71.59 H new ATOM 1210 N LYS A 68 21.520 4.841 -24.570 1.00 22.85 N ATOM 1211 CA LYS A 68 20.801 6.020 -25.050 1.00 28.96 C ATOM 1212 C LYS A 68 21.758 7.036 -25.661 1.00 46.93 C ATOM 1213 O LYS A 68 21.438 7.677 -26.672 1.00 34.41 O ATOM 1214 CB LYS A 68 20.002 6.650 -23.921 1.00 30.61 C ATOM 1215 CG LYS A 68 18.850 5.781 -23.445 1.00 49.04 C ATOM 1216 CD LYS A 68 17.894 6.564 -22.553 1.00 56.67 C ATOM 1217 CE LYS A 68 16.782 5.669 -22.011 1.00 79.50 C ATOM 1218 NZ LYS A 68 17.291 4.633 -21.061 1.00 68.45 N ATOM 0 H LYS A 68 21.472 4.700 -23.723 1.00 22.85 H new ATOM 0 HA LYS A 68 20.186 5.735 -25.744 1.00 28.96 H new ATOM 0 HB2 LYS A 68 20.594 6.829 -23.174 1.00 30.61 H new ATOM 0 HB3 LYS A 68 19.653 7.505 -24.218 1.00 30.61 H new ATOM 0 HG2 LYS A 68 18.368 5.432 -24.211 1.00 49.04 H new ATOM 0 HG3 LYS A 68 19.198 5.018 -22.958 1.00 49.04 H new ATOM 0 HD2 LYS A 68 18.385 6.956 -21.814 1.00 56.67 H new ATOM 0 HD3 LYS A 68 17.506 7.297 -23.056 1.00 56.67 H new ATOM 0 HE2 LYS A 68 16.120 6.217 -21.562 1.00 79.50 H new ATOM 0 HE3 LYS A 68 16.333 5.232 -22.751 1.00 79.50 H new ATOM 0 HZ1 LYS A 68 16.605 4.253 -20.640 1.00 68.45 H new ATOM 0 HZ2 LYS A 68 17.743 4.013 -21.512 1.00 68.45 H new ATOM 0 HZ3 LYS A 68 17.829 5.016 -20.464 1.00 68.45 H new ATOM 1232 N SER A 69 22.950 7.180 -25.075 1.00 31.73 N ATOM 1233 CA SER A 69 23.928 8.124 -25.602 1.00 40.47 C ATOM 1234 C SER A 69 24.402 7.750 -26.997 1.00 42.01 C ATOM 1235 O SER A 69 25.019 8.582 -27.670 1.00 42.57 O ATOM 1236 CB SER A 69 25.143 8.200 -24.683 1.00 39.60 C ATOM 1237 OG SER A 69 25.986 7.075 -24.913 1.00 37.35 O ATOM 0 H SER A 69 23.206 6.744 -24.379 1.00 31.73 H new ATOM 0 HA SER A 69 23.482 8.984 -25.649 1.00 40.47 H new ATOM 0 HB2 SER A 69 25.633 9.021 -24.846 1.00 39.60 H new ATOM 0 HB3 SER A 69 24.858 8.218 -23.756 1.00 39.60 H new ATOM 0 HG SER A 69 25.618 6.383 -24.612 1.00 37.35 H new ATOM 1243 N ASN A 70 24.140 6.522 -27.440 1.00 40.97 N ATOM 1244 CA ASN A 70 24.577 6.042 -28.744 1.00 50.83 C ATOM 1245 C ASN A 70 23.449 6.004 -29.769 1.00 41.32 C ATOM 1246 O ASN A 70 23.629 5.436 -30.852 1.00 55.71 O ATOM 1247 CB ASN A 70 25.202 4.649 -28.605 1.00 52.36 C ATOM 1248 CG ASN A 70 26.497 4.672 -27.807 1.00 51.79 C ATOM 1249 OD1 ASN A 70 27.299 5.596 -27.939 1.00 54.47 O ATOM 1250 ND2 ASN A 70 26.703 3.665 -26.969 1.00 49.12 N ATOM 0 H ASN A 70 23.699 5.940 -26.986 1.00 40.97 H new ATOM 0 HA ASN A 70 25.237 6.673 -29.071 1.00 50.83 H new ATOM 0 HB2 ASN A 70 24.569 4.055 -28.172 1.00 52.36 H new ATOM 0 HB3 ASN A 70 25.375 4.285 -29.487 1.00 52.36 H new ATOM 0 HD21 ASN A 70 27.419 3.642 -26.493 1.00 49.12 H new ATOM 0 HD22 ASN A 70 26.121 3.035 -26.902 1.00 49.12 H new ATOM 1257 N GLU A 71 22.300 6.596 -29.461 1.00 35.56 N ATOM 1258 CA GLU A 71 21.225 6.699 -30.435 1.00 37.90 C ATOM 1259 C GLU A 71 21.444 7.930 -31.312 1.00 67.98 C ATOM 1260 O GLU A 71 22.197 8.842 -30.962 1.00 40.54 O ATOM 1261 CB GLU A 71 19.866 6.793 -29.742 1.00 46.83 C ATOM 1262 CG GLU A 71 19.510 5.580 -28.894 1.00 45.15 C ATOM 1263 CD GLU A 71 18.133 5.704 -28.258 1.00 61.94 C ATOM 1264 OE1 GLU A 71 17.408 6.667 -28.585 1.00 86.35 O ATOM 1265 OE2 GLU A 71 17.775 4.838 -27.432 1.00 72.42 O ATOM 0 H GLU A 71 22.125 6.943 -28.694 1.00 35.56 H new ATOM 0 HA GLU A 71 21.232 5.900 -30.985 1.00 37.90 H new ATOM 0 HB2 GLU A 71 19.856 7.583 -29.179 1.00 46.83 H new ATOM 0 HB3 GLU A 71 19.179 6.916 -30.416 1.00 46.83 H new ATOM 0 HG2 GLU A 71 19.539 4.783 -29.446 1.00 45.15 H new ATOM 0 HG3 GLU A 71 20.176 5.468 -28.198 1.00 45.15 H new ATOM 1272 N GLU A 72 20.774 7.953 -32.463 1.00 66.02 N ATOM 1273 CA GLU A 72 20.866 9.108 -33.346 1.00 72.00 C ATOM 1274 C GLU A 72 20.182 10.310 -32.706 1.00 61.65 C ATOM 1275 O GLU A 72 19.097 10.192 -32.126 1.00 46.72 O ATOM 1276 CB GLU A 72 20.235 8.803 -34.705 1.00 71.61 C ATOM 1277 CG GLU A 72 20.350 9.959 -35.702 1.00 90.58 C ATOM 1278 CD GLU A 72 19.952 9.571 -37.117 1.00100.12 C ATOM 1279 OE1 GLU A 72 19.737 8.366 -37.369 1.00 95.82 O ATOM 1280 OE2 GLU A 72 19.856 10.473 -37.978 1.00 80.01 O ATOM 0 H GLU A 72 20.268 7.318 -32.746 1.00 66.02 H new ATOM 0 HA GLU A 72 21.804 9.314 -33.485 1.00 72.00 H new ATOM 0 HB2 GLU A 72 20.659 8.016 -35.082 1.00 71.61 H new ATOM 0 HB3 GLU A 72 19.298 8.586 -34.578 1.00 71.61 H new ATOM 0 HG2 GLU A 72 19.789 10.692 -35.404 1.00 90.58 H new ATOM 0 HG3 GLU A 72 21.264 10.284 -35.707 1.00 90.58 H new ATOM 1287 N GLY A 73 20.829 11.474 -32.810 1.00 52.03 N ATOM 1288 CA GLY A 73 20.327 12.692 -32.214 1.00 57.92 C ATOM 1289 C GLY A 73 20.821 12.959 -30.811 1.00 71.23 C ATOM 1290 O GLY A 73 20.570 14.049 -30.273 1.00 55.70 O ATOM 0 H GLY A 73 21.573 11.570 -33.231 1.00 52.03 H new ATOM 0 HA2 GLY A 73 20.575 13.440 -32.779 1.00 57.92 H new ATOM 0 HA3 GLY A 73 19.358 12.656 -32.201 1.00 57.92 H new ATOM 1294 N SER A 74 21.516 12.004 -30.200 1.00 45.56 N ATOM 1295 CA SER A 74 22.039 12.185 -28.852 1.00 33.39 C ATOM 1296 C SER A 74 23.312 13.014 -28.896 1.00 27.71 C ATOM 1297 O SER A 74 24.229 12.724 -29.669 1.00 47.71 O ATOM 1298 CB SER A 74 22.305 10.828 -28.196 1.00 47.33 C ATOM 1299 OG SER A 74 21.131 10.031 -28.193 1.00 54.21 O ATOM 0 H SER A 74 21.696 11.240 -30.552 1.00 45.56 H new ATOM 0 HA SER A 74 21.379 12.656 -28.320 1.00 33.39 H new ATOM 0 HB2 SER A 74 23.013 10.367 -28.673 1.00 47.33 H new ATOM 0 HB3 SER A 74 22.614 10.959 -27.286 1.00 47.33 H new ATOM 0 HG SER A 74 21.257 9.348 -27.721 1.00 54.21 H new ATOM 1305 N GLU A 75 23.364 14.056 -28.073 1.00 31.20 N ATOM 1306 CA GLU A 75 24.525 14.929 -28.038 1.00 59.20 C ATOM 1307 C GLU A 75 25.723 14.183 -27.451 1.00 53.57 C ATOM 1308 O GLU A 75 25.591 13.328 -26.572 1.00 42.26 O ATOM 1309 CB GLU A 75 24.216 16.186 -27.218 1.00 37.08 C ATOM 1310 CG GLU A 75 25.264 17.277 -27.341 1.00 44.32 C ATOM 1311 CD GLU A 75 25.343 17.848 -28.737 1.00 31.13 C ATOM 1312 OE1 GLU A 75 24.282 17.915 -29.419 1.00 34.55 O ATOM 1313 OE2 GLU A 75 26.460 18.217 -29.172 1.00 76.47 O ATOM 0 H GLU A 75 22.736 14.273 -27.527 1.00 31.20 H new ATOM 0 HA GLU A 75 24.744 15.201 -28.943 1.00 59.20 H new ATOM 0 HB2 GLU A 75 23.358 16.541 -27.499 1.00 37.08 H new ATOM 0 HB3 GLU A 75 24.128 15.938 -26.284 1.00 37.08 H new ATOM 0 HG2 GLU A 75 25.060 17.989 -26.715 1.00 44.32 H new ATOM 0 HG3 GLU A 75 26.130 16.919 -27.092 1.00 44.32 H new ATOM 1320 N GLU A 76 26.906 14.497 -27.971 1.00 45.06 N ATOM 1321 CA GLU A 76 28.137 13.928 -27.437 1.00 35.76 C ATOM 1322 C GLU A 76 28.407 14.477 -26.044 1.00 54.19 C ATOM 1323 O GLU A 76 28.290 15.682 -25.798 1.00 76.62 O ATOM 1324 CB GLU A 76 29.322 14.244 -28.351 1.00 54.56 C ATOM 1325 CG GLU A 76 30.672 13.818 -27.789 1.00 48.82 C ATOM 1326 CD GLU A 76 30.749 12.319 -27.538 1.00 82.97 C ATOM 1327 OE1 GLU A 76 30.091 11.553 -28.279 1.00 86.55 O ATOM 1328 OE2 GLU A 76 31.459 11.909 -26.593 1.00 61.21 O ATOM 0 H GLU A 76 27.017 15.036 -28.632 1.00 45.06 H new ATOM 0 HA GLU A 76 28.029 12.965 -27.388 1.00 35.76 H new ATOM 0 HB2 GLU A 76 29.185 13.805 -29.205 1.00 54.56 H new ATOM 0 HB3 GLU A 76 29.340 15.199 -28.522 1.00 54.56 H new ATOM 0 HG2 GLU A 76 31.373 14.076 -28.408 1.00 48.82 H new ATOM 0 HG3 GLU A 76 30.838 14.291 -26.959 1.00 48.82 H new ATOM 1335 N LYS A 77 28.790 13.586 -25.133 1.00 31.00 N ATOM 1336 CA LYS A 77 29.067 13.975 -23.759 1.00 32.55 C ATOM 1337 C LYS A 77 30.454 13.556 -23.291 1.00 56.11 C ATOM 1338 O LYS A 77 30.810 13.823 -22.131 1.00 50.46 O ATOM 1339 CB LYS A 77 28.009 13.389 -22.810 1.00 54.42 C ATOM 1340 CG LYS A 77 26.595 13.861 -23.096 1.00 73.34 C ATOM 1341 CD LYS A 77 26.416 15.335 -22.762 1.00 59.79 C ATOM 1342 CE LYS A 77 25.121 15.876 -23.351 1.00 64.50 C ATOM 1343 NZ LYS A 77 23.983 14.983 -23.043 1.00 54.59 N ATOM 0 H LYS A 77 28.895 12.748 -25.294 1.00 31.00 H new ATOM 0 HA LYS A 77 29.033 14.944 -23.738 1.00 32.55 H new ATOM 0 HB2 LYS A 77 28.035 12.421 -22.869 1.00 54.42 H new ATOM 0 HB3 LYS A 77 28.240 13.624 -21.898 1.00 54.42 H new ATOM 0 HG2 LYS A 77 26.387 13.713 -24.032 1.00 73.34 H new ATOM 0 HG3 LYS A 77 25.966 13.333 -22.579 1.00 73.34 H new ATOM 0 HD2 LYS A 77 26.411 15.453 -21.799 1.00 59.79 H new ATOM 0 HD3 LYS A 77 27.168 15.842 -23.106 1.00 59.79 H new ATOM 0 HE2 LYS A 77 24.946 16.762 -22.997 1.00 64.50 H new ATOM 0 HE3 LYS A 77 25.213 15.968 -24.312 1.00 64.50 H new ATOM 0 HZ1 LYS A 77 23.219 15.421 -23.171 1.00 54.59 H new ATOM 0 HZ2 LYS A 77 24.010 14.272 -23.577 1.00 54.59 H new ATOM 0 HZ3 LYS A 77 24.034 14.718 -22.195 1.00 54.59 H new ATOM 1357 N GLY A 78 31.241 12.908 -24.149 1.00 31.66 N ATOM 1358 CA GLY A 78 32.579 12.510 -23.786 1.00 21.71 C ATOM 1359 C GLY A 78 32.627 11.091 -23.269 1.00 16.77 C ATOM 1360 O GLY A 78 31.656 10.340 -23.356 1.00 19.96 O ATOM 0 H GLY A 78 31.009 12.693 -24.949 1.00 31.66 H new ATOM 0 HA2 GLY A 78 33.161 12.592 -24.558 1.00 21.71 H new ATOM 0 HA3 GLY A 78 32.922 13.112 -23.107 1.00 21.71 H new ATOM 1364 N PRO A 79 33.779 10.708 -22.722 1.00 16.07 N ATOM 1365 CA PRO A 79 34.005 9.316 -22.336 1.00 13.00 C ATOM 1366 C PRO A 79 33.467 8.938 -20.961 1.00 12.62 C ATOM 1367 O PRO A 79 33.611 7.780 -20.583 1.00 12.68 O ATOM 1368 CB PRO A 79 35.541 9.218 -22.367 1.00 16.17 C ATOM 1369 CG PRO A 79 36.000 10.570 -21.969 1.00 19.90 C ATOM 1370 CD PRO A 79 34.999 11.529 -22.582 1.00 18.44 C ATOM 0 HA PRO A 79 33.537 8.705 -22.926 1.00 13.00 H new ATOM 0 HB2 PRO A 79 35.865 8.539 -21.755 1.00 16.17 H new ATOM 0 HB3 PRO A 79 35.863 8.980 -23.250 1.00 16.17 H new ATOM 0 HG2 PRO A 79 36.026 10.661 -21.004 1.00 19.90 H new ATOM 0 HG3 PRO A 79 36.897 10.745 -22.294 1.00 19.90 H new ATOM 0 HD2 PRO A 79 34.848 12.300 -22.013 1.00 18.44 H new ATOM 0 HD3 PRO A 79 35.304 11.865 -23.439 1.00 18.44 H new ATOM 1378 N GLU A 80 32.850 9.858 -20.220 1.00 12.70 N ATOM 1379 CA GLU A 80 32.597 9.628 -18.797 1.00 13.07 C ATOM 1380 C GLU A 80 31.628 8.476 -18.558 1.00 11.15 C ATOM 1381 O GLU A 80 31.810 7.715 -17.609 1.00 12.97 O ATOM 1382 CB GLU A 80 32.087 10.905 -18.116 1.00 12.90 C ATOM 1383 CG GLU A 80 33.170 12.001 -18.004 1.00 17.95 C ATOM 1384 CD GLU A 80 33.334 12.899 -19.248 1.00 24.49 C ATOM 1385 OE1 GLU A 80 32.615 12.731 -20.265 1.00 15.33 O ATOM 1386 OE2 GLU A 80 34.186 13.816 -19.194 1.00 21.66 O ATOM 0 H GLU A 80 32.572 10.615 -20.518 1.00 12.70 H new ATOM 0 HA GLU A 80 33.446 9.379 -18.400 1.00 13.07 H new ATOM 0 HB2 GLU A 80 31.332 11.253 -18.616 1.00 12.90 H new ATOM 0 HB3 GLU A 80 31.763 10.685 -17.229 1.00 12.90 H new ATOM 0 HG2 GLU A 80 32.961 12.564 -17.243 1.00 17.95 H new ATOM 0 HG3 GLU A 80 34.021 11.575 -17.817 1.00 17.95 H new ATOM 1393 N VAL A 81 30.545 8.391 -19.323 1.00 13.20 N ATOM 1394 CA VAL A 81 29.563 7.332 -19.095 1.00 14.59 C ATOM 1395 C VAL A 81 30.208 5.969 -19.317 1.00 14.05 C ATOM 1396 O VAL A 81 30.094 5.071 -18.478 1.00 12.39 O ATOM 1397 CB VAL A 81 28.342 7.541 -20.002 1.00 16.17 C ATOM 1398 CG1 VAL A 81 27.391 6.331 -19.884 1.00 21.00 C ATOM 1399 CG2 VAL A 81 27.587 8.795 -19.610 1.00 21.13 C ATOM 0 H VAL A 81 30.360 8.926 -19.970 1.00 13.20 H new ATOM 0 HA VAL A 81 29.255 7.367 -18.176 1.00 14.59 H new ATOM 0 HB VAL A 81 28.657 7.632 -20.915 1.00 16.17 H new ATOM 0 HG11 VAL A 81 26.621 6.467 -20.458 1.00 21.00 H new ATOM 0 HG12 VAL A 81 27.858 5.525 -20.155 1.00 21.00 H new ATOM 0 HG13 VAL A 81 27.096 6.240 -18.965 1.00 21.00 H new ATOM 0 HG21 VAL A 81 26.821 8.908 -20.194 1.00 21.13 H new ATOM 0 HG22 VAL A 81 27.284 8.717 -18.692 1.00 21.13 H new ATOM 0 HG23 VAL A 81 28.172 9.564 -19.692 1.00 21.13 H new ATOM 1409 N ARG A 82 30.931 5.805 -20.433 1.00 12.67 N ATOM 1410 CA ARG A 82 31.628 4.544 -20.673 1.00 11.85 C ATOM 1411 C ARG A 82 32.635 4.250 -19.569 1.00 12.81 C ATOM 1412 O ARG A 82 32.721 3.119 -19.079 1.00 12.38 O ATOM 1413 CB ARG A 82 32.333 4.567 -22.033 1.00 13.29 C ATOM 1414 CG ARG A 82 33.176 3.335 -22.266 1.00 17.77 C ATOM 1415 CD ARG A 82 33.988 3.445 -23.561 1.00 24.41 C ATOM 1416 NE ARG A 82 34.830 4.636 -23.610 1.00 35.08 N ATOM 1417 CZ ARG A 82 35.966 4.800 -22.932 1.00 31.94 C ATOM 1418 NH1 ARG A 82 36.418 3.851 -22.134 1.00 38.99 N ATOM 1419 NH2 ARG A 82 36.655 5.925 -23.071 1.00 28.53 N ATOM 0 H ARG A 82 31.027 6.399 -21.047 1.00 12.67 H new ATOM 0 HA ARG A 82 30.964 3.837 -20.675 1.00 11.85 H new ATOM 0 HB2 ARG A 82 31.670 4.640 -22.737 1.00 13.29 H new ATOM 0 HB3 ARG A 82 32.895 5.356 -22.090 1.00 13.29 H new ATOM 0 HG2 ARG A 82 33.777 3.207 -21.516 1.00 17.77 H new ATOM 0 HG3 ARG A 82 32.603 2.553 -22.307 1.00 17.77 H new ATOM 0 HD2 ARG A 82 34.546 2.657 -23.654 1.00 24.41 H new ATOM 0 HD3 ARG A 82 33.381 3.454 -24.317 1.00 24.41 H new ATOM 0 HE ARG A 82 34.573 5.282 -24.116 1.00 35.08 H new ATOM 0 HH11 ARG A 82 35.979 3.117 -22.047 1.00 38.99 H new ATOM 0 HH12 ARG A 82 37.152 3.967 -21.701 1.00 38.99 H new ATOM 0 HH21 ARG A 82 36.368 6.543 -23.596 1.00 28.53 H new ATOM 0 HH22 ARG A 82 37.389 6.036 -22.636 1.00 28.53 H new ATOM 1433 N GLU A 83 33.429 5.259 -19.182 1.00 11.93 N ATOM 1434 CA GLU A 83 34.440 5.047 -18.159 1.00 12.94 C ATOM 1435 C GLU A 83 33.807 4.559 -16.869 1.00 13.82 C ATOM 1436 O GLU A 83 34.316 3.644 -16.235 1.00 12.72 O ATOM 1437 CB GLU A 83 35.226 6.338 -17.901 1.00 13.05 C ATOM 1438 CG GLU A 83 36.143 6.727 -19.017 1.00 13.96 C ATOM 1439 CD GLU A 83 36.750 8.126 -18.842 1.00 20.45 C ATOM 1440 OE1 GLU A 83 37.690 8.451 -19.595 1.00 18.82 O ATOM 1441 OE2 GLU A 83 36.292 8.872 -17.947 1.00 17.36 O ATOM 0 H GLU A 83 33.393 6.058 -19.498 1.00 11.93 H new ATOM 0 HA GLU A 83 35.052 4.367 -18.480 1.00 12.94 H new ATOM 0 HB2 GLU A 83 34.599 7.061 -17.743 1.00 13.05 H new ATOM 0 HB3 GLU A 83 35.747 6.232 -17.089 1.00 13.05 H new ATOM 0 HG2 GLU A 83 36.859 6.076 -19.081 1.00 13.96 H new ATOM 0 HG3 GLU A 83 35.655 6.695 -19.855 1.00 13.96 H new ATOM 1448 N TYR A 84 32.718 5.191 -16.445 1.00 10.24 N ATOM 1449 CA TYR A 84 32.137 4.839 -15.159 1.00 11.35 C ATOM 1450 C TYR A 84 31.410 3.500 -15.240 1.00 12.26 C ATOM 1451 O TYR A 84 31.504 2.701 -14.310 1.00 10.74 O ATOM 1452 CB TYR A 84 31.213 5.939 -14.669 1.00 11.29 C ATOM 1453 CG TYR A 84 30.706 5.737 -13.263 1.00 10.16 C ATOM 1454 CD1 TYR A 84 31.555 5.348 -12.250 1.00 12.67 C ATOM 1455 CD2 TYR A 84 29.354 5.830 -12.977 1.00 12.68 C ATOM 1456 CE1 TYR A 84 31.090 5.104 -10.978 1.00 12.65 C ATOM 1457 CE2 TYR A 84 28.878 5.595 -11.713 1.00 13.36 C ATOM 1458 CZ TYR A 84 29.740 5.179 -10.728 1.00 10.75 C ATOM 1459 OH TYR A 84 29.274 4.914 -9.483 1.00 14.30 O ATOM 0 H TYR A 84 32.309 5.812 -16.876 1.00 10.24 H new ATOM 0 HA TYR A 84 32.856 4.746 -14.515 1.00 11.35 H new ATOM 0 HB2 TYR A 84 31.683 6.787 -14.714 1.00 11.29 H new ATOM 0 HB3 TYR A 84 30.454 6.002 -15.270 1.00 11.29 H new ATOM 0 HD1 TYR A 84 32.462 5.248 -12.430 1.00 12.67 H new ATOM 0 HD2 TYR A 84 28.758 6.056 -13.655 1.00 12.68 H new ATOM 0 HE1 TYR A 84 31.683 4.890 -10.294 1.00 12.65 H new ATOM 0 HE2 TYR A 84 27.976 5.717 -11.523 1.00 13.36 H new ATOM 0 HH TYR A 84 28.438 4.998 -9.473 1.00 14.30 H new ATOM 1469 N ARG A 85 30.736 3.217 -16.360 1.00 10.42 N ATOM 1470 CA ARG A 85 30.212 1.867 -16.569 1.00 9.58 C ATOM 1471 C ARG A 85 31.322 0.822 -16.498 1.00 11.17 C ATOM 1472 O ARG A 85 31.143 -0.238 -15.883 1.00 12.99 O ATOM 1473 CB ARG A 85 29.468 1.789 -17.899 1.00 14.01 C ATOM 1474 CG ARG A 85 28.653 0.501 -18.088 1.00 13.54 C ATOM 1475 CD ARG A 85 29.438 -0.539 -18.819 1.00 15.29 C ATOM 1476 NE ARG A 85 29.851 -0.069 -20.122 1.00 14.28 N ATOM 1477 CZ ARG A 85 30.882 -0.527 -20.809 1.00 16.86 C ATOM 1478 NH1 ARG A 85 31.624 -1.541 -20.357 1.00 20.97 N ATOM 1479 NH2 ARG A 85 31.167 0.038 -21.985 1.00 20.29 N ATOM 0 H ARG A 85 30.576 3.776 -16.993 1.00 10.42 H new ATOM 0 HA ARG A 85 29.586 1.671 -15.854 1.00 9.58 H new ATOM 0 HB2 ARG A 85 28.872 2.551 -17.970 1.00 14.01 H new ATOM 0 HB3 ARG A 85 30.110 1.863 -18.622 1.00 14.01 H new ATOM 0 HG2 ARG A 85 28.384 0.156 -17.222 1.00 13.54 H new ATOM 0 HG3 ARG A 85 27.840 0.700 -18.579 1.00 13.54 H new ATOM 0 HD2 ARG A 85 30.219 -0.782 -18.298 1.00 15.29 H new ATOM 0 HD3 ARG A 85 28.902 -1.341 -18.918 1.00 15.29 H new ATOM 0 HE ARG A 85 29.387 0.561 -20.479 1.00 14.28 H new ATOM 0 HH11 ARG A 85 31.434 -1.910 -19.604 1.00 20.97 H new ATOM 0 HH12 ARG A 85 32.291 -1.825 -20.819 1.00 20.97 H new ATOM 0 HH21 ARG A 85 30.683 0.685 -22.279 1.00 20.29 H new ATOM 0 HH22 ARG A 85 31.834 -0.245 -22.448 1.00 20.29 H new ATOM 1493 N GLU A 86 32.452 1.079 -17.140 1.00 10.81 N ATOM 1494 CA AGLU A 86 33.581 0.160 -17.063 0.67 11.13 C ATOM 1495 CA BGLU A 86 33.589 0.166 -17.067 0.33 11.20 C ATOM 1496 C GLU A 86 34.096 0.001 -15.638 1.00 12.46 C ATOM 1497 O GLU A 86 34.512 -1.083 -15.255 1.00 14.28 O ATOM 1498 CB AGLU A 86 34.711 0.615 -17.977 0.67 13.83 C ATOM 1499 CB BGLU A 86 34.702 0.675 -17.976 0.33 14.06 C ATOM 1500 CG AGLU A 86 34.441 0.375 -19.449 0.67 10.54 C ATOM 1501 CG BGLU A 86 35.805 -0.308 -18.258 0.33 23.07 C ATOM 1502 CD AGLU A 86 35.519 0.976 -20.357 0.67 31.59 C ATOM 1503 CD BGLU A 86 35.282 -1.614 -18.819 0.33 20.67 C ATOM 1504 OE1AGLU A 86 36.460 1.619 -19.840 0.67 33.26 O ATOM 1505 OE1BGLU A 86 35.411 -2.635 -18.129 0.33 16.53 O ATOM 1506 OE2AGLU A 86 35.422 0.798 -21.594 0.67 32.28 O ATOM 1507 OE2BGLU A 86 34.739 -1.619 -19.947 0.33 28.39 O ATOM 0 H AGLU A 86 32.587 1.777 -17.624 0.67 10.81 H new ATOM 0 H BGLU A 86 32.584 1.777 -17.625 0.33 10.81 H new ATOM 0 HA AGLU A 86 33.260 -0.706 -17.359 0.67 11.20 H new ATOM 0 HA BGLU A 86 33.297 -0.709 -17.366 0.33 11.20 H new ATOM 0 HB2AGLU A 86 34.869 1.562 -17.836 0.67 14.06 H new ATOM 0 HB2BGLU A 86 34.310 0.949 -18.820 0.33 14.06 H new ATOM 0 HB3AGLU A 86 35.525 0.151 -17.726 0.67 14.06 H new ATOM 0 HB3BGLU A 86 35.091 1.467 -17.573 0.33 14.06 H new ATOM 0 HG2AGLU A 86 34.383 -0.580 -19.611 0.67 23.07 H new ATOM 0 HG2BGLU A 86 36.432 0.084 -18.886 0.33 23.07 H new ATOM 0 HG3AGLU A 86 33.579 0.755 -19.682 0.67 23.07 H new ATOM 0 HG3BGLU A 86 36.296 -0.483 -17.440 0.33 23.07 H new ATOM 1520 N LYS A 87 34.080 1.071 -14.836 1.00 11.10 N ATOM 1521 CA LYS A 87 34.549 0.990 -13.451 1.00 13.89 C ATOM 1522 C LYS A 87 33.672 0.055 -12.647 1.00 12.72 C ATOM 1523 O LYS A 87 34.173 -0.839 -11.958 1.00 13.61 O ATOM 1524 CB LYS A 87 34.565 2.392 -12.839 1.00 16.35 C ATOM 1525 CG LYS A 87 34.816 2.421 -11.336 1.00 23.19 C ATOM 1526 CD LYS A 87 34.774 3.869 -10.816 1.00 26.86 C ATOM 1527 CE LYS A 87 34.593 3.934 -9.320 1.00 41.02 C ATOM 1528 NZ LYS A 87 35.679 3.220 -8.605 1.00 48.78 N ATOM 0 H LYS A 87 33.802 1.849 -15.075 1.00 11.10 H new ATOM 0 HA LYS A 87 35.450 0.631 -13.436 1.00 13.89 H new ATOM 0 HB2 LYS A 87 35.250 2.918 -13.280 1.00 16.35 H new ATOM 0 HB3 LYS A 87 33.715 2.823 -13.022 1.00 16.35 H new ATOM 0 HG2 LYS A 87 34.147 1.887 -10.880 1.00 23.19 H new ATOM 0 HG3 LYS A 87 35.679 2.024 -11.138 1.00 23.19 H new ATOM 0 HD2 LYS A 87 35.596 4.322 -11.060 1.00 26.86 H new ATOM 0 HD3 LYS A 87 34.048 4.345 -11.249 1.00 26.86 H new ATOM 0 HE2 LYS A 87 34.573 4.861 -9.036 1.00 41.02 H new ATOM 0 HE3 LYS A 87 33.737 3.546 -9.080 1.00 41.02 H new ATOM 0 HZ1 LYS A 87 35.836 3.621 -7.826 1.00 48.78 H new ATOM 0 HZ2 LYS A 87 35.435 2.377 -8.460 1.00 48.78 H new ATOM 0 HZ3 LYS A 87 36.419 3.233 -9.099 1.00 48.78 H new ATOM 1542 N VAL A 88 32.359 0.224 -12.766 1.00 12.33 N ATOM 1543 CA VAL A 88 31.419 -0.641 -12.064 1.00 10.22 C ATOM 1544 C VAL A 88 31.534 -2.059 -12.573 1.00 11.72 C ATOM 1545 O VAL A 88 31.553 -3.013 -11.778 1.00 12.34 O ATOM 1546 CB VAL A 88 29.990 -0.091 -12.194 1.00 12.44 C ATOM 1547 CG1 VAL A 88 28.994 -1.050 -11.642 1.00 18.04 C ATOM 1548 CG2 VAL A 88 29.872 1.255 -11.521 1.00 13.28 C ATOM 0 H VAL A 88 31.992 0.834 -13.249 1.00 12.33 H new ATOM 0 HA VAL A 88 31.638 -0.654 -11.119 1.00 10.22 H new ATOM 0 HB VAL A 88 29.799 0.025 -13.138 1.00 12.44 H new ATOM 0 HG11 VAL A 88 28.102 -0.680 -11.736 1.00 18.04 H new ATOM 0 HG12 VAL A 88 29.049 -1.888 -12.127 1.00 18.04 H new ATOM 0 HG13 VAL A 88 29.181 -1.207 -10.703 1.00 18.04 H new ATOM 0 HG21 VAL A 88 28.965 1.585 -11.614 1.00 13.28 H new ATOM 0 HG22 VAL A 88 30.089 1.166 -10.580 1.00 13.28 H new ATOM 0 HG23 VAL A 88 30.487 1.880 -11.937 1.00 13.28 H new ATOM 1558 N GLU A 89 31.662 -2.226 -13.897 1.00 11.85 N ATOM 1559 CA GLU A 89 31.790 -3.555 -14.479 1.00 10.98 C ATOM 1560 C GLU A 89 33.017 -4.289 -13.963 1.00 13.65 C ATOM 1561 O GLU A 89 32.956 -5.493 -13.663 1.00 12.96 O ATOM 1562 CB GLU A 89 31.843 -3.406 -15.998 1.00 11.38 C ATOM 1563 CG GLU A 89 31.886 -4.684 -16.786 1.00 12.40 C ATOM 1564 CD GLU A 89 31.772 -4.386 -18.268 1.00 15.22 C ATOM 1565 OE1 GLU A 89 30.750 -3.767 -18.682 1.00 16.87 O ATOM 1566 OE2 GLU A 89 32.709 -4.746 -18.976 1.00 21.78 O ATOM 0 H GLU A 89 31.676 -1.582 -14.467 1.00 11.85 H new ATOM 0 HA GLU A 89 31.024 -4.091 -14.219 1.00 10.98 H new ATOM 0 HB2 GLU A 89 31.067 -2.898 -16.282 1.00 11.38 H new ATOM 0 HB3 GLU A 89 32.626 -2.880 -16.226 1.00 11.38 H new ATOM 0 HG2 GLU A 89 32.715 -5.155 -16.606 1.00 12.40 H new ATOM 0 HG3 GLU A 89 31.162 -5.267 -16.509 1.00 12.40 H new ATOM 1573 N THR A 90 34.148 -3.594 -13.883 1.00 11.93 N ATOM 1574 CA THR A 90 35.378 -4.214 -13.413 1.00 11.87 C ATOM 1575 C THR A 90 35.241 -4.629 -11.952 1.00 11.02 C ATOM 1576 O THR A 90 35.730 -5.697 -11.552 1.00 13.77 O ATOM 1577 CB THR A 90 36.556 -3.247 -13.617 1.00 17.48 C ATOM 1578 OG1 THR A 90 36.700 -2.981 -15.023 1.00 20.06 O ATOM 1579 CG2 THR A 90 37.817 -3.833 -13.097 1.00 23.72 C ATOM 0 H THR A 90 34.222 -2.764 -14.096 1.00 11.93 H new ATOM 0 HA THR A 90 35.551 -5.017 -13.929 1.00 11.87 H new ATOM 0 HB THR A 90 36.376 -2.426 -13.133 1.00 17.48 H new ATOM 0 HG1 THR A 90 36.134 -2.407 -15.259 1.00 20.06 H new ATOM 0 HG21 THR A 90 38.546 -3.208 -13.235 1.00 23.72 H new ATOM 0 HG22 THR A 90 37.723 -4.014 -12.149 1.00 23.72 H new ATOM 0 HG23 THR A 90 38.007 -4.660 -13.567 1.00 23.72 H new ATOM 1587 N GLU A 91 34.550 -3.818 -11.150 1.00 11.86 N ATOM 1588 CA AGLU A 91 34.356 -4.182 -9.753 0.51 10.25 C ATOM 1589 CA BGLU A 91 34.337 -4.166 -9.750 0.49 10.21 C ATOM 1590 C GLU A 91 33.440 -5.392 -9.628 1.00 12.54 C ATOM 1591 O GLU A 91 33.712 -6.290 -8.832 1.00 12.46 O ATOM 1592 CB AGLU A 91 33.810 -2.994 -8.967 0.51 14.30 C ATOM 1593 CB BGLU A 91 33.738 -2.970 -9.007 0.49 14.37 C ATOM 1594 CG AGLU A 91 34.784 -1.844 -8.928 0.51 13.34 C ATOM 1595 CG BGLU A 91 33.673 -3.112 -7.501 0.49 22.81 C ATOM 1596 CD AGLU A 91 34.319 -0.700 -8.059 0.51 23.68 C ATOM 1597 CD BGLU A 91 32.873 -1.995 -6.840 0.49 27.12 C ATOM 1598 OE1AGLU A 91 33.237 -0.814 -7.446 0.51 26.93 O ATOM 1599 OE1BGLU A 91 33.414 -0.871 -6.751 0.49 18.16 O ATOM 1600 OE2AGLU A 91 35.058 0.313 -7.987 0.51 23.84 O ATOM 1601 OE2BGLU A 91 31.698 -2.234 -6.419 0.49 14.47 O ATOM 0 H AGLU A 91 34.195 -3.072 -11.390 0.51 11.86 H new ATOM 0 H BGLU A 91 34.201 -3.071 -11.395 0.49 11.86 H new ATOM 0 HA AGLU A 91 35.216 -4.426 -9.376 0.51 10.21 H new ATOM 0 HA BGLU A 91 35.191 -4.387 -9.346 0.49 10.21 H new ATOM 0 HB2AGLU A 91 32.978 -2.698 -9.367 0.51 14.37 H new ATOM 0 HB2BGLU A 91 34.260 -2.181 -9.221 0.49 14.37 H new ATOM 0 HB3AGLU A 91 33.605 -3.274 -8.061 0.51 14.37 H new ATOM 0 HB3BGLU A 91 32.841 -2.816 -9.342 0.49 14.37 H new ATOM 0 HG2AGLU A 91 35.640 -2.163 -8.601 0.51 22.81 H new ATOM 0 HG2BGLU A 91 33.274 -3.967 -7.277 0.49 22.81 H new ATOM 0 HG3AGLU A 91 34.928 -1.519 -9.831 0.51 22.81 H new ATOM 0 HG3BGLU A 91 34.574 -3.117 -7.141 0.49 22.81 H new ATOM 1614 N LEU A 92 32.371 -5.431 -10.421 1.00 12.93 N ATOM 1615 CA ALEU A 92 31.493 -6.601 -10.484 0.68 11.41 C ATOM 1616 CA BLEU A 92 31.497 -6.600 -10.469 0.32 11.47 C ATOM 1617 C LEU A 92 32.267 -7.857 -10.860 1.00 13.49 C ATOM 1618 O LEU A 92 32.105 -8.917 -10.232 1.00 12.71 O ATOM 1619 CB ALEU A 92 30.369 -6.326 -11.500 0.68 12.05 C ATOM 1620 CB BLEU A 92 30.349 -6.344 -11.455 0.32 12.28 C ATOM 1621 CG ALEU A 92 29.228 -7.323 -11.686 0.68 16.13 C ATOM 1622 CG BLEU A 92 29.433 -7.536 -11.738 0.32 17.05 C ATOM 1623 CD1ALEU A 92 28.012 -6.590 -12.245 0.68 16.24 C ATOM 1624 CD1BLEU A 92 28.825 -8.064 -10.450 0.32 15.90 C ATOM 1625 CD2ALEU A 92 29.655 -8.462 -12.575 0.68 13.90 C ATOM 1626 CD2BLEU A 92 28.359 -7.146 -12.726 0.32 17.34 C ATOM 0 H ALEU A 92 32.134 -4.784 -10.936 0.68 12.93 H new ATOM 0 H BLEU A 92 32.134 -4.788 -10.941 0.32 12.93 H new ATOM 0 HA ALEU A 92 31.109 -6.756 -9.607 0.68 11.47 H new ATOM 0 HA BLEU A 92 31.133 -6.747 -9.582 0.32 11.47 H new ATOM 0 HB2ALEU A 92 29.969 -5.475 -11.260 0.68 12.28 H new ATOM 0 HB2BLEU A 92 29.807 -5.616 -11.112 0.32 12.28 H new ATOM 0 HB3ALEU A 92 30.789 -6.208 -12.366 0.68 12.28 H new ATOM 0 HB3BLEU A 92 30.729 -6.043 -12.295 0.32 12.28 H new ATOM 0 HG ALEU A 92 28.988 -7.710 -10.830 0.68 17.05 H new ATOM 0 HG BLEU A 92 29.962 -8.248 -12.129 0.32 17.05 H new ATOM 0 HD11ALEU A 92 27.283 -7.218 -12.366 0.68 15.90 H new ATOM 0 HD11BLEU A 92 28.248 -8.818 -10.649 0.32 15.90 H new ATOM 0 HD12ALEU A 92 27.740 -5.895 -11.626 0.68 15.90 H new ATOM 0 HD12BLEU A 92 29.533 -8.348 -9.851 0.32 15.90 H new ATOM 0 HD13ALEU A 92 28.239 -6.191 -13.099 0.68 15.90 H new ATOM 0 HD13BLEU A 92 28.305 -7.363 -10.026 0.32 15.90 H new ATOM 0 HD21ALEU A 92 28.918 -9.084 -12.681 0.68 17.34 H new ATOM 0 HD21BLEU A 92 27.785 -7.909 -12.898 0.32 17.34 H new ATOM 0 HD22ALEU A 92 29.913 -8.116 -13.444 0.68 17.34 H new ATOM 0 HD22BLEU A 92 27.830 -6.420 -12.360 0.32 17.34 H new ATOM 0 HD23ALEU A 92 30.409 -8.921 -12.173 0.68 17.34 H new ATOM 0 HD23BLEU A 92 28.771 -6.859 -13.556 0.32 17.34 H new ATOM 1649 N GLN A 93 33.091 -7.766 -11.908 1.00 11.59 N ATOM 1650 CA GLN A 93 33.883 -8.906 -12.341 1.00 13.03 C ATOM 1651 C GLN A 93 34.813 -9.357 -11.235 1.00 11.81 C ATOM 1652 O GLN A 93 35.064 -10.548 -11.063 1.00 13.07 O ATOM 1653 CB GLN A 93 34.655 -8.544 -13.595 1.00 12.94 C ATOM 1654 CG GLN A 93 33.716 -8.439 -14.823 1.00 13.71 C ATOM 1655 CD GLN A 93 34.395 -7.803 -16.011 1.00 17.65 C ATOM 1656 OE1 GLN A 93 35.261 -6.918 -15.856 1.00 17.18 O ATOM 1657 NE2 GLN A 93 33.973 -8.183 -17.194 1.00 17.59 N ATOM 0 H GLN A 93 33.202 -7.053 -12.376 1.00 11.59 H new ATOM 0 HA GLN A 93 33.292 -9.647 -12.547 1.00 13.03 H new ATOM 0 HB2 GLN A 93 35.114 -7.700 -13.463 1.00 12.94 H new ATOM 0 HB3 GLN A 93 35.336 -9.214 -13.763 1.00 12.94 H new ATOM 0 HG2 GLN A 93 33.406 -9.325 -15.067 1.00 13.71 H new ATOM 0 HG3 GLN A 93 32.932 -7.919 -14.585 1.00 13.71 H new ATOM 0 HE21 GLN A 93 33.374 -8.797 -17.260 1.00 17.59 H new ATOM 0 HE22 GLN A 93 34.295 -7.818 -17.903 1.00 17.59 H new ATOM 1666 N GLY A 94 35.356 -8.420 -10.490 1.00 12.82 N ATOM 1667 CA GLY A 94 36.232 -8.781 -9.396 1.00 14.69 C ATOM 1668 C GLY A 94 35.520 -9.570 -8.310 1.00 13.08 C ATOM 1669 O GLY A 94 36.069 -10.537 -7.761 1.00 13.79 O ATOM 0 H GLY A 94 35.233 -7.576 -10.597 1.00 12.82 H new ATOM 0 HA2 GLY A 94 36.972 -9.306 -9.739 1.00 14.69 H new ATOM 0 HA3 GLY A 94 36.610 -7.975 -9.010 1.00 14.69 H new ATOM 1673 N VAL A 95 34.289 -9.172 -7.987 1.00 11.60 N ATOM 1674 CA VAL A 95 33.531 -9.907 -6.986 1.00 11.41 C ATOM 1675 C VAL A 95 33.213 -11.308 -7.500 1.00 11.82 C ATOM 1676 O VAL A 95 33.408 -12.309 -6.798 1.00 11.31 O ATOM 1677 CB VAL A 95 32.258 -9.154 -6.582 1.00 13.96 C ATOM 1678 CG1 VAL A 95 31.412 -9.992 -5.659 1.00 19.64 C ATOM 1679 CG2 VAL A 95 32.611 -7.828 -5.895 1.00 17.21 C ATOM 0 H VAL A 95 33.885 -8.494 -8.329 1.00 11.60 H new ATOM 0 HA VAL A 95 34.074 -9.989 -6.187 1.00 11.41 H new ATOM 0 HB VAL A 95 31.753 -8.968 -7.389 1.00 13.96 H new ATOM 0 HG11 VAL A 95 30.613 -9.499 -5.415 1.00 19.64 H new ATOM 0 HG12 VAL A 95 31.160 -10.814 -6.108 1.00 19.64 H new ATOM 0 HG13 VAL A 95 31.918 -10.203 -4.859 1.00 19.64 H new ATOM 0 HG21 VAL A 95 31.796 -7.365 -5.646 1.00 17.21 H new ATOM 0 HG22 VAL A 95 33.137 -8.005 -5.100 1.00 17.21 H new ATOM 0 HG23 VAL A 95 33.124 -7.274 -6.504 1.00 17.21 H new ATOM 1689 N CYS A 96 32.740 -11.412 -8.744 1.00 10.40 N ATOM 1690 CA CYS A 96 32.470 -12.725 -9.311 1.00 8.20 C ATOM 1691 C CYS A 96 33.719 -13.596 -9.290 1.00 11.29 C ATOM 1692 O CYS A 96 33.653 -14.783 -8.938 1.00 12.71 O ATOM 1693 CB CYS A 96 31.935 -12.615 -10.734 1.00 11.69 C ATOM 1694 SG CYS A 96 30.320 -11.850 -10.817 1.00 13.79 S ATOM 0 H CYS A 96 32.573 -10.747 -9.263 1.00 10.40 H new ATOM 0 HA CYS A 96 31.790 -13.143 -8.760 1.00 8.20 H new ATOM 0 HB2 CYS A 96 32.559 -12.101 -11.270 1.00 11.69 H new ATOM 0 HB3 CYS A 96 31.888 -13.501 -11.126 1.00 11.69 H new ATOM 0 HG CYS A 96 29.962 -11.794 -11.961 1.00 13.79 H new ATOM 1700 N ASP A 97 34.872 -13.022 -9.639 1.00 12.17 N ATOM 1701 CA ASP A 97 36.117 -13.794 -9.643 1.00 14.54 C ATOM 1702 C ASP A 97 36.502 -14.238 -8.240 1.00 12.89 C ATOM 1703 O ASP A 97 37.075 -15.311 -8.067 1.00 12.15 O ATOM 1704 CB ASP A 97 37.273 -12.977 -10.234 1.00 17.71 C ATOM 1705 CG ASP A 97 37.191 -12.796 -11.756 1.00 31.72 C ATOM 1706 OD1 ASP A 97 36.367 -13.439 -12.433 1.00 25.05 O ATOM 1707 OD2 ASP A 97 37.972 -11.969 -12.280 1.00 24.72 O ATOM 0 H ASP A 97 34.955 -12.199 -9.874 1.00 12.17 H new ATOM 0 HA ASP A 97 35.957 -14.577 -10.193 1.00 14.54 H new ATOM 0 HB2 ASP A 97 37.288 -12.103 -9.813 1.00 17.71 H new ATOM 0 HB3 ASP A 97 38.111 -13.412 -10.013 1.00 17.71 H new ATOM 1712 N THR A 98 36.263 -13.400 -7.243 1.00 11.39 N ATOM 1713 CA THR A 98 36.525 -13.789 -5.861 1.00 12.25 C ATOM 1714 C THR A 98 35.688 -14.993 -5.461 1.00 12.06 C ATOM 1715 O THR A 98 36.206 -15.959 -4.870 1.00 11.97 O ATOM 1716 CB THR A 98 36.217 -12.610 -4.945 1.00 16.90 C ATOM 1717 OG1 THR A 98 37.146 -11.549 -5.193 1.00 17.95 O ATOM 1718 CG2 THR A 98 36.322 -12.997 -3.472 1.00 17.22 C ATOM 0 H THR A 98 35.951 -12.605 -7.341 1.00 11.39 H new ATOM 0 HA THR A 98 37.459 -14.037 -5.778 1.00 12.25 H new ATOM 0 HB THR A 98 35.308 -12.328 -5.134 1.00 16.90 H new ATOM 0 HG1 THR A 98 36.895 -11.108 -5.862 1.00 17.95 H new ATOM 0 HG21 THR A 98 36.120 -12.226 -2.919 1.00 17.22 H new ATOM 0 HG22 THR A 98 35.690 -13.707 -3.278 1.00 17.22 H new ATOM 0 HG23 THR A 98 37.222 -13.304 -3.281 1.00 17.22 H new ATOM 1726 N VAL A 99 34.385 -14.942 -5.761 1.00 10.52 N ATOM 1727 CA VAL A 99 33.493 -16.050 -5.417 1.00 9.91 C ATOM 1728 C VAL A 99 33.924 -17.314 -6.148 1.00 9.63 C ATOM 1729 O VAL A 99 34.052 -18.399 -5.552 1.00 10.78 O ATOM 1730 CB VAL A 99 32.033 -15.690 -5.743 1.00 9.60 C ATOM 1731 CG1 VAL A 99 31.140 -16.908 -5.565 1.00 16.06 C ATOM 1732 CG2 VAL A 99 31.561 -14.557 -4.827 1.00 12.09 C ATOM 0 H VAL A 99 34.004 -14.282 -6.159 1.00 10.52 H new ATOM 0 HA VAL A 99 33.551 -16.216 -4.463 1.00 9.91 H new ATOM 0 HB VAL A 99 31.980 -15.396 -6.666 1.00 9.60 H new ATOM 0 HG11 VAL A 99 30.223 -16.670 -5.773 1.00 16.06 H new ATOM 0 HG12 VAL A 99 31.433 -17.615 -6.161 1.00 16.06 H new ATOM 0 HG13 VAL A 99 31.193 -17.217 -4.647 1.00 16.06 H new ATOM 0 HG21 VAL A 99 30.641 -14.334 -5.036 1.00 12.09 H new ATOM 0 HG22 VAL A 99 31.622 -14.842 -3.902 1.00 12.09 H new ATOM 0 HG23 VAL A 99 32.121 -13.777 -4.962 1.00 12.09 H new ATOM 1742 N LEU A 100 34.166 -17.197 -7.456 1.00 10.36 N ATOM 1743 CA LEU A 100 34.573 -18.376 -8.211 1.00 11.14 C ATOM 1744 C LEU A 100 35.885 -18.919 -7.691 1.00 12.85 C ATOM 1745 O LEU A 100 36.084 -20.136 -7.667 1.00 12.35 O ATOM 1746 CB LEU A 100 34.676 -18.076 -9.701 1.00 11.95 C ATOM 1747 CG LEU A 100 33.324 -17.704 -10.329 1.00 12.10 C ATOM 1748 CD1 LEU A 100 33.482 -17.078 -11.694 1.00 13.32 C ATOM 1749 CD2 LEU A 100 32.407 -18.951 -10.409 1.00 10.92 C ATOM 0 H LEU A 100 34.102 -16.469 -7.909 1.00 10.36 H new ATOM 0 HA LEU A 100 33.888 -19.051 -8.089 1.00 11.14 H new ATOM 0 HB2 LEU A 100 35.302 -17.348 -9.837 1.00 11.95 H new ATOM 0 HB3 LEU A 100 35.038 -18.851 -10.158 1.00 11.95 H new ATOM 0 HG LEU A 100 32.911 -17.040 -9.755 1.00 12.10 H new ATOM 0 HD11 LEU A 100 32.608 -16.859 -12.053 1.00 13.32 H new ATOM 0 HD12 LEU A 100 34.012 -16.269 -11.620 1.00 13.32 H new ATOM 0 HD13 LEU A 100 33.928 -17.703 -12.287 1.00 13.32 H new ATOM 0 HD21 LEU A 100 31.558 -18.703 -10.807 1.00 10.92 H new ATOM 0 HD22 LEU A 100 32.833 -19.631 -10.954 1.00 10.92 H new ATOM 0 HD23 LEU A 100 32.256 -19.300 -9.517 1.00 10.92 H new ATOM 1761 N GLY A 101 36.775 -18.037 -7.242 1.00 15.02 N ATOM 1762 CA GLY A 101 38.014 -18.492 -6.629 1.00 13.72 C ATOM 1763 C GLY A 101 37.817 -19.292 -5.358 1.00 15.08 C ATOM 1764 O GLY A 101 38.504 -20.285 -5.135 1.00 16.44 O ATOM 0 H GLY A 101 36.681 -17.183 -7.283 1.00 15.02 H new ATOM 0 HA2 GLY A 101 38.500 -19.035 -7.269 1.00 13.72 H new ATOM 0 HA3 GLY A 101 38.568 -17.721 -6.432 1.00 13.72 H new ATOM 1768 N LEU A 102 36.901 -18.855 -4.500 1.00 9.90 N ATOM 1769 CA LEU A 102 36.595 -19.583 -3.286 1.00 10.10 C ATOM 1770 C LEU A 102 36.015 -20.943 -3.614 1.00 11.17 C ATOM 1771 O LEU A 102 36.323 -21.934 -2.936 1.00 12.53 O ATOM 1772 CB LEU A 102 35.615 -18.780 -2.417 1.00 12.43 C ATOM 1773 CG LEU A 102 36.149 -17.480 -1.819 1.00 11.79 C ATOM 1774 CD1 LEU A 102 35.014 -16.707 -1.171 1.00 20.63 C ATOM 1775 CD2 LEU A 102 37.272 -17.732 -0.852 1.00 17.44 C ATOM 0 H LEU A 102 36.445 -18.134 -4.608 1.00 9.90 H new ATOM 0 HA LEU A 102 37.418 -19.712 -2.789 1.00 10.10 H new ATOM 0 HB2 LEU A 102 34.834 -18.570 -2.953 1.00 12.43 H new ATOM 0 HB3 LEU A 102 35.316 -19.349 -1.691 1.00 12.43 H new ATOM 0 HG LEU A 102 36.519 -16.941 -2.536 1.00 11.79 H new ATOM 0 HD11 LEU A 102 35.358 -15.883 -0.793 1.00 20.63 H new ATOM 0 HD12 LEU A 102 34.341 -16.500 -1.838 1.00 20.63 H new ATOM 0 HD13 LEU A 102 34.617 -17.244 -0.467 1.00 20.63 H new ATOM 0 HD21 LEU A 102 37.586 -16.887 -0.493 1.00 17.44 H new ATOM 0 HD22 LEU A 102 36.955 -18.293 -0.127 1.00 17.44 H new ATOM 0 HD23 LEU A 102 38.001 -18.178 -1.311 1.00 17.44 H new ATOM 1787 N LEU A 103 35.147 -21.006 -4.631 1.00 11.14 N ATOM 1788 CA LEU A 103 34.531 -22.284 -4.970 1.00 11.05 C ATOM 1789 C LEU A 103 35.584 -23.230 -5.510 1.00 11.80 C ATOM 1790 O LEU A 103 35.546 -24.422 -5.217 1.00 13.33 O ATOM 1791 CB LEU A 103 33.414 -22.080 -6.002 1.00 12.18 C ATOM 1792 CG LEU A 103 32.198 -21.303 -5.513 1.00 12.44 C ATOM 1793 CD1 LEU A 103 31.300 -20.888 -6.681 1.00 14.45 C ATOM 1794 CD2 LEU A 103 31.385 -22.090 -4.507 1.00 14.12 C ATOM 0 H LEU A 103 34.910 -20.340 -5.121 1.00 11.14 H new ATOM 0 HA LEU A 103 34.140 -22.670 -4.171 1.00 11.05 H new ATOM 0 HB2 LEU A 103 33.786 -21.618 -6.770 1.00 12.18 H new ATOM 0 HB3 LEU A 103 33.118 -22.951 -6.311 1.00 12.18 H new ATOM 0 HG LEU A 103 32.539 -20.508 -5.074 1.00 12.44 H new ATOM 0 HD11 LEU A 103 30.535 -20.396 -6.343 1.00 14.45 H new ATOM 0 HD12 LEU A 103 31.802 -20.325 -7.291 1.00 14.45 H new ATOM 0 HD13 LEU A 103 30.993 -21.679 -7.150 1.00 14.45 H new ATOM 0 HD21 LEU A 103 30.623 -21.562 -4.222 1.00 14.12 H new ATOM 0 HD22 LEU A 103 31.073 -22.913 -4.915 1.00 14.12 H new ATOM 0 HD23 LEU A 103 31.937 -22.301 -3.738 1.00 14.12 H new ATOM 1806 N ASP A 104 36.563 -22.700 -6.235 1.00 11.57 N ATOM 1807 CA ASP A 104 37.612 -23.529 -6.823 1.00 12.73 C ATOM 1808 C ASP A 104 38.723 -23.880 -5.841 1.00 17.64 C ATOM 1809 O ASP A 104 39.415 -24.888 -6.039 1.00 22.45 O ATOM 1810 CB ASP A 104 38.216 -22.823 -8.024 1.00 15.93 C ATOM 1811 CG ASP A 104 39.014 -23.768 -8.913 1.00 28.16 C ATOM 1812 OD1 ASP A 104 38.462 -24.828 -9.295 1.00 33.00 O ATOM 1813 OD2 ASP A 104 40.177 -23.451 -9.220 1.00 31.76 O ATOM 0 H ASP A 104 36.639 -21.859 -6.399 1.00 11.57 H new ATOM 0 HA ASP A 104 37.188 -24.360 -7.088 1.00 12.73 H new ATOM 0 HB2 ASP A 104 37.508 -22.414 -8.545 1.00 15.93 H new ATOM 0 HB3 ASP A 104 38.793 -22.106 -7.718 1.00 15.93 H new ATOM 1818 N SER A 105 38.871 -23.126 -4.780 1.00 17.11 N ATOM 1819 CA SER A 105 39.956 -23.301 -3.801 1.00 15.85 C ATOM 1820 C SER A 105 39.406 -23.124 -2.382 1.00 18.41 C ATOM 1821 O SER A 105 39.630 -22.092 -1.736 1.00 25.42 O ATOM 1822 CB SER A 105 41.093 -22.293 -4.069 1.00 23.76 C ATOM 1823 OG SER A 105 41.522 -22.317 -5.426 1.00 30.87 O ATOM 0 H SER A 105 38.339 -22.478 -4.589 1.00 17.11 H new ATOM 0 HA SER A 105 40.318 -24.196 -3.889 1.00 15.85 H new ATOM 0 HB2 SER A 105 40.791 -21.399 -3.842 1.00 23.76 H new ATOM 0 HB3 SER A 105 41.845 -22.494 -3.490 1.00 23.76 H new ATOM 0 HG SER A 105 42.070 -22.944 -5.536 1.00 30.87 H new ATOM 1829 N HIS A 106 38.733 -24.141 -1.831 1.00 15.20 N ATOM 1830 CA HIS A 106 38.607 -25.482 -2.367 1.00 14.30 C ATOM 1831 C HIS A 106 37.215 -26.038 -2.044 1.00 16.17 C ATOM 1832 O HIS A 106 37.041 -27.234 -1.857 1.00 14.79 O ATOM 1833 CB HIS A 106 39.697 -26.422 -1.803 1.00 16.77 C ATOM 1834 CG HIS A 106 41.086 -25.958 -2.112 1.00 18.22 C ATOM 1835 ND1 HIS A 106 41.724 -26.221 -3.313 1.00 21.11 N ATOM 1836 CD2 HIS A 106 41.943 -25.207 -1.387 1.00 17.32 C ATOM 1837 CE1 HIS A 106 42.908 -25.626 -3.314 1.00 18.23 C ATOM 1838 NE2 HIS A 106 43.070 -25.019 -2.151 1.00 20.54 N ATOM 0 H HIS A 106 38.314 -24.050 -1.086 1.00 15.20 H new ATOM 0 HA HIS A 106 38.725 -25.436 -3.329 1.00 14.30 H new ATOM 0 HB2 HIS A 106 39.591 -26.492 -0.841 1.00 16.77 H new ATOM 0 HB3 HIS A 106 39.570 -27.312 -2.168 1.00 16.77 H new ATOM 0 HD2 HIS A 106 41.797 -24.878 -0.529 1.00 17.32 H new ATOM 0 HE1 HIS A 106 43.521 -25.634 -4.014 1.00 18.23 H new ATOM 0 HE2 HIS A 106 43.768 -24.578 -1.911 1.00 20.54 H new ATOM 1846 N LEU A 107 36.202 -25.171 -2.064 1.00 13.86 N ATOM 1847 CA LEU A 107 34.889 -25.573 -1.580 1.00 11.41 C ATOM 1848 C LEU A 107 34.300 -26.726 -2.388 1.00 13.06 C ATOM 1849 O LEU A 107 33.797 -27.688 -1.812 1.00 15.28 O ATOM 1850 CB LEU A 107 33.925 -24.393 -1.569 1.00 11.24 C ATOM 1851 CG LEU A 107 34.170 -23.322 -0.517 1.00 11.56 C ATOM 1852 CD1 LEU A 107 33.298 -22.107 -0.823 1.00 14.58 C ATOM 1853 CD2 LEU A 107 33.866 -23.887 0.856 1.00 16.10 C ATOM 0 H LEU A 107 36.255 -24.361 -2.349 1.00 13.86 H new ATOM 0 HA LEU A 107 35.013 -25.887 -0.671 1.00 11.41 H new ATOM 0 HB2 LEU A 107 33.952 -23.972 -2.442 1.00 11.24 H new ATOM 0 HB3 LEU A 107 33.026 -24.737 -1.448 1.00 11.24 H new ATOM 0 HG LEU A 107 35.099 -23.042 -0.531 1.00 11.56 H new ATOM 0 HD11 LEU A 107 33.451 -21.422 -0.154 1.00 14.58 H new ATOM 0 HD12 LEU A 107 33.524 -21.759 -1.700 1.00 14.58 H new ATOM 0 HD13 LEU A 107 32.364 -22.367 -0.810 1.00 14.58 H new ATOM 0 HD21 LEU A 107 34.022 -23.205 1.528 1.00 16.10 H new ATOM 0 HD22 LEU A 107 32.939 -24.170 0.892 1.00 16.10 H new ATOM 0 HD23 LEU A 107 34.443 -24.648 1.028 1.00 16.10 H new ATOM 1865 N ILE A 108 34.373 -26.669 -3.716 1.00 12.45 N ATOM 1866 CA ILE A 108 33.708 -27.687 -4.520 1.00 11.01 C ATOM 1867 C ILE A 108 34.424 -29.024 -4.402 1.00 13.45 C ATOM 1868 O ILE A 108 33.783 -30.065 -4.231 1.00 14.34 O ATOM 1869 CB ILE A 108 33.591 -27.240 -5.986 1.00 11.96 C ATOM 1870 CG1 ILE A 108 32.536 -26.151 -6.078 1.00 13.12 C ATOM 1871 CG2 ILE A 108 33.233 -28.425 -6.860 1.00 14.51 C ATOM 1872 CD1 ILE A 108 32.490 -25.436 -7.403 1.00 15.46 C ATOM 0 H ILE A 108 34.792 -26.064 -4.161 1.00 12.45 H new ATOM 0 HA ILE A 108 32.808 -27.804 -4.177 1.00 11.01 H new ATOM 0 HB ILE A 108 34.438 -26.887 -6.300 1.00 11.96 H new ATOM 0 HG12 ILE A 108 31.666 -26.544 -5.905 1.00 13.12 H new ATOM 0 HG13 ILE A 108 32.698 -25.500 -5.377 1.00 13.12 H new ATOM 0 HG21 ILE A 108 33.161 -28.136 -7.783 1.00 14.51 H new ATOM 0 HG22 ILE A 108 33.924 -29.102 -6.786 1.00 14.51 H new ATOM 0 HG23 ILE A 108 32.385 -28.796 -6.571 1.00 14.51 H new ATOM 0 HD11 ILE A 108 31.795 -24.760 -7.382 1.00 15.46 H new ATOM 0 HD12 ILE A 108 33.347 -25.014 -7.573 1.00 15.46 H new ATOM 0 HD13 ILE A 108 32.299 -26.074 -8.109 1.00 15.46 H new ATOM 1884 N LYS A 109 35.755 -29.025 -4.445 1.00 14.33 N ATOM 1885 CA LYS A 109 36.440 -30.314 -4.424 1.00 15.58 C ATOM 1886 C LYS A 109 36.260 -31.065 -3.111 1.00 17.17 C ATOM 1887 O LYS A 109 36.383 -32.289 -3.099 1.00 21.20 O ATOM 1888 CB LYS A 109 37.929 -30.142 -4.741 1.00 19.46 C ATOM 1889 CG LYS A 109 38.744 -29.464 -3.709 1.00 20.98 C ATOM 1890 CD LYS A 109 40.238 -29.557 -4.015 1.00 24.54 C ATOM 1891 CE LYS A 109 40.610 -28.992 -5.379 1.00 25.46 C ATOM 1892 NZ LYS A 109 40.356 -27.527 -5.498 1.00 29.63 N ATOM 0 H LYS A 109 36.258 -28.329 -4.485 1.00 14.33 H new ATOM 0 HA LYS A 109 36.026 -30.855 -5.114 1.00 15.58 H new ATOM 0 HB2 LYS A 109 38.310 -31.020 -4.902 1.00 19.46 H new ATOM 0 HB3 LYS A 109 38.009 -29.642 -5.569 1.00 19.46 H new ATOM 0 HG2 LYS A 109 38.483 -28.532 -3.652 1.00 20.98 H new ATOM 0 HG3 LYS A 109 38.566 -29.862 -2.843 1.00 20.98 H new ATOM 0 HD2 LYS A 109 40.732 -29.081 -3.329 1.00 24.54 H new ATOM 0 HD3 LYS A 109 40.514 -30.486 -3.971 1.00 24.54 H new ATOM 0 HE2 LYS A 109 41.549 -29.166 -5.550 1.00 25.46 H new ATOM 0 HE3 LYS A 109 40.106 -29.458 -6.064 1.00 25.46 H new ATOM 0 HZ1 LYS A 109 40.669 -27.234 -6.278 1.00 29.63 H new ATOM 0 HZ2 LYS A 109 39.481 -27.373 -5.454 1.00 29.63 H new ATOM 0 HZ3 LYS A 109 40.766 -27.099 -4.834 1.00 29.63 H new ATOM 1906 N GLU A 110 35.986 -30.394 -2.001 1.00 12.66 N ATOM 1907 CA AGLU A 110 35.801 -31.103 -0.745 0.44 16.92 C ATOM 1908 CA BGLU A 110 35.801 -31.065 -0.724 0.56 16.85 C ATOM 1909 C GLU A 110 34.337 -31.381 -0.434 1.00 19.85 C ATOM 1910 O GLU A 110 34.049 -32.028 0.583 1.00 21.41 O ATOM 1911 CB AGLU A 110 36.444 -30.325 0.406 0.44 16.20 C ATOM 1912 CB BGLU A 110 36.390 -30.205 0.408 0.56 15.84 C ATOM 1913 CG AGLU A 110 37.980 -30.330 0.357 0.44 29.65 C ATOM 1914 CG BGLU A 110 37.867 -29.793 0.175 0.56 11.64 C ATOM 1915 CD AGLU A 110 38.578 -31.738 0.375 0.44 39.40 C ATOM 1916 CD BGLU A 110 38.481 -29.045 1.327 0.56 39.52 C ATOM 1917 OE1AGLU A 110 37.956 -32.674 0.938 0.44 26.64 O ATOM 1918 OE1BGLU A 110 39.722 -29.125 1.504 0.56 27.31 O ATOM 1919 OE2AGLU A 110 39.681 -31.921 -0.185 0.44 38.27 O ATOM 1920 OE2BGLU A 110 37.738 -28.362 2.070 0.56 38.87 O ATOM 0 H AGLU A 110 35.904 -29.539 -1.953 0.44 12.66 H new ATOM 0 H BGLU A 110 35.902 -29.539 -1.967 0.56 12.66 H new ATOM 0 HA AGLU A 110 36.239 -31.963 -0.843 0.44 16.85 H new ATOM 0 HA BGLU A 110 36.270 -31.913 -0.774 0.56 16.85 H new ATOM 0 HB2AGLU A 110 36.129 -29.408 0.385 0.44 15.84 H new ATOM 0 HB2BGLU A 110 35.851 -29.405 0.509 0.56 15.84 H new ATOM 0 HB3AGLU A 110 36.152 -30.706 1.249 0.44 15.84 H new ATOM 0 HB3BGLU A 110 36.327 -30.696 1.242 0.56 15.84 H new ATOM 0 HG2AGLU A 110 38.274 -29.870 -0.445 0.44 11.64 H new ATOM 0 HG2BGLU A 110 38.392 -30.590 0.002 0.56 11.64 H new ATOM 0 HG3AGLU A 110 38.324 -29.829 1.113 0.44 11.64 H new ATOM 0 HG3BGLU A 110 37.918 -29.241 -0.621 0.56 11.64 H new ATOM 1933 N ALA A 111 33.415 -30.940 -1.297 1.00 15.18 N ATOM 1934 CA ALA A 111 31.982 -31.100 -1.076 1.00 15.88 C ATOM 1935 C ALA A 111 31.550 -32.436 -1.654 1.00 19.15 C ATOM 1936 O ALA A 111 31.513 -32.604 -2.879 1.00 20.64 O ATOM 1937 CB ALA A 111 31.199 -29.953 -1.726 1.00 20.50 C ATOM 0 H ALA A 111 33.610 -30.537 -2.031 1.00 15.18 H new ATOM 0 HA ALA A 111 31.796 -31.078 -0.124 1.00 15.88 H new ATOM 0 HB1 ALA A 111 30.250 -30.078 -1.568 1.00 20.50 H new ATOM 0 HB2 ALA A 111 31.482 -29.109 -1.341 1.00 20.50 H new ATOM 0 HB3 ALA A 111 31.369 -29.945 -2.681 1.00 20.50 H new ATOM 1943 N GLY A 112 31.217 -33.378 -0.771 1.00 20.05 N ATOM 1944 CA GLY A 112 30.834 -34.707 -1.214 1.00 19.24 C ATOM 1945 C GLY A 112 29.345 -34.969 -1.105 1.00 25.65 C ATOM 1946 O GLY A 112 28.786 -35.735 -1.898 1.00 27.51 O ATOM 0 H GLY A 112 31.208 -33.264 0.081 1.00 20.05 H new ATOM 0 HA2 GLY A 112 31.110 -34.826 -2.136 1.00 19.24 H new ATOM 0 HA3 GLY A 112 31.312 -35.367 -0.687 1.00 19.24 H new ATOM 1950 N ASP A 113 28.684 -34.351 -0.135 1.00 18.25 N ATOM 1951 CA ASP A 113 27.251 -34.560 0.019 1.00 17.49 C ATOM 1952 C ASP A 113 26.508 -33.779 -1.043 1.00 20.15 C ATOM 1953 O ASP A 113 26.937 -32.704 -1.459 1.00 16.55 O ATOM 1954 CB ASP A 113 26.760 -34.124 1.392 1.00 14.78 C ATOM 1955 CG ASP A 113 27.268 -35.012 2.486 1.00 27.78 C ATOM 1956 OD1 ASP A 113 27.904 -36.056 2.179 1.00 26.56 O ATOM 1957 OD2 ASP A 113 27.001 -34.677 3.648 1.00 23.11 O ATOM 0 H ASP A 113 29.039 -33.815 0.436 1.00 18.25 H new ATOM 0 HA ASP A 113 27.080 -35.510 -0.076 1.00 17.49 H new ATOM 0 HB2 ASP A 113 27.044 -33.212 1.560 1.00 14.78 H new ATOM 0 HB3 ASP A 113 25.790 -34.125 1.402 1.00 14.78 H new ATOM 1962 N ALA A 114 25.367 -34.312 -1.473 1.00 18.88 N ATOM 1963 CA ALA A 114 24.635 -33.680 -2.571 1.00 20.54 C ATOM 1964 C ALA A 114 24.216 -32.260 -2.220 1.00 15.89 C ATOM 1965 O ALA A 114 24.283 -31.355 -3.064 1.00 18.10 O ATOM 1966 CB ALA A 114 23.407 -34.527 -2.933 1.00 23.86 C ATOM 0 H ALA A 114 25.005 -35.023 -1.152 1.00 18.88 H new ATOM 0 HA ALA A 114 25.227 -33.628 -3.338 1.00 20.54 H new ATOM 0 HB1 ALA A 114 22.925 -34.104 -3.661 1.00 23.86 H new ATOM 0 HB2 ALA A 114 23.694 -35.412 -3.207 1.00 23.86 H new ATOM 0 HB3 ALA A 114 22.825 -34.600 -2.160 1.00 23.86 H new ATOM 1972 N GLU A 115 23.757 -32.034 -0.983 1.00 17.81 N ATOM 1973 CA GLU A 115 23.265 -30.704 -0.627 1.00 21.25 C ATOM 1974 C GLU A 115 24.362 -29.645 -0.748 1.00 22.89 C ATOM 1975 O GLU A 115 24.112 -28.542 -1.250 1.00 25.78 O ATOM 1976 CB GLU A 115 22.692 -30.706 0.788 1.00 28.56 C ATOM 1977 CG GLU A 115 21.354 -31.446 0.910 1.00 30.87 C ATOM 1978 CD GLU A 115 21.477 -32.977 0.736 1.00 73.17 C ATOM 1979 OE1 GLU A 115 22.554 -33.583 1.047 1.00 29.18 O ATOM 1980 OE2 GLU A 115 20.475 -33.579 0.284 1.00 47.50 O ATOM 0 H GLU A 115 23.723 -32.620 -0.355 1.00 17.81 H new ATOM 0 HA GLU A 115 22.561 -30.477 -1.254 1.00 21.25 H new ATOM 0 HB2 GLU A 115 23.335 -31.115 1.388 1.00 28.56 H new ATOM 0 HB3 GLU A 115 22.573 -29.789 1.082 1.00 28.56 H new ATOM 0 HG2 GLU A 115 20.966 -31.257 1.779 1.00 30.87 H new ATOM 0 HG3 GLU A 115 20.740 -31.100 0.244 1.00 30.87 H new ATOM 1987 N SER A 116 25.582 -29.964 -0.321 1.00 12.89 N ATOM 1988 CA SER A 116 26.664 -28.993 -0.438 1.00 11.95 C ATOM 1989 C SER A 116 27.169 -28.894 -1.867 1.00 14.22 C ATOM 1990 O SER A 116 27.364 -27.793 -2.367 1.00 12.40 O ATOM 1991 CB SER A 116 27.823 -29.324 0.491 1.00 17.26 C ATOM 1992 OG SER A 116 28.371 -30.586 0.190 1.00 19.91 O ATOM 0 H SER A 116 25.800 -30.718 0.031 1.00 12.89 H new ATOM 0 HA SER A 116 26.295 -28.135 -0.176 1.00 11.95 H new ATOM 0 HB2 SER A 116 28.509 -28.643 0.412 1.00 17.26 H new ATOM 0 HB3 SER A 116 27.517 -29.312 1.411 1.00 17.26 H new ATOM 0 HG SER A 116 29.008 -30.747 0.713 1.00 19.91 H new ATOM 1998 N ARG A 117 27.410 -30.034 -2.527 1.00 12.30 N ATOM 1999 CA ARG A 117 27.967 -30.015 -3.872 1.00 11.93 C ATOM 2000 C ARG A 117 27.044 -29.321 -4.868 1.00 11.53 C ATOM 2001 O ARG A 117 27.504 -28.496 -5.666 1.00 13.01 O ATOM 2002 CB ARG A 117 28.271 -31.431 -4.328 1.00 14.83 C ATOM 2003 CG ARG A 117 29.041 -31.463 -5.605 1.00 24.15 C ATOM 2004 CD ARG A 117 29.729 -32.811 -5.798 1.00 23.69 C ATOM 2005 NE ARG A 117 30.635 -32.708 -6.935 1.00 22.48 N ATOM 2006 CZ ARG A 117 31.897 -32.307 -6.842 1.00 25.91 C ATOM 2007 NH1 ARG A 117 32.402 -31.994 -5.656 1.00 25.59 N ATOM 2008 NH2 ARG A 117 32.649 -32.227 -7.932 1.00 30.69 N ATOM 0 H ARG A 117 27.257 -30.819 -2.211 1.00 12.30 H new ATOM 0 HA ARG A 117 28.790 -29.502 -3.841 1.00 11.93 H new ATOM 0 HB2 ARG A 117 28.775 -31.889 -3.638 1.00 14.83 H new ATOM 0 HB3 ARG A 117 27.439 -31.917 -4.442 1.00 14.83 H new ATOM 0 HG2 ARG A 117 28.444 -31.291 -6.350 1.00 24.15 H new ATOM 0 HG3 ARG A 117 29.704 -30.755 -5.604 1.00 24.15 H new ATOM 0 HD2 ARG A 117 30.219 -33.057 -4.998 1.00 23.69 H new ATOM 0 HD3 ARG A 117 29.071 -33.506 -5.953 1.00 23.69 H new ATOM 0 HE ARG A 117 30.334 -32.920 -7.712 1.00 22.48 H new ATOM 0 HH11 ARG A 117 31.912 -32.051 -4.951 1.00 25.59 H new ATOM 0 HH12 ARG A 117 33.219 -31.734 -5.592 1.00 25.59 H new ATOM 0 HH21 ARG A 117 32.319 -32.435 -8.698 1.00 30.69 H new ATOM 0 HH22 ARG A 117 33.467 -31.967 -7.872 1.00 30.69 H new ATOM 2022 N VAL A 118 25.736 -29.589 -4.791 1.00 10.74 N ATOM 2023 CA VAL A 118 24.775 -28.926 -5.664 1.00 9.27 C ATOM 2024 C VAL A 118 24.697 -27.435 -5.368 1.00 9.81 C ATOM 2025 O VAL A 118 24.629 -26.618 -6.298 1.00 10.64 O ATOM 2026 CB VAL A 118 23.388 -29.584 -5.537 1.00 14.19 C ATOM 2027 CG1 VAL A 118 22.390 -28.823 -6.367 1.00 14.72 C ATOM 2028 CG2 VAL A 118 23.441 -31.041 -5.974 1.00 13.11 C ATOM 0 H VAL A 118 25.390 -30.151 -4.240 1.00 10.74 H new ATOM 0 HA VAL A 118 25.081 -29.028 -6.579 1.00 9.27 H new ATOM 0 HB VAL A 118 23.113 -29.559 -4.607 1.00 14.19 H new ATOM 0 HG11 VAL A 118 21.517 -29.239 -6.286 1.00 14.72 H new ATOM 0 HG12 VAL A 118 22.341 -27.906 -6.055 1.00 14.72 H new ATOM 0 HG13 VAL A 118 22.667 -28.833 -7.296 1.00 14.72 H new ATOM 0 HG21 VAL A 118 22.560 -31.437 -5.887 1.00 13.11 H new ATOM 0 HG22 VAL A 118 23.728 -31.091 -6.899 1.00 13.11 H new ATOM 0 HG23 VAL A 118 24.069 -31.524 -5.415 1.00 13.11 H new ATOM 2038 N PHE A 119 24.685 -27.055 -4.076 1.00 11.69 N ATOM 2039 CA PHE A 119 24.669 -25.637 -3.716 1.00 10.79 C ATOM 2040 C PHE A 119 25.863 -24.913 -4.320 1.00 8.11 C ATOM 2041 O PHE A 119 25.718 -23.814 -4.877 1.00 10.03 O ATOM 2042 CB PHE A 119 24.652 -25.496 -2.183 1.00 10.52 C ATOM 2043 CG PHE A 119 24.399 -24.122 -1.700 1.00 13.71 C ATOM 2044 CD1 PHE A 119 25.440 -23.239 -1.503 1.00 13.14 C ATOM 2045 CD2 PHE A 119 23.130 -23.719 -1.415 1.00 18.61 C ATOM 2046 CE1 PHE A 119 25.182 -21.940 -1.024 1.00 12.80 C ATOM 2047 CE2 PHE A 119 22.873 -22.442 -0.937 1.00 22.05 C ATOM 2048 CZ PHE A 119 23.894 -21.579 -0.762 1.00 11.81 C ATOM 0 H PHE A 119 24.686 -27.598 -3.409 1.00 11.69 H new ATOM 0 HA PHE A 119 23.867 -25.227 -4.076 1.00 10.79 H new ATOM 0 HB2 PHE A 119 23.971 -26.085 -1.822 1.00 10.52 H new ATOM 0 HB3 PHE A 119 25.504 -25.799 -1.832 1.00 10.52 H new ATOM 0 HD1 PHE A 119 26.313 -23.502 -1.687 1.00 13.14 H new ATOM 0 HD2 PHE A 119 22.423 -24.310 -1.543 1.00 18.61 H new ATOM 0 HE1 PHE A 119 25.879 -21.339 -0.889 1.00 12.80 H new ATOM 0 HE2 PHE A 119 22.002 -22.183 -0.739 1.00 22.05 H new ATOM 0 HZ PHE A 119 23.716 -20.719 -0.456 1.00 11.81 H new ATOM 2058 N TYR A 120 27.057 -25.496 -4.186 1.00 10.16 N ATOM 2059 CA TYR A 120 28.242 -24.807 -4.676 1.00 8.11 C ATOM 2060 C TYR A 120 28.278 -24.762 -6.198 1.00 7.77 C ATOM 2061 O TYR A 120 28.717 -23.760 -6.790 1.00 9.08 O ATOM 2062 CB TYR A 120 29.508 -25.434 -4.171 1.00 8.86 C ATOM 2063 CG TYR A 120 29.769 -25.282 -2.681 1.00 8.18 C ATOM 2064 CD1 TYR A 120 29.570 -24.085 -2.046 1.00 8.72 C ATOM 2065 CD2 TYR A 120 30.172 -26.361 -1.929 1.00 11.91 C ATOM 2066 CE1 TYR A 120 29.780 -23.962 -0.693 1.00 11.23 C ATOM 2067 CE2 TYR A 120 30.393 -26.244 -0.598 1.00 12.33 C ATOM 2068 CZ TYR A 120 30.222 -25.034 0.012 1.00 14.34 C ATOM 2069 OH TYR A 120 30.444 -24.961 1.370 1.00 15.96 O ATOM 0 H TYR A 120 27.196 -26.265 -3.826 1.00 10.16 H new ATOM 0 HA TYR A 120 28.186 -23.901 -4.333 1.00 8.11 H new ATOM 0 HB2 TYR A 120 29.489 -26.380 -4.385 1.00 8.86 H new ATOM 0 HB3 TYR A 120 30.256 -25.049 -4.655 1.00 8.86 H new ATOM 0 HD1 TYR A 120 29.289 -23.346 -2.536 1.00 8.72 H new ATOM 0 HD2 TYR A 120 30.295 -27.185 -2.342 1.00 11.91 H new ATOM 0 HE1 TYR A 120 29.621 -23.152 -0.265 1.00 11.23 H new ATOM 0 HE2 TYR A 120 30.660 -26.984 -0.102 1.00 12.33 H new ATOM 0 HH TYR A 120 30.837 -25.657 1.628 1.00 15.96 H new ATOM 2079 N LEU A 121 27.906 -25.863 -6.863 1.00 10.07 N ATOM 2080 CA LEU A 121 27.894 -25.853 -8.319 1.00 10.91 C ATOM 2081 C LEU A 121 26.849 -24.875 -8.859 1.00 10.31 C ATOM 2082 O LEU A 121 27.063 -24.244 -9.903 1.00 10.92 O ATOM 2083 CB LEU A 121 27.659 -27.269 -8.830 1.00 11.07 C ATOM 2084 CG LEU A 121 28.872 -28.202 -8.729 1.00 12.36 C ATOM 2085 CD1 LEU A 121 28.358 -29.653 -8.948 1.00 14.93 C ATOM 2086 CD2 LEU A 121 29.961 -27.824 -9.727 1.00 14.40 C ATOM 0 H LEU A 121 27.665 -26.603 -6.497 1.00 10.07 H new ATOM 0 HA LEU A 121 28.755 -25.545 -8.643 1.00 10.91 H new ATOM 0 HB2 LEU A 121 26.924 -27.660 -8.332 1.00 11.07 H new ATOM 0 HB3 LEU A 121 27.380 -27.222 -9.758 1.00 11.07 H new ATOM 0 HG LEU A 121 29.285 -28.124 -7.855 1.00 12.36 H new ATOM 0 HD11 LEU A 121 29.102 -30.272 -8.891 1.00 14.93 H new ATOM 0 HD12 LEU A 121 27.703 -29.871 -8.266 1.00 14.93 H new ATOM 0 HD13 LEU A 121 27.947 -29.722 -9.824 1.00 14.93 H new ATOM 0 HD21 LEU A 121 30.710 -28.433 -9.635 1.00 14.40 H new ATOM 0 HD22 LEU A 121 29.608 -27.880 -10.629 1.00 14.40 H new ATOM 0 HD23 LEU A 121 30.259 -26.917 -9.553 1.00 14.40 H new ATOM 2098 N LYS A 122 25.688 -24.792 -8.206 1.00 8.15 N ATOM 2099 CA LYS A 122 24.718 -23.750 -8.520 1.00 9.19 C ATOM 2100 C LYS A 122 25.342 -22.360 -8.399 1.00 10.52 C ATOM 2101 O LYS A 122 25.161 -21.513 -9.279 1.00 10.26 O ATOM 2102 CB LYS A 122 23.495 -23.841 -7.615 1.00 11.56 C ATOM 2103 CG LYS A 122 22.452 -22.744 -7.852 1.00 11.67 C ATOM 2104 CD LYS A 122 21.352 -22.817 -6.793 1.00 12.36 C ATOM 2105 CE LYS A 122 20.518 -21.561 -6.739 1.00 12.13 C ATOM 2106 NZ LYS A 122 21.361 -20.403 -6.276 1.00 15.90 N ATOM 0 H LYS A 122 25.446 -25.330 -7.580 1.00 8.15 H new ATOM 0 HA LYS A 122 24.438 -23.889 -9.438 1.00 9.19 H new ATOM 0 HB2 LYS A 122 23.074 -24.706 -7.743 1.00 11.56 H new ATOM 0 HB3 LYS A 122 23.786 -23.802 -6.691 1.00 11.56 H new ATOM 0 HG2 LYS A 122 22.878 -21.873 -7.825 1.00 11.67 H new ATOM 0 HG3 LYS A 122 22.065 -22.843 -8.736 1.00 11.67 H new ATOM 0 HD2 LYS A 122 20.777 -23.576 -6.980 1.00 12.36 H new ATOM 0 HD3 LYS A 122 21.754 -22.973 -5.924 1.00 12.36 H new ATOM 0 HE2 LYS A 122 20.148 -21.371 -7.615 1.00 12.13 H new ATOM 0 HE3 LYS A 122 19.769 -21.687 -6.136 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 20.834 -19.761 -5.957 1.00 15.90 H new ATOM 0 HZ2 LYS A 122 21.915 -20.676 -5.636 1.00 15.90 H new ATOM 0 HZ3 LYS A 122 21.833 -20.086 -6.961 1.00 15.90 H new ATOM 2120 N MET A 123 26.036 -22.097 -7.288 1.00 11.36 N ATOM 2121 CA AMET A 123 26.723 -20.818 -7.133 0.59 10.34 C ATOM 2122 CA BMET A 123 26.727 -20.822 -7.126 0.41 10.37 C ATOM 2123 C MET A 123 27.705 -20.567 -8.264 1.00 8.84 C ATOM 2124 O MET A 123 27.783 -19.445 -8.769 1.00 9.37 O ATOM 2125 CB AMET A 123 27.462 -20.743 -5.802 0.59 12.16 C ATOM 2126 CB BMET A 123 27.453 -20.793 -5.783 0.41 12.30 C ATOM 2127 CG AMET A 123 26.558 -20.537 -4.625 0.59 10.54 C ATOM 2128 CG BMET A 123 27.783 -19.426 -5.284 0.41 10.25 C ATOM 2129 SD AMET A 123 27.579 -20.132 -3.173 0.59 14.66 S ATOM 2130 SD BMET A 123 28.556 -19.487 -3.652 0.41 12.91 S ATOM 2131 CE AMET A 123 28.038 -18.444 -3.441 0.59 7.79 C ATOM 2132 CE BMET A 123 27.448 -20.519 -2.726 0.41 19.01 C ATOM 0 H AMET A 123 26.119 -22.638 -6.624 0.59 11.36 H new ATOM 0 H BMET A 123 26.117 -22.639 -6.625 0.41 11.36 H new ATOM 0 HA AMET A 123 26.038 -20.132 -7.156 0.59 10.37 H new ATOM 0 HA BMET A 123 26.064 -20.115 -7.147 0.41 10.37 H new ATOM 0 HB2AMET A 123 27.966 -21.562 -5.674 0.59 12.30 H new ATOM 0 HB2BMET A 123 26.903 -21.242 -5.122 0.41 12.30 H new ATOM 0 HB3AMET A 123 28.104 -20.017 -5.838 0.59 12.30 H new ATOM 0 HB3BMET A 123 28.275 -21.303 -5.862 0.41 12.30 H new ATOM 0 HG2AMET A 123 25.929 -19.821 -4.805 0.59 10.25 H new ATOM 0 HG2BMET A 123 28.380 -18.987 -5.910 0.41 10.25 H new ATOM 0 HG3AMET A 123 26.036 -21.337 -4.457 0.59 10.25 H new ATOM 0 HG3BMET A 123 26.974 -18.892 -5.241 0.41 10.25 H new ATOM 0 HE1AMET A 123 28.368 -18.063 -2.612 0.59 19.01 H new ATOM 0 HE1BMET A 123 27.572 -20.358 -1.778 0.41 19.01 H new ATOM 0 HE2AMET A 123 28.734 -18.401 -4.116 0.59 19.01 H new ATOM 0 HE2BMET A 123 26.532 -20.313 -2.971 0.41 19.01 H new ATOM 0 HE3AMET A 123 27.265 -17.942 -3.742 0.59 19.01 H new ATOM 0 HE3BMET A 123 27.633 -21.451 -2.922 0.41 19.01 H new ATOM 2151 N LYS A 124 28.465 -21.593 -8.668 1.00 8.43 N ATOM 2152 CA LYS A 124 29.413 -21.421 -9.748 1.00 9.41 C ATOM 2153 C LYS A 124 28.699 -21.033 -11.036 1.00 9.96 C ATOM 2154 O LYS A 124 29.106 -20.082 -11.701 1.00 10.22 O ATOM 2155 CB LYS A 124 30.234 -22.696 -9.893 1.00 9.30 C ATOM 2156 CG LYS A 124 31.268 -22.652 -11.028 1.00 10.45 C ATOM 2157 CD LYS A 124 32.151 -23.912 -10.997 1.00 13.89 C ATOM 2158 CE LYS A 124 33.170 -23.874 -12.119 1.00 19.70 C ATOM 2159 NZ LYS A 124 34.095 -25.049 -11.976 1.00 28.57 N ATOM 0 H LYS A 124 28.440 -22.383 -8.328 1.00 8.43 H new ATOM 0 HA LYS A 124 30.021 -20.693 -9.546 1.00 9.41 H new ATOM 0 HB2 LYS A 124 30.694 -22.870 -9.057 1.00 9.30 H new ATOM 0 HB3 LYS A 124 29.632 -23.441 -10.046 1.00 9.30 H new ATOM 0 HG2 LYS A 124 30.815 -22.588 -11.884 1.00 10.45 H new ATOM 0 HG3 LYS A 124 31.821 -21.860 -10.939 1.00 10.45 H new ATOM 0 HD2 LYS A 124 32.605 -23.974 -10.142 1.00 13.89 H new ATOM 0 HD3 LYS A 124 31.597 -24.704 -11.082 1.00 13.89 H new ATOM 0 HE2 LYS A 124 32.723 -23.902 -12.979 1.00 19.70 H new ATOM 0 HE3 LYS A 124 33.673 -23.045 -12.087 1.00 19.70 H new ATOM 0 HZ1 LYS A 124 34.641 -25.084 -12.678 1.00 28.57 H new ATOM 0 HZ2 LYS A 124 34.574 -24.961 -11.231 1.00 28.57 H new ATOM 0 HZ3 LYS A 124 33.618 -25.799 -11.934 1.00 28.57 H new ATOM 2173 N GLY A 125 27.608 -21.730 -11.379 1.00 8.22 N ATOM 2174 CA GLY A 125 26.787 -21.308 -12.511 1.00 9.90 C ATOM 2175 C GLY A 125 26.265 -19.880 -12.386 1.00 8.46 C ATOM 2176 O GLY A 125 26.348 -19.104 -13.340 1.00 9.82 O ATOM 0 H GLY A 125 27.333 -22.437 -10.974 1.00 8.22 H new ATOM 0 HA2 GLY A 125 27.308 -21.384 -13.325 1.00 9.90 H new ATOM 0 HA3 GLY A 125 26.034 -21.913 -12.599 1.00 9.90 H new ATOM 2180 N ASP A 126 25.782 -19.506 -11.196 1.00 9.47 N ATOM 2181 CA ASP A 126 25.247 -18.168 -10.969 1.00 7.28 C ATOM 2182 C ASP A 126 26.297 -17.092 -11.221 1.00 9.93 C ATOM 2183 O ASP A 126 26.009 -16.094 -11.878 1.00 9.71 O ATOM 2184 CB ASP A 126 24.736 -18.016 -9.535 1.00 7.31 C ATOM 2185 CG ASP A 126 23.447 -18.800 -9.261 1.00 13.01 C ATOM 2186 OD1 ASP A 126 22.715 -19.146 -10.217 1.00 12.49 O ATOM 2187 OD2 ASP A 126 23.158 -18.971 -8.065 1.00 11.69 O ATOM 0 H ASP A 126 25.757 -20.019 -10.506 1.00 9.47 H new ATOM 0 HA ASP A 126 24.515 -18.054 -11.595 1.00 7.28 H new ATOM 0 HB2 ASP A 126 25.425 -18.314 -8.920 1.00 7.31 H new ATOM 0 HB3 ASP A 126 24.580 -17.076 -9.352 1.00 7.31 H new ATOM 2192 N TYR A 127 27.524 -17.265 -10.703 1.00 10.01 N ATOM 2193 CA TYR A 127 28.504 -16.175 -10.820 1.00 10.35 C ATOM 2194 C TYR A 127 29.118 -16.140 -12.216 1.00 10.72 C ATOM 2195 O TYR A 127 29.451 -15.046 -12.692 1.00 10.48 O ATOM 2196 CB TYR A 127 29.528 -16.241 -9.660 1.00 9.32 C ATOM 2197 CG TYR A 127 28.857 -15.702 -8.403 1.00 9.16 C ATOM 2198 CD1 TYR A 127 28.063 -16.507 -7.619 1.00 8.56 C ATOM 2199 CD2 TYR A 127 28.944 -14.383 -8.054 1.00 8.68 C ATOM 2200 CE1 TYR A 127 27.364 -16.025 -6.540 1.00 9.78 C ATOM 2201 CE2 TYR A 127 28.278 -13.863 -6.951 1.00 9.46 C ATOM 2202 CZ TYR A 127 27.495 -14.683 -6.192 1.00 11.49 C ATOM 2203 OH TYR A 127 26.810 -14.167 -5.126 1.00 13.77 O ATOM 0 H TYR A 127 27.799 -17.972 -10.298 1.00 10.01 H new ATOM 0 HA TYR A 127 28.057 -15.319 -10.723 1.00 10.35 H new ATOM 0 HB2 TYR A 127 29.823 -17.154 -9.521 1.00 9.32 H new ATOM 0 HB3 TYR A 127 30.316 -15.718 -9.874 1.00 9.32 H new ATOM 0 HD1 TYR A 127 27.997 -17.411 -7.828 1.00 8.56 H new ATOM 0 HD2 TYR A 127 29.467 -13.815 -8.572 1.00 8.68 H new ATOM 0 HE1 TYR A 127 26.810 -16.587 -6.048 1.00 9.78 H new ATOM 0 HE2 TYR A 127 28.365 -12.963 -6.732 1.00 9.46 H new ATOM 0 HH TYR A 127 26.607 -13.367 -5.284 1.00 13.77 H new ATOM 2213 N TYR A 128 29.200 -17.279 -12.920 1.00 10.30 N ATOM 2214 CA TYR A 128 29.503 -17.200 -14.345 1.00 8.14 C ATOM 2215 C TYR A 128 28.361 -16.514 -15.102 1.00 10.36 C ATOM 2216 O TYR A 128 28.603 -15.784 -16.068 1.00 10.45 O ATOM 2217 CB TYR A 128 29.805 -18.593 -14.935 1.00 9.06 C ATOM 2218 CG TYR A 128 31.252 -19.025 -14.764 1.00 9.47 C ATOM 2219 CD1 TYR A 128 32.278 -18.333 -15.407 1.00 14.18 C ATOM 2220 CD2 TYR A 128 31.593 -20.073 -13.955 1.00 11.69 C ATOM 2221 CE1 TYR A 128 33.572 -18.692 -15.261 1.00 15.17 C ATOM 2222 CE2 TYR A 128 32.935 -20.433 -13.776 1.00 14.65 C ATOM 2223 CZ TYR A 128 33.908 -19.740 -14.451 1.00 15.43 C ATOM 2224 OH TYR A 128 35.257 -20.079 -14.323 1.00 19.53 O ATOM 0 H TYR A 128 29.088 -18.071 -12.604 1.00 10.30 H new ATOM 0 HA TYR A 128 30.303 -16.662 -14.451 1.00 8.14 H new ATOM 0 HB2 TYR A 128 29.228 -19.247 -14.512 1.00 9.06 H new ATOM 0 HB3 TYR A 128 29.586 -18.590 -15.880 1.00 9.06 H new ATOM 0 HD1 TYR A 128 32.066 -17.607 -15.949 1.00 14.18 H new ATOM 0 HD2 TYR A 128 30.926 -20.552 -13.518 1.00 11.69 H new ATOM 0 HE1 TYR A 128 34.237 -18.224 -15.713 1.00 15.17 H new ATOM 0 HE2 TYR A 128 33.163 -21.132 -13.207 1.00 14.65 H new ATOM 0 HH TYR A 128 35.729 -19.391 -14.420 1.00 19.53 H new ATOM 2234 N ARG A 129 27.099 -16.772 -14.708 1.00 9.25 N ATOM 2235 CA ARG A 129 25.979 -16.089 -15.344 1.00 10.11 C ATOM 2236 C ARG A 129 26.082 -14.572 -15.156 1.00 11.05 C ATOM 2237 O ARG A 129 25.820 -13.826 -16.091 1.00 11.46 O ATOM 2238 CB ARG A 129 24.648 -16.622 -14.833 1.00 11.28 C ATOM 2239 CG ARG A 129 23.442 -15.806 -15.266 1.00 10.17 C ATOM 2240 CD ARG A 129 22.105 -16.589 -15.098 1.00 10.95 C ATOM 2241 NE ARG A 129 21.863 -17.001 -13.715 1.00 10.00 N ATOM 2242 CZ ARG A 129 21.240 -16.267 -12.819 1.00 11.23 C ATOM 2243 NH1 ARG A 129 20.732 -15.101 -13.143 1.00 12.01 N ATOM 2244 NH2 ARG A 129 21.114 -16.721 -11.590 1.00 11.09 N ATOM 0 H ARG A 129 26.883 -17.328 -14.088 1.00 9.25 H new ATOM 0 HA ARG A 129 26.020 -16.271 -16.296 1.00 10.11 H new ATOM 0 HB2 ARG A 129 24.536 -17.534 -15.143 1.00 11.28 H new ATOM 0 HB3 ARG A 129 24.674 -16.652 -13.864 1.00 11.28 H new ATOM 0 HG2 ARG A 129 23.403 -14.989 -14.745 1.00 10.17 H new ATOM 0 HG3 ARG A 129 23.547 -15.545 -16.194 1.00 10.17 H new ATOM 0 HD2 ARG A 129 21.369 -16.034 -15.400 1.00 10.95 H new ATOM 0 HD3 ARG A 129 22.120 -17.374 -15.668 1.00 10.95 H new ATOM 0 HE ARG A 129 22.147 -17.775 -13.472 1.00 10.00 H new ATOM 0 HH11 ARG A 129 20.805 -14.809 -13.949 1.00 12.01 H new ATOM 0 HH12 ARG A 129 20.326 -14.629 -12.550 1.00 12.01 H new ATOM 0 HH21 ARG A 129 21.437 -17.490 -11.380 1.00 11.09 H new ATOM 0 HH22 ARG A 129 20.708 -16.249 -10.997 1.00 11.09 H new ATOM 2258 N TYR A 130 26.464 -14.111 -13.971 1.00 9.74 N ATOM 2259 CA TYR A 130 26.594 -12.667 -13.738 1.00 11.88 C ATOM 2260 C TYR A 130 27.724 -12.112 -14.595 1.00 11.48 C ATOM 2261 O TYR A 130 27.610 -11.007 -15.158 1.00 13.32 O ATOM 2262 CB TYR A 130 26.813 -12.371 -12.239 1.00 9.19 C ATOM 2263 CG TYR A 130 25.758 -12.918 -11.313 1.00 10.31 C ATOM 2264 CD1 TYR A 130 24.441 -13.090 -11.725 1.00 9.11 C ATOM 2265 CD2 TYR A 130 26.085 -13.284 -10.025 1.00 9.58 C ATOM 2266 CE1 TYR A 130 23.492 -13.639 -10.895 1.00 10.98 C ATOM 2267 CE2 TYR A 130 25.145 -13.848 -9.165 1.00 10.05 C ATOM 2268 CZ TYR A 130 23.847 -14.036 -9.599 1.00 11.47 C ATOM 2269 OH TYR A 130 22.930 -14.612 -8.724 1.00 13.72 O ATOM 0 H TYR A 130 26.652 -14.606 -13.293 1.00 9.74 H new ATOM 0 HA TYR A 130 25.770 -12.225 -13.997 1.00 11.88 H new ATOM 0 HB2 TYR A 130 27.673 -12.734 -11.975 1.00 9.19 H new ATOM 0 HB3 TYR A 130 26.861 -11.410 -12.118 1.00 9.19 H new ATOM 0 HD1 TYR A 130 24.196 -12.827 -12.583 1.00 9.11 H new ATOM 0 HD2 TYR A 130 26.954 -13.151 -9.723 1.00 9.58 H new ATOM 0 HE1 TYR A 130 22.618 -13.746 -11.193 1.00 10.98 H new ATOM 0 HE2 TYR A 130 25.390 -14.097 -8.303 1.00 10.05 H new ATOM 0 HH TYR A 130 22.249 -14.856 -9.152 1.00 13.72 H new ATOM 2279 N LEU A 131 28.813 -12.875 -14.728 1.00 10.40 N ATOM 2280 CA LEU A 131 29.874 -12.462 -15.656 1.00 10.23 C ATOM 2281 C LEU A 131 29.341 -12.386 -17.090 1.00 12.27 C ATOM 2282 O LEU A 131 29.662 -11.459 -17.852 1.00 10.99 O ATOM 2283 CB LEU A 131 31.057 -13.421 -15.575 1.00 10.13 C ATOM 2284 CG LEU A 131 31.945 -13.355 -14.311 1.00 10.73 C ATOM 2285 CD1 LEU A 131 33.009 -14.423 -14.323 1.00 12.99 C ATOM 2286 CD2 LEU A 131 32.555 -11.955 -14.169 1.00 13.83 C ATOM 0 H LEU A 131 28.956 -13.611 -14.306 1.00 10.40 H new ATOM 0 HA LEU A 131 30.177 -11.577 -15.398 1.00 10.23 H new ATOM 0 HB2 LEU A 131 30.715 -14.325 -15.654 1.00 10.13 H new ATOM 0 HB3 LEU A 131 31.623 -13.264 -16.347 1.00 10.13 H new ATOM 0 HG LEU A 131 31.386 -13.526 -13.537 1.00 10.73 H new ATOM 0 HD11 LEU A 131 33.547 -14.354 -13.519 1.00 12.99 H new ATOM 0 HD12 LEU A 131 32.590 -15.297 -14.357 1.00 12.99 H new ATOM 0 HD13 LEU A 131 33.576 -14.306 -15.101 1.00 12.99 H new ATOM 0 HD21 LEU A 131 33.110 -11.923 -13.374 1.00 13.83 H new ATOM 0 HD22 LEU A 131 33.096 -11.757 -14.949 1.00 13.83 H new ATOM 0 HD23 LEU A 131 31.845 -11.299 -14.094 1.00 13.83 H new ATOM 2298 N ALA A 132 28.482 -13.335 -17.462 1.00 12.18 N ATOM 2299 CA ALA A 132 27.945 -13.360 -18.819 1.00 12.95 C ATOM 2300 C ALA A 132 27.056 -12.161 -19.107 1.00 11.02 C ATOM 2301 O ALA A 132 26.976 -11.726 -20.269 1.00 14.10 O ATOM 2302 CB ALA A 132 27.176 -14.666 -19.043 1.00 14.42 C ATOM 0 H ALA A 132 28.201 -13.966 -16.949 1.00 12.18 H new ATOM 0 HA ALA A 132 28.692 -13.312 -19.436 1.00 12.95 H new ATOM 0 HB1 ALA A 132 26.820 -14.681 -19.945 1.00 14.42 H new ATOM 0 HB2 ALA A 132 27.774 -15.419 -18.919 1.00 14.42 H new ATOM 0 HB3 ALA A 132 26.446 -14.725 -18.407 1.00 14.42 H new ATOM 2308 N GLU A 133 26.351 -11.655 -18.091 1.00 14.03 N ATOM 2309 CA GLU A 133 25.454 -10.531 -18.269 1.00 14.17 C ATOM 2310 C GLU A 133 26.208 -9.304 -18.772 1.00 11.75 C ATOM 2311 O GLU A 133 25.621 -8.446 -19.444 1.00 15.64 O ATOM 2312 CB GLU A 133 24.760 -10.190 -16.944 1.00 16.57 C ATOM 2313 CG GLU A 133 23.689 -11.157 -16.485 1.00 14.81 C ATOM 2314 CD GLU A 133 23.085 -10.816 -15.119 1.00 19.41 C ATOM 2315 OE1 GLU A 133 23.637 -9.989 -14.345 1.00 18.66 O ATOM 2316 OE2 GLU A 133 22.035 -11.395 -14.803 1.00 19.10 O ATOM 0 H GLU A 133 26.385 -11.958 -17.287 1.00 14.03 H new ATOM 0 HA GLU A 133 24.790 -10.783 -18.929 1.00 14.17 H new ATOM 0 HB2 GLU A 133 25.436 -10.132 -16.251 1.00 16.57 H new ATOM 0 HB3 GLU A 133 24.362 -9.309 -17.026 1.00 16.57 H new ATOM 0 HG2 GLU A 133 22.979 -11.177 -17.146 1.00 14.81 H new ATOM 0 HG3 GLU A 133 24.067 -12.050 -16.447 1.00 14.81 H new ATOM 2323 N VAL A 134 27.503 -9.200 -18.471 1.00 11.49 N ATOM 2324 CA VAL A 134 28.274 -8.024 -18.876 1.00 13.64 C ATOM 2325 C VAL A 134 29.316 -8.332 -19.938 1.00 17.26 C ATOM 2326 O VAL A 134 30.057 -7.421 -20.366 1.00 18.88 O ATOM 2327 CB VAL A 134 28.928 -7.331 -17.668 1.00 13.77 C ATOM 2328 CG1 VAL A 134 27.870 -7.005 -16.641 1.00 14.65 C ATOM 2329 CG2 VAL A 134 30.037 -8.183 -17.030 1.00 13.35 C ATOM 0 H VAL A 134 27.950 -9.793 -18.037 1.00 11.49 H new ATOM 0 HA VAL A 134 27.633 -7.414 -19.274 1.00 13.64 H new ATOM 0 HB VAL A 134 29.346 -6.516 -17.988 1.00 13.77 H new ATOM 0 HG11 VAL A 134 28.282 -6.568 -15.879 1.00 14.65 H new ATOM 0 HG12 VAL A 134 27.209 -6.414 -17.034 1.00 14.65 H new ATOM 0 HG13 VAL A 134 27.439 -7.823 -16.349 1.00 14.65 H new ATOM 0 HG21 VAL A 134 30.418 -7.707 -16.276 1.00 13.35 H new ATOM 0 HG22 VAL A 134 29.664 -9.025 -16.725 1.00 13.35 H new ATOM 0 HG23 VAL A 134 30.730 -8.356 -17.686 1.00 13.35 H new ATOM 2339 N ALA A 135 29.388 -9.562 -20.400 1.00 16.89 N ATOM 2340 CA ALA A 135 30.429 -9.989 -21.310 1.00 15.13 C ATOM 2341 C ALA A 135 30.077 -9.604 -22.726 1.00 18.57 C ATOM 2342 O ALA A 135 28.912 -9.678 -23.128 1.00 21.30 O ATOM 2343 CB ALA A 135 30.606 -11.511 -21.218 1.00 17.59 C ATOM 0 H ALA A 135 28.828 -10.181 -20.193 1.00 16.89 H new ATOM 0 HA ALA A 135 31.259 -9.552 -21.063 1.00 15.13 H new ATOM 0 HB1 ALA A 135 31.304 -11.793 -21.829 1.00 17.59 H new ATOM 0 HB2 ALA A 135 30.852 -11.754 -20.312 1.00 17.59 H new ATOM 0 HB3 ALA A 135 29.773 -11.949 -21.455 1.00 17.59 H new ATOM 2349 N THR A 136 31.095 -9.179 -23.477 1.00 24.24 N ATOM 2350 CA THR A 136 30.872 -8.739 -24.861 1.00 33.00 C ATOM 2351 C THR A 136 31.914 -9.223 -25.857 1.00 45.17 C ATOM 2352 O THR A 136 31.615 -9.263 -27.055 1.00 57.06 O ATOM 2353 CB THR A 136 30.821 -7.200 -24.944 1.00 33.44 C ATOM 2354 OG1 THR A 136 32.021 -6.653 -24.377 1.00 33.78 O ATOM 2355 CG2 THR A 136 29.617 -6.638 -24.211 1.00 31.12 C ATOM 0 H THR A 136 31.912 -9.137 -23.211 1.00 24.24 H new ATOM 0 HA THR A 136 30.024 -9.140 -25.107 1.00 33.00 H new ATOM 0 HB THR A 136 30.745 -6.953 -25.879 1.00 33.44 H new ATOM 0 HG1 THR A 136 31.830 -5.979 -23.913 1.00 33.78 H new ATOM 0 HG21 THR A 136 29.616 -5.671 -24.283 1.00 31.12 H new ATOM 0 HG22 THR A 136 28.804 -6.992 -24.605 1.00 31.12 H new ATOM 0 HG23 THR A 136 29.660 -6.892 -23.276 1.00 31.12 H new ATOM 2363 N GLY A 137 33.109 -9.591 -25.431 1.00 37.17 N ATOM 2364 CA GLY A 137 34.216 -9.858 -26.328 1.00 59.65 C ATOM 2365 C GLY A 137 34.440 -11.330 -26.600 1.00 48.36 C ATOM 2366 O GLY A 137 33.498 -12.130 -26.641 1.00 47.40 O ATOM 0 H GLY A 137 33.303 -9.694 -24.600 1.00 37.17 H new ATOM 0 HA2 GLY A 137 34.057 -9.403 -27.170 1.00 59.65 H new ATOM 0 HA3 GLY A 137 35.026 -9.481 -25.950 1.00 59.65 H new ATOM 2370 N ASP A 138 35.715 -11.692 -26.780 1.00 36.10 N ATOM 2371 CA ASP A 138 36.076 -13.037 -27.210 1.00 53.58 C ATOM 2372 C ASP A 138 35.750 -14.103 -26.172 1.00 40.44 C ATOM 2373 O ASP A 138 35.629 -15.277 -26.532 1.00 51.68 O ATOM 2374 CB ASP A 138 37.575 -13.112 -27.529 1.00 70.79 C ATOM 2375 CG ASP A 138 37.928 -12.510 -28.879 1.00 96.78 C ATOM 2376 OD1 ASP A 138 37.031 -11.929 -29.529 1.00 85.81 O ATOM 2377 OD2 ASP A 138 39.107 -12.628 -29.290 1.00 85.23 O ATOM 0 H ASP A 138 36.385 -11.167 -26.656 1.00 36.10 H new ATOM 0 HA ASP A 138 35.545 -13.216 -28.002 1.00 53.58 H new ATOM 0 HB2 ASP A 138 38.071 -12.650 -26.835 1.00 70.79 H new ATOM 0 HB3 ASP A 138 37.858 -14.040 -27.511 1.00 70.79 H new ATOM 2382 N ASP A 139 35.624 -13.730 -24.903 1.00 43.75 N ATOM 2383 CA ASP A 139 35.388 -14.698 -23.845 1.00 64.56 C ATOM 2384 C ASP A 139 33.911 -14.930 -23.557 1.00 32.42 C ATOM 2385 O ASP A 139 33.600 -15.795 -22.739 1.00 31.06 O ATOM 2386 CB ASP A 139 36.105 -14.260 -22.563 1.00 70.54 C ATOM 2387 CG ASP A 139 37.559 -14.701 -22.536 1.00 76.55 C ATOM 2388 OD1 ASP A 139 38.454 -13.843 -22.694 1.00 95.14 O ATOM 2389 OD2 ASP A 139 37.801 -15.917 -22.380 1.00 74.66 O ATOM 0 H ASP A 139 35.673 -12.914 -24.635 1.00 43.75 H new ATOM 0 HA ASP A 139 35.747 -15.543 -24.159 1.00 64.56 H new ATOM 0 HB2 ASP A 139 36.061 -13.294 -22.484 1.00 70.54 H new ATOM 0 HB3 ASP A 139 35.643 -14.629 -21.794 1.00 70.54 H new ATOM 2394 N LYS A 140 33.001 -14.226 -24.231 1.00 27.25 N ATOM 2395 CA LYS A 140 31.580 -14.364 -23.926 1.00 25.71 C ATOM 2396 C LYS A 140 31.111 -15.811 -24.086 1.00 23.29 C ATOM 2397 O LYS A 140 30.430 -16.352 -23.216 1.00 18.31 O ATOM 2398 CB LYS A 140 30.774 -13.444 -24.829 1.00 30.82 C ATOM 2399 CG LYS A 140 29.311 -13.351 -24.483 1.00 29.52 C ATOM 2400 CD LYS A 140 28.562 -12.501 -25.520 1.00 53.02 C ATOM 2401 CE LYS A 140 27.049 -12.625 -25.370 1.00 61.16 C ATOM 2402 NZ LYS A 140 26.337 -12.017 -26.539 1.00 87.88 N ATOM 0 H LYS A 140 33.184 -13.670 -24.861 1.00 27.25 H new ATOM 0 HA LYS A 140 31.441 -14.112 -23.000 1.00 25.71 H new ATOM 0 HB2 LYS A 140 31.160 -12.555 -24.793 1.00 30.82 H new ATOM 0 HB3 LYS A 140 30.859 -13.753 -25.745 1.00 30.82 H new ATOM 0 HG2 LYS A 140 28.925 -14.240 -24.447 1.00 29.52 H new ATOM 0 HG3 LYS A 140 29.206 -12.960 -23.601 1.00 29.52 H new ATOM 0 HD2 LYS A 140 28.821 -11.571 -25.424 1.00 53.02 H new ATOM 0 HD3 LYS A 140 28.822 -12.777 -26.413 1.00 53.02 H new ATOM 0 HE2 LYS A 140 26.805 -13.560 -25.290 1.00 61.16 H new ATOM 0 HE3 LYS A 140 26.766 -12.187 -24.552 1.00 61.16 H new ATOM 0 HZ1 LYS A 140 25.458 -12.102 -26.428 1.00 87.88 H new ATOM 0 HZ2 LYS A 140 26.546 -11.154 -26.598 1.00 87.88 H new ATOM 0 HZ3 LYS A 140 26.583 -12.434 -27.286 1.00 87.88 H new ATOM 2416 N LYS A 141 31.465 -16.463 -25.189 1.00 21.85 N ATOM 2417 CA LYS A 141 30.980 -17.827 -25.390 1.00 21.17 C ATOM 2418 C LYS A 141 31.525 -18.774 -24.329 1.00 18.42 C ATOM 2419 O LYS A 141 30.826 -19.699 -23.894 1.00 17.40 O ATOM 2420 CB LYS A 141 31.329 -18.312 -26.805 1.00 20.76 C ATOM 2421 CG LYS A 141 30.414 -17.717 -27.854 1.00 24.62 C ATOM 2422 CD LYS A 141 30.790 -18.213 -29.267 1.00 31.83 C ATOM 2423 CE LYS A 141 29.847 -17.631 -30.315 1.00 59.31 C ATOM 2424 NZ LYS A 141 30.219 -18.057 -31.698 1.00 61.78 N ATOM 0 H LYS A 141 31.967 -16.149 -25.813 1.00 21.85 H new ATOM 0 HA LYS A 141 30.014 -17.822 -25.298 1.00 21.17 H new ATOM 0 HB2 LYS A 141 32.248 -18.077 -27.008 1.00 20.76 H new ATOM 0 HB3 LYS A 141 31.270 -19.280 -26.838 1.00 20.76 H new ATOM 0 HG2 LYS A 141 29.495 -17.956 -27.658 1.00 24.62 H new ATOM 0 HG3 LYS A 141 30.468 -16.749 -27.823 1.00 24.62 H new ATOM 0 HD2 LYS A 141 31.704 -17.959 -29.471 1.00 31.83 H new ATOM 0 HD3 LYS A 141 30.753 -19.182 -29.295 1.00 31.83 H new ATOM 0 HE2 LYS A 141 28.939 -17.912 -30.124 1.00 59.31 H new ATOM 0 HE3 LYS A 141 29.862 -16.663 -30.260 1.00 59.31 H new ATOM 0 HZ1 LYS A 141 29.490 -18.082 -32.208 1.00 61.78 H new ATOM 0 HZ2 LYS A 141 30.801 -17.477 -32.041 1.00 61.78 H new ATOM 0 HZ3 LYS A 141 30.588 -18.866 -31.670 1.00 61.78 H new ATOM 2438 N ARG A 142 32.792 -18.601 -23.937 1.00 19.24 N ATOM 2439 CA ARG A 142 33.369 -19.505 -22.959 1.00 25.70 C ATOM 2440 C ARG A 142 32.804 -19.240 -21.566 1.00 15.27 C ATOM 2441 O ARG A 142 32.665 -20.186 -20.783 1.00 15.40 O ATOM 2442 CB ARG A 142 34.896 -19.392 -22.951 1.00 32.81 C ATOM 2443 CG ARG A 142 35.574 -20.496 -23.799 1.00 53.58 C ATOM 2444 CD ARG A 142 37.100 -20.369 -23.832 1.00 57.14 C ATOM 2445 NE ARG A 142 37.532 -19.277 -24.698 1.00 41.02 N ATOM 2446 CZ ARG A 142 37.778 -19.408 -26.001 1.00 48.44 C ATOM 2447 NH1 ARG A 142 37.648 -20.593 -26.592 1.00 36.93 N ATOM 2448 NH2 ARG A 142 38.156 -18.356 -26.715 1.00 42.51 N ATOM 0 H ARG A 142 33.316 -17.981 -24.221 1.00 19.24 H new ATOM 0 HA ARG A 142 33.130 -20.410 -23.213 1.00 25.70 H new ATOM 0 HB2 ARG A 142 35.155 -18.521 -23.291 1.00 32.81 H new ATOM 0 HB3 ARG A 142 35.217 -19.447 -22.037 1.00 32.81 H new ATOM 0 HG2 ARG A 142 35.334 -21.365 -23.442 1.00 53.58 H new ATOM 0 HG3 ARG A 142 35.231 -20.458 -24.706 1.00 53.58 H new ATOM 0 HD2 ARG A 142 37.432 -20.220 -22.933 1.00 57.14 H new ATOM 0 HD3 ARG A 142 37.488 -21.202 -24.143 1.00 57.14 H new ATOM 0 HE ARG A 142 37.634 -18.499 -24.345 1.00 41.02 H new ATOM 0 HH11 ARG A 142 37.404 -21.278 -26.133 1.00 36.93 H new ATOM 0 HH12 ARG A 142 37.808 -20.674 -27.433 1.00 36.93 H new ATOM 0 HH21 ARG A 142 38.243 -17.588 -26.337 1.00 42.51 H new ATOM 0 HH22 ARG A 142 38.315 -18.442 -27.556 1.00 42.51 H new ATOM 2462 N ILE A 143 32.477 -17.983 -21.248 1.00 15.74 N ATOM 2463 CA ILE A 143 31.828 -17.686 -19.970 1.00 14.24 C ATOM 2464 C ILE A 143 30.459 -18.357 -19.930 1.00 14.21 C ATOM 2465 O ILE A 143 30.081 -18.998 -18.940 1.00 13.68 O ATOM 2466 CB ILE A 143 31.742 -16.166 -19.765 1.00 14.80 C ATOM 2467 CG1 ILE A 143 33.162 -15.596 -19.622 1.00 22.20 C ATOM 2468 CG2 ILE A 143 30.886 -15.846 -18.566 1.00 17.50 C ATOM 2469 CD1 ILE A 143 33.194 -14.076 -19.627 1.00 25.79 C ATOM 0 H ILE A 143 32.620 -17.300 -21.750 1.00 15.74 H new ATOM 0 HA ILE A 143 32.353 -18.042 -19.236 1.00 14.24 H new ATOM 0 HB ILE A 143 31.322 -15.752 -20.535 1.00 14.80 H new ATOM 0 HG12 ILE A 143 33.554 -15.920 -18.796 1.00 22.20 H new ATOM 0 HG13 ILE A 143 33.713 -15.929 -20.347 1.00 22.20 H new ATOM 0 HG21 ILE A 143 30.840 -14.884 -18.448 1.00 17.50 H new ATOM 0 HG22 ILE A 143 29.992 -16.197 -18.703 1.00 17.50 H new ATOM 0 HG23 ILE A 143 31.274 -16.250 -17.774 1.00 17.50 H new ATOM 0 HD11 ILE A 143 34.110 -13.771 -19.534 1.00 25.79 H new ATOM 0 HD12 ILE A 143 32.827 -13.747 -20.463 1.00 25.79 H new ATOM 0 HD13 ILE A 143 32.665 -13.739 -18.887 1.00 25.79 H new ATOM 2481 N ILE A 144 29.707 -18.251 -21.028 1.00 14.34 N ATOM 2482 CA ILE A 144 28.383 -18.856 -21.081 1.00 12.07 C ATOM 2483 C ILE A 144 28.495 -20.365 -20.924 1.00 15.89 C ATOM 2484 O ILE A 144 27.707 -20.997 -20.210 1.00 14.75 O ATOM 2485 CB ILE A 144 27.698 -18.465 -22.408 1.00 15.05 C ATOM 2486 CG1 ILE A 144 27.379 -16.958 -22.401 1.00 18.86 C ATOM 2487 CG2 ILE A 144 26.446 -19.281 -22.680 1.00 14.30 C ATOM 2488 CD1 ILE A 144 26.741 -16.459 -23.689 1.00 21.13 C ATOM 0 H ILE A 144 29.945 -17.837 -21.743 1.00 14.34 H new ATOM 0 HA ILE A 144 27.836 -18.528 -20.350 1.00 12.07 H new ATOM 0 HB ILE A 144 28.316 -18.663 -23.129 1.00 15.05 H new ATOM 0 HG12 ILE A 144 26.784 -16.765 -21.660 1.00 18.86 H new ATOM 0 HG13 ILE A 144 28.198 -16.463 -22.243 1.00 18.86 H new ATOM 0 HG21 ILE A 144 26.053 -19.000 -23.521 1.00 14.30 H new ATOM 0 HG22 ILE A 144 26.677 -20.222 -22.730 1.00 14.30 H new ATOM 0 HG23 ILE A 144 25.807 -19.143 -21.963 1.00 14.30 H new ATOM 0 HD11 ILE A 144 26.567 -15.507 -23.617 1.00 21.13 H new ATOM 0 HD12 ILE A 144 27.342 -16.622 -24.433 1.00 21.13 H new ATOM 0 HD13 ILE A 144 25.906 -16.929 -23.840 1.00 21.13 H new ATOM 2500 N ASP A 145 29.472 -20.978 -21.594 1.00 14.29 N ATOM 2501 CA AASP A 145 29.632 -22.425 -21.498 0.40 15.33 C ATOM 2502 CA BASP A 145 29.581 -22.423 -21.486 0.60 15.38 C ATOM 2503 C ASP A 145 30.031 -22.857 -20.094 1.00 12.26 C ATOM 2504 O ASP A 145 29.662 -23.954 -19.651 1.00 14.08 O ATOM 2505 CB AASP A 145 30.675 -22.899 -22.506 0.40 18.49 C ATOM 2506 CB BASP A 145 30.524 -22.984 -22.541 0.60 20.84 C ATOM 2507 CG AASP A 145 31.102 -24.341 -22.271 0.40 26.99 C ATOM 2508 CG BASP A 145 30.252 -24.475 -22.818 0.60 34.89 C ATOM 2509 OD1AASP A 145 30.363 -25.270 -22.668 0.40 24.75 O ATOM 2510 OD1BASP A 145 29.095 -24.813 -23.209 0.60 20.91 O ATOM 2511 OD2AASP A 145 32.180 -24.547 -21.677 0.40 26.12 O ATOM 2512 OD2BASP A 145 31.166 -25.310 -22.616 0.60 31.49 O ATOM 0 H AASP A 145 30.042 -20.581 -22.100 0.40 14.29 H new ATOM 0 H BASP A 145 30.056 -20.592 -22.094 0.60 14.29 H new ATOM 0 HA AASP A 145 28.775 -22.832 -21.699 0.40 15.38 H new ATOM 0 HA BASP A 145 28.694 -22.784 -21.639 0.60 15.38 H new ATOM 0 HB2AASP A 145 30.315 -22.814 -23.403 0.40 20.84 H new ATOM 0 HB2BASP A 145 30.426 -22.479 -23.363 0.60 20.84 H new ATOM 0 HB3AASP A 145 31.453 -22.322 -22.456 0.40 20.84 H new ATOM 0 HB3BASP A 145 31.442 -22.872 -22.247 0.60 20.84 H new ATOM 2521 N SER A 146 30.818 -22.021 -19.390 1.00 15.33 N ATOM 2522 CA SER A 146 31.209 -22.350 -18.027 1.00 11.89 C ATOM 2523 C SER A 146 30.002 -22.309 -17.093 1.00 11.23 C ATOM 2524 O SER A 146 29.844 -23.192 -16.242 1.00 13.08 O ATOM 2525 CB SER A 146 32.261 -21.378 -17.537 1.00 16.76 C ATOM 2526 OG SER A 146 33.517 -21.601 -18.152 1.00 19.53 O ATOM 0 H SER A 146 31.126 -21.275 -19.686 1.00 15.33 H new ATOM 0 HA SER A 146 31.575 -23.248 -18.026 1.00 11.89 H new ATOM 0 HB2 SER A 146 31.970 -20.470 -17.717 1.00 16.76 H new ATOM 0 HB3 SER A 146 32.354 -21.461 -16.575 1.00 16.76 H new ATOM 0 HG SER A 146 33.473 -21.391 -18.964 1.00 19.53 H new ATOM 2532 N ALA A 147 29.116 -21.321 -17.276 1.00 10.49 N ATOM 2533 CA ALA A 147 27.874 -21.313 -16.516 1.00 11.95 C ATOM 2534 C ALA A 147 27.038 -22.551 -16.811 1.00 12.82 C ATOM 2535 O ALA A 147 26.573 -23.230 -15.893 1.00 11.93 O ATOM 2536 CB ALA A 147 27.069 -20.053 -16.800 1.00 11.05 C ATOM 0 H ALA A 147 29.217 -20.665 -17.823 1.00 10.49 H new ATOM 0 HA ALA A 147 28.109 -21.323 -15.575 1.00 11.95 H new ATOM 0 HB1 ALA A 147 26.248 -20.070 -16.284 1.00 11.05 H new ATOM 0 HB2 ALA A 147 27.590 -19.273 -16.552 1.00 11.05 H new ATOM 0 HB3 ALA A 147 26.855 -20.012 -17.745 1.00 11.05 H new ATOM 2542 N ARG A 148 26.852 -22.866 -18.090 1.00 12.93 N ATOM 2543 CA AARG A 148 26.049 -24.024 -18.489 0.50 11.55 C ATOM 2544 CA BARG A 148 26.045 -24.023 -18.479 0.50 11.49 C ATOM 2545 C ARG A 148 26.608 -25.314 -17.903 1.00 12.10 C ATOM 2546 O ARG A 148 25.863 -26.157 -17.392 1.00 11.97 O ATOM 2547 CB AARG A 148 26.005 -24.125 -20.027 0.50 12.53 C ATOM 2548 CB BARG A 148 25.982 -24.115 -20.013 0.50 12.64 C ATOM 2549 CG AARG A 148 25.177 -25.310 -20.526 0.50 12.03 C ATOM 2550 CG BARG A 148 25.060 -25.219 -20.519 0.50 12.44 C ATOM 2551 CD AARG A 148 25.664 -25.872 -21.855 0.50 18.99 C ATOM 2552 CD BARG A 148 25.214 -25.447 -22.012 0.50 12.09 C ATOM 2553 NE AARG A 148 27.070 -26.257 -21.806 0.50 16.70 N ATOM 2554 NE BARG A 148 25.195 -24.186 -22.751 0.50 19.53 N ATOM 2555 CZ AARG A 148 27.533 -27.366 -21.235 0.50 11.48 C ATOM 2556 CZ BARG A 148 24.104 -23.609 -23.239 0.50 22.28 C ATOM 2557 NH1AARG A 148 26.709 -28.260 -20.678 0.50 11.84 N ATOM 2558 NH1BARG A 148 22.908 -24.198 -23.108 0.50 10.02 N ATOM 2559 NH2AARG A 148 28.835 -27.600 -21.243 0.50 15.58 N ATOM 2560 NH2BARG A 148 24.226 -22.439 -23.865 0.50 15.96 N ATOM 0 H AARG A 148 27.183 -22.421 -18.747 0.50 12.93 H new ATOM 0 H BARG A 148 27.184 -22.424 -18.749 0.50 12.93 H new ATOM 0 HA AARG A 148 25.151 -23.901 -18.144 0.50 11.49 H new ATOM 0 HA BARG A 148 25.151 -23.904 -18.121 0.50 11.49 H new ATOM 0 HB2AARG A 148 25.636 -23.304 -20.389 0.50 12.64 H new ATOM 0 HB2BARG A 148 25.681 -23.264 -20.369 0.50 12.64 H new ATOM 0 HB3AARG A 148 26.910 -24.204 -20.367 0.50 12.64 H new ATOM 0 HB3BARG A 148 26.876 -24.267 -20.358 0.50 12.64 H new ATOM 0 HG2AARG A 148 25.197 -26.013 -19.858 0.50 12.44 H new ATOM 0 HG2BARG A 148 25.253 -26.043 -20.045 0.50 12.44 H new ATOM 0 HG3AARG A 148 24.252 -25.033 -20.619 0.50 12.44 H new ATOM 0 HG3BARG A 148 24.139 -24.987 -20.321 0.50 12.44 H new ATOM 0 HD2AARG A 148 25.127 -26.643 -22.095 0.50 12.09 H new ATOM 0 HD2BARG A 148 26.047 -25.912 -22.185 0.50 12.09 H new ATOM 0 HD3AARG A 148 25.536 -25.209 -22.552 0.50 12.09 H new ATOM 0 HD3BARG A 148 24.498 -26.020 -22.329 0.50 12.09 H new ATOM 0 HE AARG A 148 27.641 -25.729 -22.173 0.50 19.53 H new ATOM 0 HE BARG A 148 25.947 -23.788 -22.879 0.50 19.53 H new ATOM 0 HH11AARG A 148 25.860 -28.124 -20.684 0.50 10.02 H new ATOM 0 HH11BARG A 148 22.843 -24.955 -22.705 0.50 10.02 H new ATOM 0 HH12AARG A 148 27.028 -28.971 -20.314 0.50 10.02 H new ATOM 0 HH12BARG A 148 22.205 -23.819 -23.426 0.50 10.02 H new ATOM 0 HH21AARG A 148 29.370 -27.039 -21.614 0.50 15.96 H new ATOM 0 HH21BARG A 148 25.000 -22.073 -23.946 0.50 15.96 H new ATOM 0 HH22AARG A 148 29.146 -28.313 -20.877 0.50 15.96 H new ATOM 0 HH22BARG A 148 23.531 -22.050 -24.188 0.50 15.96 H new ATOM 2587 N SER A 149 27.923 -25.494 -17.986 1.00 12.62 N ATOM 2588 CA SER A 149 28.546 -26.715 -17.492 1.00 11.77 C ATOM 2589 C SER A 149 28.348 -26.877 -15.983 1.00 12.84 C ATOM 2590 O SER A 149 28.071 -27.981 -15.500 1.00 12.46 O ATOM 2591 CB SER A 149 30.036 -26.688 -17.843 1.00 18.25 C ATOM 2592 OG SER A 149 30.674 -27.861 -17.379 1.00 23.40 O ATOM 0 H SER A 149 28.470 -24.923 -18.324 1.00 12.62 H new ATOM 0 HA SER A 149 28.123 -27.477 -17.917 1.00 11.77 H new ATOM 0 HB2 SER A 149 30.146 -26.611 -18.804 1.00 18.25 H new ATOM 0 HB3 SER A 149 30.453 -25.907 -17.446 1.00 18.25 H new ATOM 0 HG SER A 149 30.397 -28.523 -17.816 1.00 23.40 H new ATOM 2598 N ALA A 150 28.492 -25.791 -15.232 1.00 12.38 N ATOM 2599 CA ALA A 150 28.320 -25.875 -13.790 1.00 10.83 C ATOM 2600 C ALA A 150 26.873 -26.216 -13.424 1.00 10.18 C ATOM 2601 O ALA A 150 26.612 -27.099 -12.580 1.00 11.73 O ATOM 2602 CB ALA A 150 28.751 -24.558 -13.140 1.00 12.67 C ATOM 0 H ALA A 150 28.686 -25.009 -15.532 1.00 12.38 H new ATOM 0 HA ALA A 150 28.881 -26.591 -13.453 1.00 10.83 H new ATOM 0 HB1 ALA A 150 28.635 -24.618 -12.179 1.00 12.67 H new ATOM 0 HB2 ALA A 150 29.684 -24.387 -13.342 1.00 12.67 H new ATOM 0 HB3 ALA A 150 28.208 -23.833 -13.486 1.00 12.67 H new ATOM 2608 N TYR A 151 25.920 -25.503 -14.040 1.00 12.54 N ATOM 2609 CA TYR A 151 24.513 -25.791 -13.811 1.00 10.59 C ATOM 2610 C TYR A 151 24.172 -27.229 -14.181 1.00 10.49 C ATOM 2611 O TYR A 151 23.406 -27.890 -13.464 1.00 11.25 O ATOM 2612 CB TYR A 151 23.644 -24.844 -14.620 1.00 11.51 C ATOM 2613 CG TYR A 151 23.477 -23.433 -14.106 1.00 9.44 C ATOM 2614 CD1 TYR A 151 23.242 -23.179 -12.760 1.00 8.10 C ATOM 2615 CD2 TYR A 151 23.554 -22.355 -14.952 1.00 10.62 C ATOM 2616 CE1 TYR A 151 23.025 -21.856 -12.305 1.00 10.33 C ATOM 2617 CE2 TYR A 151 23.360 -21.046 -14.505 1.00 10.78 C ATOM 2618 CZ TYR A 151 23.078 -20.810 -13.170 1.00 11.22 C ATOM 2619 OH TYR A 151 22.917 -19.500 -12.747 1.00 11.96 O ATOM 0 H TYR A 151 26.073 -24.857 -14.587 1.00 12.54 H new ATOM 0 HA TYR A 151 24.339 -25.667 -12.865 1.00 10.59 H new ATOM 0 HB2 TYR A 151 24.011 -24.794 -15.516 1.00 11.51 H new ATOM 0 HB3 TYR A 151 22.762 -25.240 -14.697 1.00 11.51 H new ATOM 0 HD1 TYR A 151 23.227 -23.884 -12.153 1.00 8.10 H new ATOM 0 HD2 TYR A 151 23.741 -22.501 -15.851 1.00 10.62 H new ATOM 0 HE1 TYR A 151 22.845 -21.702 -11.406 1.00 10.33 H new ATOM 0 HE2 TYR A 151 23.420 -20.335 -15.102 1.00 10.78 H new ATOM 0 HH TYR A 151 22.629 -19.494 -11.958 1.00 11.96 H new ATOM 2629 N GLN A 152 24.709 -27.719 -15.311 1.00 10.46 N ATOM 2630 CA GLN A 152 24.375 -29.069 -15.772 1.00 11.94 C ATOM 2631 C GLN A 152 24.907 -30.123 -14.811 1.00 11.14 C ATOM 2632 O GLN A 152 24.203 -31.085 -14.499 1.00 14.00 O ATOM 2633 CB GLN A 152 24.927 -29.293 -17.186 1.00 13.01 C ATOM 2634 CG GLN A 152 24.452 -30.646 -17.764 1.00 17.04 C ATOM 2635 CD GLN A 152 22.957 -30.717 -17.858 1.00 18.33 C ATOM 2636 OE1 GLN A 152 22.311 -31.588 -17.241 1.00 28.57 O ATOM 2637 NE2 GLN A 152 22.380 -29.806 -18.617 1.00 16.12 N ATOM 0 H GLN A 152 25.259 -27.290 -15.814 1.00 10.46 H new ATOM 0 HA GLN A 152 23.409 -29.155 -15.797 1.00 11.94 H new ATOM 0 HB2 GLN A 152 24.639 -28.571 -17.767 1.00 13.01 H new ATOM 0 HB3 GLN A 152 25.896 -29.270 -17.165 1.00 13.01 H new ATOM 0 HG2 GLN A 152 24.838 -30.775 -18.644 1.00 17.04 H new ATOM 0 HG3 GLN A 152 24.776 -31.369 -17.204 1.00 17.04 H new ATOM 0 HE21 GLN A 152 22.859 -29.221 -19.027 1.00 16.12 H new ATOM 0 HE22 GLN A 152 21.524 -29.796 -18.702 1.00 16.12 H new ATOM 2646 N GLU A 153 26.147 -29.972 -14.334 1.00 12.92 N ATOM 2647 CA AGLU A 153 26.650 -30.899 -13.334 0.71 14.62 C ATOM 2648 CA BGLU A 153 26.667 -30.881 -13.319 0.29 14.66 C ATOM 2649 C GLU A 153 25.786 -30.867 -12.081 1.00 15.85 C ATOM 2650 O GLU A 153 25.497 -31.920 -11.500 1.00 14.43 O ATOM 2651 CB AGLU A 153 28.103 -30.585 -12.987 0.71 16.89 C ATOM 2652 CB BGLU A 153 28.096 -30.491 -12.946 0.29 16.99 C ATOM 2653 CG AGLU A 153 28.698 -31.612 -12.047 0.71 17.57 C ATOM 2654 CG BGLU A 153 29.080 -30.592 -14.085 0.29 14.87 C ATOM 2655 CD AGLU A 153 30.177 -31.384 -11.742 0.71 30.92 C ATOM 2656 CD BGLU A 153 30.274 -29.655 -13.937 0.29 26.20 C ATOM 2657 OE1AGLU A 153 30.810 -30.578 -12.434 0.71 34.06 O ATOM 2658 OE1BGLU A 153 30.570 -29.204 -12.811 0.29 25.63 O ATOM 2659 OE2AGLU A 153 30.694 -32.037 -10.806 0.71 41.96 O ATOM 2660 OE2BGLU A 153 30.916 -29.358 -14.966 0.29 31.58 O ATOM 0 H AGLU A 153 26.695 -29.354 -14.573 0.71 12.92 H new ATOM 0 H BGLU A 153 26.693 -29.357 -14.584 0.29 12.92 H new ATOM 0 HA AGLU A 153 26.610 -31.793 -13.709 0.71 14.66 H new ATOM 0 HA BGLU A 153 26.668 -31.779 -13.686 0.29 14.66 H new ATOM 0 HB2AGLU A 153 28.629 -30.551 -13.801 0.71 16.99 H new ATOM 0 HB2BGLU A 153 28.096 -29.580 -12.612 0.29 16.99 H new ATOM 0 HB3AGLU A 153 28.154 -29.707 -12.579 0.71 16.99 H new ATOM 0 HB3BGLU A 153 28.397 -31.060 -12.220 0.29 16.99 H new ATOM 0 HG2AGLU A 153 28.200 -31.604 -11.215 0.71 14.87 H new ATOM 0 HG2BGLU A 153 29.400 -31.506 -14.147 0.29 14.87 H new ATOM 0 HG3AGLU A 153 28.588 -32.495 -12.434 0.71 14.87 H new ATOM 0 HG3BGLU A 153 28.623 -30.394 -14.917 0.29 14.87 H new ATOM 2673 N ALA A 154 25.357 -29.673 -11.656 1.00 12.04 N ATOM 2674 CA ALA A 154 24.510 -29.577 -10.470 1.00 10.92 C ATOM 2675 C ALA A 154 23.166 -30.247 -10.718 1.00 10.70 C ATOM 2676 O ALA A 154 22.637 -30.940 -9.845 1.00 12.60 O ATOM 2677 CB ALA A 154 24.327 -28.099 -10.101 1.00 11.98 C ATOM 0 H ALA A 154 25.542 -28.923 -12.034 1.00 12.04 H new ATOM 0 HA ALA A 154 24.936 -30.038 -9.730 1.00 10.92 H new ATOM 0 HB1 ALA A 154 23.765 -28.029 -9.314 1.00 11.98 H new ATOM 0 HB2 ALA A 154 25.192 -27.702 -9.916 1.00 11.98 H new ATOM 0 HB3 ALA A 154 23.908 -27.630 -10.840 1.00 11.98 H new ATOM 2683 N MET A 155 22.590 -30.034 -11.904 1.00 12.88 N ATOM 2684 CA AMET A 155 21.303 -30.637 -12.231 0.75 12.83 C ATOM 2685 CA BMET A 155 21.306 -30.642 -12.236 0.25 12.95 C ATOM 2686 C MET A 155 21.402 -32.161 -12.202 1.00 13.40 C ATOM 2687 O MET A 155 20.503 -32.841 -11.683 1.00 15.39 O ATOM 2688 CB AMET A 155 20.835 -30.178 -13.616 0.75 13.29 C ATOM 2689 CB BMET A 155 20.853 -30.160 -13.618 0.25 13.40 C ATOM 2690 CG AMET A 155 20.432 -28.719 -13.700 0.75 14.24 C ATOM 2691 CG BMET A 155 19.535 -30.736 -14.086 0.25 16.59 C ATOM 2692 SD AMET A 155 18.849 -28.362 -12.948 0.75 16.67 S ATOM 2693 SD BMET A 155 18.140 -30.178 -13.118 0.25 21.23 S ATOM 2694 CE AMET A 155 17.737 -29.213 -14.091 0.75 18.86 C ATOM 2695 CE BMET A 155 18.026 -28.452 -13.592 0.25 22.66 C ATOM 0 H AMET A 155 22.928 -29.547 -12.527 0.75 12.88 H new ATOM 0 H BMET A 155 22.927 -29.543 -12.525 0.25 12.88 H new ATOM 0 HA AMET A 155 20.657 -30.351 -11.566 0.75 12.95 H new ATOM 0 HA BMET A 155 20.650 -30.372 -11.575 0.25 12.95 H new ATOM 0 HB2AMET A 155 21.547 -30.341 -14.254 0.75 13.40 H new ATOM 0 HB2BMET A 155 20.782 -29.193 -13.603 0.25 13.40 H new ATOM 0 HB3AMET A 155 20.081 -30.725 -13.886 0.75 13.40 H new ATOM 0 HB3BMET A 155 21.539 -30.384 -14.266 0.25 13.40 H new ATOM 0 HG2AMET A 155 21.114 -28.179 -13.271 0.75 16.59 H new ATOM 0 HG2BMET A 155 19.394 -30.494 -15.015 0.25 16.59 H new ATOM 0 HG3AMET A 155 20.405 -28.453 -14.632 0.75 16.59 H new ATOM 0 HG3BMET A 155 19.580 -31.704 -14.049 0.25 16.59 H new ATOM 0 HE1AMET A 155 16.817 -29.046 -13.832 0.75 22.66 H new ATOM 0 HE1BMET A 155 17.167 -28.097 -13.316 0.25 22.66 H new ATOM 0 HE2AMET A 155 17.884 -28.883 -14.991 0.75 22.66 H new ATOM 0 HE2BMET A 155 18.736 -27.950 -13.162 0.25 22.66 H new ATOM 0 HE3AMET A 155 17.912 -30.167 -14.064 0.75 22.66 H new ATOM 0 HE3BMET A 155 18.114 -28.374 -14.555 0.25 22.66 H new ATOM 2714 N ASP A 156 22.476 -32.714 -12.782 1.00 15.09 N ATOM 2715 CA ASP A 156 22.620 -34.164 -12.826 1.00 16.48 C ATOM 2716 C ASP A 156 22.639 -34.742 -11.416 1.00 18.41 C ATOM 2717 O ASP A 156 21.966 -35.738 -11.140 1.00 17.51 O ATOM 2718 CB ASP A 156 23.887 -34.555 -13.578 1.00 14.59 C ATOM 2719 CG ASP A 156 23.819 -34.223 -15.069 1.00 22.94 C ATOM 2720 OD1 ASP A 156 22.715 -33.996 -15.595 1.00 25.40 O ATOM 2721 OD2 ASP A 156 24.888 -34.213 -15.723 1.00 26.77 O ATOM 0 H ASP A 156 23.117 -32.272 -13.147 1.00 15.09 H new ATOM 0 HA ASP A 156 21.857 -34.532 -13.299 1.00 16.48 H new ATOM 0 HB2 ASP A 156 24.646 -34.098 -13.184 1.00 14.59 H new ATOM 0 HB3 ASP A 156 24.042 -35.506 -13.470 1.00 14.59 H new ATOM 2726 N ILE A 157 23.378 -34.108 -10.496 1.00 12.97 N ATOM 2727 CA ILE A 157 23.446 -34.601 -9.128 1.00 13.17 C ATOM 2728 C ILE A 157 22.098 -34.448 -8.437 1.00 13.15 C ATOM 2729 O ILE A 157 21.631 -35.360 -7.740 1.00 14.61 O ATOM 2730 CB ILE A 157 24.558 -33.870 -8.351 1.00 11.68 C ATOM 2731 CG1 ILE A 157 25.924 -34.154 -8.944 1.00 14.47 C ATOM 2732 CG2 ILE A 157 24.515 -34.308 -6.893 1.00 13.00 C ATOM 2733 CD1 ILE A 157 27.005 -33.174 -8.460 1.00 19.73 C ATOM 0 H ILE A 157 23.840 -33.399 -10.648 1.00 12.97 H new ATOM 0 HA ILE A 157 23.664 -35.546 -9.147 1.00 13.17 H new ATOM 0 HB ILE A 157 24.406 -32.914 -8.413 1.00 11.68 H new ATOM 0 HG12 ILE A 157 26.189 -35.059 -8.715 1.00 14.47 H new ATOM 0 HG13 ILE A 157 25.866 -34.112 -9.911 1.00 14.47 H new ATOM 0 HG21 ILE A 157 25.213 -33.852 -6.397 1.00 13.00 H new ATOM 0 HG22 ILE A 157 23.651 -34.085 -6.513 1.00 13.00 H new ATOM 0 HG23 ILE A 157 24.654 -35.266 -6.839 1.00 13.00 H new ATOM 0 HD11 ILE A 157 27.855 -33.401 -8.869 1.00 19.73 H new ATOM 0 HD12 ILE A 157 26.758 -32.270 -8.710 1.00 19.73 H new ATOM 0 HD13 ILE A 157 27.085 -33.231 -7.495 1.00 19.73 H new ATOM 2745 N SER A 158 21.450 -33.288 -8.609 1.00 12.23 N ATOM 2746 CA SER A 158 20.219 -32.996 -7.879 1.00 13.58 C ATOM 2747 C SER A 158 19.116 -33.967 -8.298 1.00 15.16 C ATOM 2748 O SER A 158 18.322 -34.409 -7.467 1.00 15.23 O ATOM 2749 CB SER A 158 19.793 -31.527 -8.086 1.00 13.88 C ATOM 2750 OG SER A 158 19.315 -31.282 -9.374 1.00 21.71 O ATOM 0 H SER A 158 21.708 -32.664 -9.141 1.00 12.23 H new ATOM 0 HA SER A 158 20.381 -33.118 -6.930 1.00 13.58 H new ATOM 0 HB2 SER A 158 19.105 -31.300 -7.441 1.00 13.88 H new ATOM 0 HB3 SER A 158 20.550 -30.947 -7.910 1.00 13.88 H new ATOM 0 HG SER A 158 19.721 -31.772 -9.922 1.00 21.71 H new ATOM 2756 N LYS A 159 19.047 -34.311 -9.580 1.00 15.71 N ATOM 2757 CA LYS A 159 18.013 -35.247 -10.023 1.00 13.13 C ATOM 2758 C LYS A 159 18.246 -36.644 -9.486 1.00 15.49 C ATOM 2759 O LYS A 159 17.277 -37.363 -9.205 1.00 20.73 O ATOM 2760 CB LYS A 159 17.948 -35.211 -11.547 1.00 18.21 C ATOM 2761 CG LYS A 159 17.258 -33.941 -12.047 1.00 27.77 C ATOM 2762 CD LYS A 159 17.110 -33.906 -13.575 1.00 41.66 C ATOM 2763 CE LYS A 159 15.958 -33.020 -14.007 1.00 69.10 C ATOM 2764 NZ LYS A 159 14.865 -33.815 -14.654 1.00 85.63 N ATOM 0 H LYS A 159 19.573 -34.024 -10.197 1.00 15.71 H new ATOM 0 HA LYS A 159 17.154 -34.975 -9.664 1.00 13.13 H new ATOM 0 HB2 LYS A 159 18.846 -35.258 -11.912 1.00 18.21 H new ATOM 0 HB3 LYS A 159 17.469 -35.990 -11.870 1.00 18.21 H new ATOM 0 HG2 LYS A 159 16.380 -33.873 -11.640 1.00 27.77 H new ATOM 0 HG3 LYS A 159 17.766 -33.167 -11.758 1.00 27.77 H new ATOM 0 HD2 LYS A 159 17.934 -33.583 -13.973 1.00 41.66 H new ATOM 0 HD3 LYS A 159 16.968 -34.806 -13.907 1.00 41.66 H new ATOM 0 HE2 LYS A 159 15.604 -32.549 -13.236 1.00 69.10 H new ATOM 0 HE3 LYS A 159 16.281 -32.347 -14.627 1.00 69.10 H new ATOM 0 HZ1 LYS A 159 14.322 -33.267 -15.098 1.00 85.63 H new ATOM 0 HZ2 LYS A 159 15.220 -34.403 -15.220 1.00 85.63 H new ATOM 0 HZ3 LYS A 159 14.402 -34.248 -14.029 1.00 85.63 H new ATOM 2778 N LYS A 160 19.498 -37.017 -9.254 1.00 13.38 N ATOM 2779 CA ALYS A 160 19.791 -38.354 -8.748 0.55 16.17 C ATOM 2780 CA BLYS A 160 19.799 -38.354 -8.748 0.45 16.17 C ATOM 2781 C LYS A 160 19.695 -38.440 -7.228 1.00 20.44 C ATOM 2782 O LYS A 160 19.348 -39.497 -6.685 1.00 19.44 O ATOM 2783 CB ALYS A 160 21.186 -38.779 -9.185 0.55 18.43 C ATOM 2784 CB BLYS A 160 21.195 -38.752 -9.216 0.45 18.32 C ATOM 2785 CG ALYS A 160 21.307 -39.129 -10.637 0.55 17.93 C ATOM 2786 CG BLYS A 160 21.647 -40.128 -8.781 0.45 22.68 C ATOM 2787 CD ALYS A 160 22.742 -39.463 -10.999 0.55 29.22 C ATOM 2788 CD BLYS A 160 22.990 -40.485 -9.413 0.45 31.25 C ATOM 2789 CE ALYS A 160 22.875 -39.731 -12.498 0.55 35.79 C ATOM 2790 CE BLYS A 160 24.121 -39.612 -8.886 0.45 41.70 C ATOM 2791 NZ ALYS A 160 24.032 -38.988 -13.084 0.55 42.46 N ATOM 2792 NZ BLYS A 160 25.424 -39.947 -9.537 0.45 68.81 N ATOM 0 H ALYS A 160 20.187 -36.518 -9.381 0.55 13.38 H new ATOM 0 H BLYS A 160 20.185 -36.516 -9.381 0.45 13.38 H new ATOM 0 HA ALYS A 160 19.122 -38.950 -9.120 0.55 16.17 H new ATOM 0 HA BLYS A 160 19.138 -38.970 -9.101 0.45 16.17 H new ATOM 0 HB2ALYS A 160 21.807 -38.061 -8.985 0.55 18.32 H new ATOM 0 HB2BLYS A 160 21.221 -38.709 -10.185 0.45 18.32 H new ATOM 0 HB3ALYS A 160 21.458 -39.545 -8.656 0.55 18.32 H new ATOM 0 HB3BLYS A 160 21.831 -38.098 -8.886 0.45 18.32 H new ATOM 0 HG2ALYS A 160 20.735 -39.885 -10.839 0.55 22.68 H new ATOM 0 HG2BLYS A 160 21.722 -40.157 -7.814 0.45 22.68 H new ATOM 0 HG3ALYS A 160 20.998 -38.386 -11.179 0.55 22.68 H new ATOM 0 HG3BLYS A 160 20.981 -40.786 -9.034 0.45 22.68 H new ATOM 0 HD2ALYS A 160 23.323 -38.729 -10.744 0.55 31.25 H new ATOM 0 HD2BLYS A 160 23.192 -41.417 -9.235 0.45 31.25 H new ATOM 0 HD3ALYS A 160 23.033 -40.242 -10.500 0.55 31.25 H new ATOM 0 HD3BLYS A 160 22.929 -40.387 -10.376 0.45 31.25 H new ATOM 0 HE2ALYS A 160 22.989 -40.682 -12.649 0.55 41.70 H new ATOM 0 HE2BLYS A 160 23.910 -38.678 -9.044 0.45 41.70 H new ATOM 0 HE3ALYS A 160 22.058 -39.468 -12.949 0.55 41.70 H new ATOM 0 HE3BLYS A 160 24.199 -39.727 -7.926 0.45 41.70 H new ATOM 0 HZ1ALYS A 160 24.086 -39.162 -13.955 0.55 68.81 H new ATOM 0 HZ1BLYS A 160 26.063 -39.422 -9.209 0.45 68.81 H new ATOM 0 HZ2ALYS A 160 23.916 -38.114 -12.963 0.55 68.81 H new ATOM 0 HZ2BLYS A 160 25.627 -40.798 -9.374 0.45 68.81 H new ATOM 0 HZ3ALYS A 160 24.784 -39.245 -12.683 0.55 68.81 H new ATOM 0 HZ3BLYS A 160 25.358 -39.821 -10.416 0.45 68.81 H new ATOM 2819 N GLU A 161 19.996 -37.360 -6.526 1.00 16.30 N ATOM 2820 CA GLU A 161 20.198 -37.424 -5.090 1.00 12.82 C ATOM 2821 C GLU A 161 19.215 -36.639 -4.231 1.00 14.64 C ATOM 2822 O GLU A 161 19.237 -36.809 -3.002 1.00 21.03 O ATOM 2823 CB GLU A 161 21.620 -36.933 -4.750 1.00 15.02 C ATOM 2824 CG GLU A 161 22.748 -37.697 -5.348 1.00 17.29 C ATOM 2825 CD GLU A 161 22.792 -39.142 -4.892 1.00 40.40 C ATOM 2826 OE1 GLU A 161 22.199 -39.450 -3.834 1.00 49.78 O ATOM 2827 OE2 GLU A 161 23.409 -39.970 -5.605 1.00 53.87 O ATOM 0 H GLU A 161 20.088 -36.575 -6.865 1.00 16.30 H new ATOM 0 HA GLU A 161 20.052 -38.358 -4.872 1.00 12.82 H new ATOM 0 HB2 GLU A 161 21.697 -36.008 -5.032 1.00 15.02 H new ATOM 0 HB3 GLU A 161 21.723 -36.945 -3.786 1.00 15.02 H new ATOM 0 HG2 GLU A 161 22.674 -37.670 -6.315 1.00 17.29 H new ATOM 0 HG3 GLU A 161 23.584 -37.264 -5.116 1.00 17.29 H new ATOM 2834 N MET A 162 18.360 -35.806 -4.800 1.00 13.60 N ATOM 2835 CA AMET A 162 17.476 -34.928 -4.053 0.60 11.49 C ATOM 2836 CA BMET A 162 17.468 -34.980 -4.008 0.40 11.32 C ATOM 2837 C MET A 162 16.042 -35.109 -4.515 1.00 12.85 C ATOM 2838 O MET A 162 15.812 -35.360 -5.708 1.00 15.07 O ATOM 2839 CB AMET A 162 17.840 -33.440 -4.260 0.60 13.91 C ATOM 2840 CB BMET A 162 17.939 -33.505 -4.050 0.40 15.56 C ATOM 2841 CG AMET A 162 19.192 -33.051 -3.785 0.60 13.72 C ATOM 2842 CG BMET A 162 19.285 -33.319 -3.335 0.40 21.81 C ATOM 2843 SD AMET A 162 19.499 -31.331 -4.325 0.60 15.57 S ATOM 2844 SD BMET A 162 20.420 -32.051 -3.979 0.40 22.92 S ATOM 2845 CE AMET A 162 20.527 -30.770 -2.963 0.60 16.13 C ATOM 2846 CE BMET A 162 19.533 -30.590 -3.448 0.40 18.71 C ATOM 0 H AMET A 162 18.275 -35.733 -5.653 0.60 13.60 H new ATOM 0 H BMET A 162 18.280 -35.704 -5.650 0.40 13.60 H new ATOM 0 HA AMET A 162 17.575 -35.163 -3.117 0.60 11.32 H new ATOM 0 HA BMET A 162 17.488 -35.283 -3.087 0.40 11.32 H new ATOM 0 HB2AMET A 162 17.773 -33.233 -5.205 0.60 15.56 H new ATOM 0 HB2BMET A 162 18.020 -33.217 -4.973 0.40 15.56 H new ATOM 0 HB3AMET A 162 17.182 -32.894 -3.802 0.60 15.56 H new ATOM 0 HB3BMET A 162 17.270 -32.939 -3.634 0.40 15.56 H new ATOM 0 HG2AMET A 162 19.246 -33.119 -2.819 0.60 21.81 H new ATOM 0 HG2BMET A 162 19.102 -33.111 -2.405 0.40 21.81 H new ATOM 0 HG3AMET A 162 19.865 -33.647 -4.149 0.60 21.81 H new ATOM 0 HG3BMET A 162 19.750 -34.170 -3.349 0.40 21.81 H new ATOM 0 HE1AMET A 162 21.144 -30.093 -3.281 0.60 18.71 H new ATOM 0 HE1BMET A 162 20.013 -29.798 -3.736 0.40 18.71 H new ATOM 0 HE2AMET A 162 19.966 -30.394 -2.267 0.60 18.71 H new ATOM 0 HE2BMET A 162 18.645 -30.590 -3.839 0.40 18.71 H new ATOM 0 HE3AMET A 162 21.027 -31.520 -2.605 0.60 18.71 H new ATOM 0 HE3BMET A 162 19.460 -30.589 -2.481 0.40 18.71 H new ATOM 2865 N PRO A 163 15.066 -34.952 -3.610 1.00 13.22 N ATOM 2866 CA PRO A 163 13.665 -34.966 -4.006 1.00 13.98 C ATOM 2867 C PRO A 163 13.298 -33.732 -4.805 1.00 13.68 C ATOM 2868 O PRO A 163 13.956 -32.681 -4.690 1.00 15.13 O ATOM 2869 CB PRO A 163 12.914 -35.009 -2.671 1.00 15.46 C ATOM 2870 CG PRO A 163 13.802 -34.337 -1.732 1.00 20.23 C ATOM 2871 CD PRO A 163 15.216 -34.644 -2.174 1.00 17.19 C ATOM 0 HA PRO A 163 13.449 -35.714 -4.585 1.00 13.98 H new ATOM 0 HB2 PRO A 163 12.058 -34.557 -2.733 1.00 15.46 H new ATOM 0 HB3 PRO A 163 12.734 -35.922 -2.396 1.00 15.46 H new ATOM 0 HG2 PRO A 163 13.642 -33.380 -1.731 1.00 20.23 H new ATOM 0 HG3 PRO A 163 13.648 -34.651 -0.827 1.00 20.23 H new ATOM 0 HD2 PRO A 163 15.808 -33.889 -2.030 1.00 17.19 H new ATOM 0 HD3 PRO A 163 15.589 -35.394 -1.684 1.00 17.19 H new ATOM 2879 N PRO A 164 12.268 -33.837 -5.648 1.00 13.95 N ATOM 2880 CA PRO A 164 11.913 -32.706 -6.513 1.00 14.77 C ATOM 2881 C PRO A 164 11.504 -31.469 -5.775 1.00 17.40 C ATOM 2882 O PRO A 164 11.473 -30.396 -6.389 1.00 18.19 O ATOM 2883 CB PRO A 164 10.746 -33.250 -7.354 1.00 19.08 C ATOM 2884 CG PRO A 164 10.713 -34.710 -7.164 1.00 27.41 C ATOM 2885 CD PRO A 164 11.411 -35.029 -5.878 1.00 19.23 C ATOM 0 HA PRO A 164 12.679 -32.417 -7.032 1.00 14.77 H new ATOM 0 HB2 PRO A 164 9.908 -32.850 -7.075 1.00 19.08 H new ATOM 0 HB3 PRO A 164 10.868 -33.030 -8.291 1.00 19.08 H new ATOM 0 HG2 PRO A 164 9.797 -35.028 -7.140 1.00 27.41 H new ATOM 0 HG3 PRO A 164 11.149 -35.158 -7.906 1.00 27.41 H new ATOM 0 HD2 PRO A 164 10.781 -35.162 -5.152 1.00 19.23 H new ATOM 0 HD3 PRO A 164 11.938 -35.840 -5.949 1.00 19.23 H new ATOM 2893 N THR A 165 11.164 -31.564 -4.491 1.00 14.98 N ATOM 2894 CA THR A 165 10.771 -30.399 -3.719 1.00 14.03 C ATOM 2895 C THR A 165 11.930 -29.754 -2.971 1.00 11.75 C ATOM 2896 O THR A 165 11.722 -28.752 -2.287 1.00 13.08 O ATOM 2897 CB THR A 165 9.696 -30.769 -2.701 1.00 14.72 C ATOM 2898 OG1 THR A 165 10.124 -31.956 -2.049 1.00 16.14 O ATOM 2899 CG2 THR A 165 8.361 -30.994 -3.410 1.00 23.69 C ATOM 0 H THR A 165 11.156 -32.302 -4.050 1.00 14.98 H new ATOM 0 HA THR A 165 10.434 -29.759 -4.365 1.00 14.03 H new ATOM 0 HB THR A 165 9.569 -30.057 -2.055 1.00 14.72 H new ATOM 0 HG1 THR A 165 9.730 -32.618 -2.384 1.00 16.14 H new ATOM 0 HG21 THR A 165 7.683 -31.229 -2.757 1.00 23.69 H new ATOM 0 HG22 THR A 165 8.098 -30.182 -3.871 1.00 23.69 H new ATOM 0 HG23 THR A 165 8.453 -31.715 -4.053 1.00 23.69 H new ATOM 2907 N ASN A 166 13.115 -30.327 -3.014 1.00 12.98 N ATOM 2908 CA ASN A 166 14.228 -29.762 -2.258 1.00 11.64 C ATOM 2909 C ASN A 166 14.491 -28.321 -2.691 1.00 11.49 C ATOM 2910 O ASN A 166 14.613 -28.062 -3.887 1.00 12.68 O ATOM 2911 CB ASN A 166 15.464 -30.621 -2.509 1.00 13.05 C ATOM 2912 CG ASN A 166 16.667 -30.128 -1.793 1.00 21.59 C ATOM 2913 OD1 ASN A 166 17.352 -29.246 -2.274 1.00 19.57 O ATOM 2914 ND2 ASN A 166 16.957 -30.723 -0.642 1.00 21.96 N ATOM 0 H ASN A 166 13.302 -31.034 -3.466 1.00 12.98 H new ATOM 0 HA ASN A 166 14.013 -29.755 -1.312 1.00 11.64 H new ATOM 0 HB2 ASN A 166 15.280 -31.532 -2.233 1.00 13.05 H new ATOM 0 HB3 ASN A 166 15.647 -30.645 -3.461 1.00 13.05 H new ATOM 0 HD21 ASN A 166 17.657 -30.488 -0.201 1.00 21.96 H new ATOM 0 HD22 ASN A 166 16.445 -31.343 -0.337 1.00 21.96 H new ATOM 2921 N PRO A 167 14.535 -27.358 -1.763 1.00 10.41 N ATOM 2922 CA PRO A 167 14.728 -25.957 -2.170 1.00 10.43 C ATOM 2923 C PRO A 167 15.998 -25.699 -2.962 1.00 11.39 C ATOM 2924 O PRO A 167 15.989 -24.814 -3.826 1.00 10.73 O ATOM 2925 CB PRO A 167 14.736 -25.217 -0.831 1.00 13.65 C ATOM 2926 CG PRO A 167 13.868 -26.085 0.049 1.00 17.32 C ATOM 2927 CD PRO A 167 14.216 -27.477 -0.327 1.00 15.62 C ATOM 0 HA PRO A 167 14.036 -25.666 -2.784 1.00 10.43 H new ATOM 0 HB2 PRO A 167 15.634 -25.131 -0.475 1.00 13.65 H new ATOM 0 HB3 PRO A 167 14.377 -24.320 -0.915 1.00 13.65 H new ATOM 0 HG2 PRO A 167 14.044 -25.920 0.989 1.00 17.32 H new ATOM 0 HG3 PRO A 167 12.926 -25.906 -0.099 1.00 17.32 H new ATOM 0 HD2 PRO A 167 14.971 -27.810 0.183 1.00 15.62 H new ATOM 0 HD3 PRO A 167 13.478 -28.087 -0.172 1.00 15.62 H new ATOM 2935 N ILE A 168 17.086 -26.408 -2.682 1.00 13.24 N ATOM 2936 CA ILE A 168 18.298 -26.206 -3.462 1.00 12.15 C ATOM 2937 C ILE A 168 18.071 -26.677 -4.890 1.00 10.65 C ATOM 2938 O ILE A 168 18.439 -26.004 -5.850 1.00 11.80 O ATOM 2939 CB ILE A 168 19.494 -26.927 -2.815 1.00 10.02 C ATOM 2940 CG1 ILE A 168 19.750 -26.363 -1.411 1.00 14.58 C ATOM 2941 CG2 ILE A 168 20.724 -26.755 -3.682 1.00 15.19 C ATOM 2942 CD1 ILE A 168 20.661 -27.231 -0.598 1.00 20.91 C ATOM 0 H ILE A 168 17.143 -26.998 -2.059 1.00 13.24 H new ATOM 0 HA ILE A 168 18.510 -25.260 -3.480 1.00 12.15 H new ATOM 0 HB ILE A 168 19.293 -27.873 -2.737 1.00 10.02 H new ATOM 0 HG12 ILE A 168 20.137 -25.477 -1.488 1.00 14.58 H new ATOM 0 HG13 ILE A 168 18.904 -26.264 -0.947 1.00 14.58 H new ATOM 0 HG21 ILE A 168 21.476 -27.210 -3.272 1.00 15.19 H new ATOM 0 HG22 ILE A 168 20.557 -27.133 -4.559 1.00 15.19 H new ATOM 0 HG23 ILE A 168 20.928 -25.811 -3.771 1.00 15.19 H new ATOM 0 HD11 ILE A 168 20.791 -26.833 0.277 1.00 20.91 H new ATOM 0 HD12 ILE A 168 20.265 -28.111 -0.497 1.00 20.91 H new ATOM 0 HD13 ILE A 168 21.517 -27.311 -1.047 1.00 20.91 H new ATOM 2954 N ARG A 169 17.487 -27.871 -5.051 1.00 11.60 N ATOM 2955 CA ARG A 169 17.156 -28.367 -6.378 1.00 12.91 C ATOM 2956 C ARG A 169 16.225 -27.416 -7.118 1.00 10.39 C ATOM 2957 O ARG A 169 16.455 -27.109 -8.292 1.00 12.10 O ATOM 2958 CB ARG A 169 16.529 -29.764 -6.275 1.00 10.95 C ATOM 2959 CG ARG A 169 16.105 -30.311 -7.631 1.00 11.98 C ATOM 2960 CD ARG A 169 15.728 -31.821 -7.554 1.00 14.38 C ATOM 2961 NE ARG A 169 15.050 -32.221 -8.779 1.00 15.16 N ATOM 2962 CZ ARG A 169 14.584 -33.444 -9.006 1.00 20.22 C ATOM 2963 NH1 ARG A 169 14.749 -34.383 -8.099 1.00 17.19 N ATOM 2964 NH2 ARG A 169 13.955 -33.729 -10.128 1.00 17.76 N ATOM 0 H ARG A 169 17.278 -28.400 -4.406 1.00 11.60 H new ATOM 0 HA ARG A 169 17.978 -28.424 -6.890 1.00 12.91 H new ATOM 0 HB2 ARG A 169 17.166 -30.372 -5.868 1.00 10.95 H new ATOM 0 HB3 ARG A 169 15.757 -29.727 -5.688 1.00 10.95 H new ATOM 0 HG2 ARG A 169 15.346 -29.805 -7.961 1.00 11.98 H new ATOM 0 HG3 ARG A 169 16.826 -30.190 -8.268 1.00 11.98 H new ATOM 0 HD2 ARG A 169 16.527 -32.357 -7.426 1.00 14.38 H new ATOM 0 HD3 ARG A 169 15.154 -31.981 -6.789 1.00 14.38 H new ATOM 0 HE ARG A 169 14.945 -31.629 -9.394 1.00 15.16 H new ATOM 0 HH11 ARG A 169 15.157 -34.203 -7.363 1.00 17.19 H new ATOM 0 HH12 ARG A 169 14.449 -35.176 -8.242 1.00 17.19 H new ATOM 0 HH21 ARG A 169 13.842 -33.120 -10.724 1.00 17.76 H new ATOM 0 HH22 ARG A 169 13.658 -34.524 -10.264 1.00 17.76 H new ATOM 2978 N LEU A 170 15.218 -26.875 -6.429 1.00 10.44 N ATOM 2979 CA LEU A 170 14.284 -25.938 -7.042 1.00 10.95 C ATOM 2980 C LEU A 170 14.956 -24.638 -7.437 1.00 9.49 C ATOM 2981 O LEU A 170 14.717 -24.116 -8.526 1.00 12.11 O ATOM 2982 CB LEU A 170 13.119 -25.660 -6.086 1.00 13.63 C ATOM 2983 CG LEU A 170 12.099 -26.799 -5.863 1.00 13.08 C ATOM 2984 CD1 LEU A 170 11.128 -26.383 -4.757 1.00 13.53 C ATOM 2985 CD2 LEU A 170 11.350 -27.094 -7.155 1.00 16.79 C ATOM 0 H LEU A 170 15.061 -27.041 -5.600 1.00 10.44 H new ATOM 0 HA LEU A 170 13.949 -26.349 -7.854 1.00 10.95 H new ATOM 0 HB2 LEU A 170 13.490 -25.416 -5.224 1.00 13.63 H new ATOM 0 HB3 LEU A 170 12.637 -24.886 -6.417 1.00 13.63 H new ATOM 0 HG LEU A 170 12.562 -27.608 -5.595 1.00 13.08 H new ATOM 0 HD11 LEU A 170 10.483 -27.092 -4.609 1.00 13.53 H new ATOM 0 HD12 LEU A 170 11.621 -26.219 -3.938 1.00 13.53 H new ATOM 0 HD13 LEU A 170 10.663 -25.574 -5.022 1.00 13.53 H new ATOM 0 HD21 LEU A 170 10.713 -27.810 -7.004 1.00 16.79 H new ATOM 0 HD22 LEU A 170 10.878 -26.298 -7.445 1.00 16.79 H new ATOM 0 HD23 LEU A 170 11.981 -27.363 -7.841 1.00 16.79 H new ATOM 2997 N GLY A 171 15.762 -24.073 -6.552 1.00 11.83 N ATOM 2998 CA GLY A 171 16.435 -22.830 -6.876 1.00 11.98 C ATOM 2999 C GLY A 171 17.443 -22.980 -7.989 1.00 10.68 C ATOM 3000 O GLY A 171 17.626 -22.044 -8.787 1.00 10.71 O ATOM 0 H GLY A 171 15.931 -24.388 -5.770 1.00 11.83 H new ATOM 0 HA2 GLY A 171 15.775 -22.167 -7.131 1.00 11.98 H new ATOM 0 HA3 GLY A 171 16.883 -22.494 -6.084 1.00 11.98 H new ATOM 3004 N LEU A 172 18.103 -24.144 -8.047 1.00 10.65 N ATOM 3005 CA LEU A 172 18.992 -24.461 -9.149 1.00 10.30 C ATOM 3006 C LEU A 172 18.225 -24.473 -10.452 1.00 10.39 C ATOM 3007 O LEU A 172 18.626 -23.846 -11.423 1.00 10.30 O ATOM 3008 CB LEU A 172 19.695 -25.793 -8.895 1.00 10.83 C ATOM 3009 CG LEU A 172 20.326 -26.471 -10.096 1.00 10.41 C ATOM 3010 CD1 LEU A 172 21.470 -25.588 -10.644 1.00 10.83 C ATOM 3011 CD2 LEU A 172 20.848 -27.854 -9.758 1.00 14.50 C ATOM 0 H LEU A 172 18.043 -24.760 -7.450 1.00 10.65 H new ATOM 0 HA LEU A 172 19.675 -23.776 -9.215 1.00 10.30 H new ATOM 0 HB2 LEU A 172 20.387 -25.648 -8.231 1.00 10.83 H new ATOM 0 HB3 LEU A 172 19.052 -26.405 -8.505 1.00 10.83 H new ATOM 0 HG LEU A 172 19.640 -26.580 -10.773 1.00 10.41 H new ATOM 0 HD11 LEU A 172 21.874 -26.021 -11.412 1.00 10.83 H new ATOM 0 HD12 LEU A 172 21.114 -24.725 -10.910 1.00 10.83 H new ATOM 0 HD13 LEU A 172 22.141 -25.462 -9.955 1.00 10.83 H new ATOM 0 HD21 LEU A 172 21.243 -28.253 -10.549 1.00 14.50 H new ATOM 0 HD22 LEU A 172 21.520 -27.785 -9.062 1.00 14.50 H new ATOM 0 HD23 LEU A 172 20.116 -28.409 -9.447 1.00 14.50 H new ATOM 3023 N ALA A 173 17.115 -25.190 -10.495 1.00 11.69 N ATOM 3024 CA ALA A 173 16.356 -25.280 -11.733 1.00 14.03 C ATOM 3025 C ALA A 173 15.817 -23.914 -12.145 1.00 11.44 C ATOM 3026 O ALA A 173 15.860 -23.552 -13.327 1.00 14.26 O ATOM 3027 CB ALA A 173 15.234 -26.309 -11.556 1.00 11.04 C ATOM 0 H ALA A 173 16.786 -25.627 -9.831 1.00 11.69 H new ATOM 0 HA ALA A 173 16.937 -25.575 -12.451 1.00 14.03 H new ATOM 0 HB1 ALA A 173 14.723 -26.375 -12.378 1.00 11.04 H new ATOM 0 HB2 ALA A 173 15.618 -27.174 -11.344 1.00 11.04 H new ATOM 0 HB3 ALA A 173 14.650 -26.030 -10.834 1.00 11.04 H new ATOM 3033 N LEU A 174 15.273 -23.168 -11.194 1.00 9.94 N ATOM 3034 CA LEU A 174 14.869 -21.788 -11.435 1.00 9.43 C ATOM 3035 C LEU A 174 15.979 -21.002 -12.108 1.00 12.23 C ATOM 3036 O LEU A 174 15.759 -20.350 -13.138 1.00 11.47 O ATOM 3037 CB LEU A 174 14.478 -21.119 -10.120 1.00 9.95 C ATOM 3038 CG LEU A 174 14.056 -19.664 -10.178 1.00 11.46 C ATOM 3039 CD1 LEU A 174 12.759 -19.466 -10.921 1.00 16.10 C ATOM 3040 CD2 LEU A 174 13.898 -19.078 -8.772 1.00 15.42 C ATOM 0 H LEU A 174 15.127 -23.445 -10.393 1.00 9.94 H new ATOM 0 HA LEU A 174 14.102 -21.798 -12.029 1.00 9.43 H new ATOM 0 HB2 LEU A 174 13.750 -21.627 -9.730 1.00 9.95 H new ATOM 0 HB3 LEU A 174 15.231 -21.189 -9.512 1.00 9.95 H new ATOM 0 HG LEU A 174 14.763 -19.204 -10.657 1.00 11.46 H new ATOM 0 HD11 LEU A 174 12.532 -18.523 -10.931 1.00 16.10 H new ATOM 0 HD12 LEU A 174 12.856 -19.784 -11.832 1.00 16.10 H new ATOM 0 HD13 LEU A 174 12.053 -19.963 -10.479 1.00 16.10 H new ATOM 0 HD21 LEU A 174 13.628 -18.149 -8.837 1.00 15.42 H new ATOM 0 HD22 LEU A 174 13.222 -19.577 -8.287 1.00 15.42 H new ATOM 0 HD23 LEU A 174 14.743 -19.137 -8.300 1.00 15.42 H new ATOM 3052 N ASN A 175 17.184 -21.051 -11.545 1.00 10.21 N ATOM 3053 CA ASN A 175 18.262 -20.216 -12.093 1.00 9.70 C ATOM 3054 C ASN A 175 18.807 -20.729 -13.409 1.00 8.67 C ATOM 3055 O ASN A 175 19.164 -19.918 -14.255 1.00 10.52 O ATOM 3056 CB ASN A 175 19.415 -20.123 -11.103 1.00 11.94 C ATOM 3057 CG ASN A 175 19.095 -19.208 -9.970 1.00 11.72 C ATOM 3058 OD1 ASN A 175 17.941 -18.766 -9.835 1.00 12.01 O ATOM 3059 ND2 ASN A 175 20.083 -18.928 -9.125 1.00 12.69 N ATOM 0 H ASN A 175 17.398 -21.540 -10.871 1.00 10.21 H new ATOM 0 HA ASN A 175 17.867 -19.345 -12.252 1.00 9.70 H new ATOM 0 HB2 ASN A 175 19.618 -21.007 -10.758 1.00 11.94 H new ATOM 0 HB3 ASN A 175 20.210 -19.807 -11.560 1.00 11.94 H new ATOM 0 HD21 ASN A 175 19.938 -18.419 -8.447 1.00 12.69 H new ATOM 0 HD22 ASN A 175 20.867 -19.256 -9.257 1.00 12.69 H new ATOM 3066 N PHE A 176 18.808 -22.052 -13.632 1.00 9.18 N ATOM 3067 CA PHE A 176 19.193 -22.597 -14.936 1.00 9.60 C ATOM 3068 C PHE A 176 18.165 -22.180 -15.975 1.00 11.07 C ATOM 3069 O PHE A 176 18.525 -21.845 -17.101 1.00 11.12 O ATOM 3070 CB PHE A 176 19.337 -24.116 -14.837 1.00 10.15 C ATOM 3071 CG PHE A 176 20.134 -24.770 -15.938 1.00 11.12 C ATOM 3072 CD1 PHE A 176 20.960 -24.073 -16.767 1.00 10.89 C ATOM 3073 CD2 PHE A 176 20.057 -26.134 -16.098 1.00 11.83 C ATOM 3074 CE1 PHE A 176 21.711 -24.717 -17.747 1.00 11.18 C ATOM 3075 CE2 PHE A 176 20.798 -26.802 -17.086 1.00 13.88 C ATOM 3076 CZ PHE A 176 21.634 -26.082 -17.896 1.00 15.26 C ATOM 0 H PHE A 176 18.591 -22.642 -13.045 1.00 9.18 H new ATOM 0 HA PHE A 176 20.053 -22.244 -15.212 1.00 9.60 H new ATOM 0 HB2 PHE A 176 19.753 -24.330 -13.988 1.00 10.15 H new ATOM 0 HB3 PHE A 176 18.450 -24.508 -14.825 1.00 10.15 H new ATOM 0 HD1 PHE A 176 21.024 -23.150 -16.677 1.00 10.89 H new ATOM 0 HD2 PHE A 176 19.501 -26.626 -15.538 1.00 11.83 H new ATOM 0 HE1 PHE A 176 22.267 -24.222 -18.304 1.00 11.18 H new ATOM 0 HE2 PHE A 176 20.722 -27.723 -17.189 1.00 13.88 H new ATOM 0 HZ PHE A 176 22.146 -26.512 -18.542 1.00 15.26 H new ATOM 3086 N SER A 177 16.878 -22.131 -15.600 1.00 9.83 N ATOM 3087 CA ASER A 177 15.861 -21.656 -16.539 0.59 8.92 C ATOM 3088 CA BSER A 177 15.846 -21.647 -16.519 0.41 9.00 C ATOM 3089 C SER A 177 16.076 -20.185 -16.886 1.00 13.19 C ATOM 3090 O SER A 177 15.920 -19.796 -18.044 1.00 12.49 O ATOM 3091 CB ASER A 177 14.465 -21.890 -15.966 0.59 12.30 C ATOM 3092 CB BSER A 177 14.474 -21.852 -15.878 0.41 12.29 C ATOM 3093 OG ASER A 177 14.167 -20.988 -14.917 0.59 16.44 O ATOM 3094 OG BSER A 177 13.438 -21.216 -16.592 0.41 9.44 O ATOM 0 H ASER A 177 16.583 -22.363 -14.826 0.59 9.83 H new ATOM 0 H BSER A 177 16.588 -22.371 -14.827 0.41 9.83 H new ATOM 0 HA ASER A 177 15.943 -22.162 -17.362 0.59 9.00 H new ATOM 0 HA BSER A 177 15.889 -22.153 -17.345 0.41 9.00 H new ATOM 0 HB2ASER A 177 13.806 -21.794 -16.671 0.59 12.29 H new ATOM 0 HB2BSER A 177 14.287 -22.802 -15.821 0.41 12.29 H new ATOM 0 HB3ASER A 177 14.399 -22.800 -15.638 0.59 12.29 H new ATOM 0 HB3BSER A 177 14.492 -21.512 -14.970 0.41 12.29 H new ATOM 0 HG ASER A 177 14.739 -21.068 -14.307 0.59 9.44 H new ATOM 0 HG BSER A 177 13.101 -21.757 -17.139 0.41 9.44 H new ATOM 3105 N VAL A 178 16.458 -19.361 -15.910 1.00 11.16 N ATOM 3106 CA VAL A 178 16.753 -17.954 -16.179 1.00 10.17 C ATOM 3107 C VAL A 178 17.970 -17.838 -17.082 1.00 9.74 C ATOM 3108 O VAL A 178 17.981 -17.043 -18.036 1.00 12.28 O ATOM 3109 CB VAL A 178 16.954 -17.187 -14.863 1.00 11.14 C ATOM 3110 CG1 VAL A 178 17.489 -15.800 -15.148 1.00 11.83 C ATOM 3111 CG2 VAL A 178 15.629 -17.078 -14.083 1.00 14.29 C ATOM 0 H VAL A 178 16.552 -19.596 -15.088 1.00 11.16 H new ATOM 0 HA VAL A 178 15.999 -17.555 -16.640 1.00 10.17 H new ATOM 0 HB VAL A 178 17.593 -17.677 -14.322 1.00 11.14 H new ATOM 0 HG11 VAL A 178 17.613 -15.323 -14.313 1.00 11.83 H new ATOM 0 HG12 VAL A 178 18.339 -15.869 -15.609 1.00 11.83 H new ATOM 0 HG13 VAL A 178 16.858 -15.318 -15.705 1.00 11.83 H new ATOM 0 HG21 VAL A 178 15.778 -16.591 -13.257 1.00 14.29 H new ATOM 0 HG22 VAL A 178 14.974 -16.607 -14.622 1.00 14.29 H new ATOM 0 HG23 VAL A 178 15.300 -17.967 -13.879 1.00 14.29 H new ATOM 3121 N PHE A 179 18.990 -18.663 -16.830 1.00 11.07 N ATOM 3122 CA PHE A 179 20.142 -18.741 -17.726 1.00 10.37 C ATOM 3123 C PHE A 179 19.705 -19.021 -19.162 1.00 11.07 C ATOM 3124 O PHE A 179 20.121 -18.336 -20.087 1.00 11.60 O ATOM 3125 CB PHE A 179 21.103 -19.823 -17.244 1.00 11.46 C ATOM 3126 CG PHE A 179 22.154 -20.204 -18.272 1.00 10.95 C ATOM 3127 CD1 PHE A 179 23.330 -19.484 -18.384 1.00 15.16 C ATOM 3128 CD2 PHE A 179 21.960 -21.263 -19.110 1.00 11.64 C ATOM 3129 CE1 PHE A 179 24.276 -19.839 -19.340 1.00 11.80 C ATOM 3130 CE2 PHE A 179 22.921 -21.630 -20.051 1.00 16.10 C ATOM 3131 CZ PHE A 179 24.071 -20.904 -20.145 1.00 16.46 C ATOM 0 H PHE A 179 19.032 -19.184 -16.147 1.00 11.07 H new ATOM 0 HA PHE A 179 20.596 -17.884 -17.714 1.00 10.37 H new ATOM 0 HB2 PHE A 179 21.546 -19.516 -16.438 1.00 11.46 H new ATOM 0 HB3 PHE A 179 20.594 -20.613 -17.004 1.00 11.46 H new ATOM 0 HD1 PHE A 179 23.488 -18.762 -17.820 1.00 15.16 H new ATOM 0 HD2 PHE A 179 21.170 -21.750 -19.052 1.00 11.64 H new ATOM 0 HE1 PHE A 179 25.056 -19.339 -19.426 1.00 11.80 H new ATOM 0 HE2 PHE A 179 22.779 -22.361 -20.608 1.00 16.10 H new ATOM 0 HZ PHE A 179 24.719 -21.144 -20.768 1.00 16.46 H new ATOM 3141 N HIS A 180 18.852 -20.035 -19.367 1.00 11.13 N ATOM 3142 CA HIS A 180 18.397 -20.339 -20.712 1.00 11.15 C ATOM 3143 C HIS A 180 17.695 -19.150 -21.346 1.00 10.14 C ATOM 3144 O HIS A 180 17.906 -18.857 -22.525 1.00 12.10 O ATOM 3145 CB HIS A 180 17.446 -21.552 -20.707 1.00 10.85 C ATOM 3146 CG HIS A 180 18.120 -22.860 -20.434 1.00 12.68 C ATOM 3147 ND1 HIS A 180 19.207 -23.303 -21.151 1.00 14.27 N ATOM 3148 CD2 HIS A 180 17.844 -23.834 -19.531 1.00 14.69 C ATOM 3149 CE1 HIS A 180 19.579 -24.489 -20.700 1.00 14.88 C ATOM 3150 NE2 HIS A 180 18.762 -24.842 -19.724 1.00 14.92 N ATOM 0 H HIS A 180 18.536 -20.543 -18.750 1.00 11.13 H new ATOM 0 HA HIS A 180 19.184 -20.550 -21.238 1.00 11.15 H new ATOM 0 HB2 HIS A 180 16.759 -21.408 -20.038 1.00 10.85 H new ATOM 0 HB3 HIS A 180 16.999 -21.603 -21.566 1.00 10.85 H new ATOM 0 HD1 HIS A 180 19.586 -22.875 -21.793 1.00 14.27 H new ATOM 0 HD2 HIS A 180 17.162 -23.823 -18.899 1.00 14.69 H new ATOM 0 HE1 HIS A 180 20.295 -24.990 -21.017 1.00 14.88 H new ATOM 3158 N TYR A 181 16.816 -18.478 -20.597 1.00 10.74 N ATOM 3159 CA TYR A 181 16.007 -17.418 -21.182 1.00 13.09 C ATOM 3160 C TYR A 181 16.827 -16.152 -21.448 1.00 14.29 C ATOM 3161 O TYR A 181 16.737 -15.548 -22.535 1.00 17.95 O ATOM 3162 CB TYR A 181 14.857 -17.093 -20.253 1.00 14.87 C ATOM 3163 CG TYR A 181 13.792 -16.265 -20.908 1.00 14.35 C ATOM 3164 CD1 TYR A 181 13.896 -14.881 -20.955 1.00 18.54 C ATOM 3165 CD2 TYR A 181 12.688 -16.870 -21.494 1.00 17.98 C ATOM 3166 CE1 TYR A 181 12.924 -14.132 -21.573 1.00 17.35 C ATOM 3167 CE2 TYR A 181 11.706 -16.112 -22.110 1.00 19.60 C ATOM 3168 CZ TYR A 181 11.832 -14.743 -22.139 1.00 24.35 C ATOM 3169 OH TYR A 181 10.837 -13.988 -22.760 1.00 27.27 O ATOM 0 H TYR A 181 16.678 -18.621 -19.760 1.00 10.74 H new ATOM 0 HA TYR A 181 15.671 -17.735 -22.035 1.00 13.09 H new ATOM 0 HB2 TYR A 181 14.465 -17.919 -19.930 1.00 14.87 H new ATOM 0 HB3 TYR A 181 15.197 -16.619 -19.478 1.00 14.87 H new ATOM 0 HD1 TYR A 181 14.628 -14.459 -20.566 1.00 18.54 H new ATOM 0 HD2 TYR A 181 12.607 -17.796 -21.473 1.00 17.98 H new ATOM 0 HE1 TYR A 181 13.006 -13.206 -21.608 1.00 17.35 H new ATOM 0 HE2 TYR A 181 10.969 -16.525 -22.500 1.00 19.60 H new ATOM 0 HH TYR A 181 11.175 -13.289 -23.081 1.00 27.27 H new ATOM 3179 N AGLU A 182 17.629 -15.734 -20.467 0.48 13.23 N ATOM 3180 N BGLU A 182 17.624 -15.732 -20.463 0.52 13.20 N ATOM 3181 CA AGLU A 182 18.269 -14.428 -20.507 0.48 14.20 C ATOM 3182 CA BGLU A 182 18.270 -14.428 -20.489 0.52 14.10 C ATOM 3183 C AGLU A 182 19.676 -14.442 -21.084 0.48 16.41 C ATOM 3184 C BGLU A 182 19.673 -14.442 -21.079 0.52 16.40 C ATOM 3185 O AGLU A 182 20.128 -13.411 -21.595 0.48 17.61 O ATOM 3186 O BGLU A 182 20.119 -13.411 -21.598 0.52 17.59 O ATOM 3187 CB AGLU A 182 18.330 -13.837 -19.102 0.48 15.99 C ATOM 3188 CB BGLU A 182 18.342 -13.860 -19.073 0.52 15.94 C ATOM 3189 CG AGLU A 182 16.984 -13.516 -18.521 0.48 16.55 C ATOM 3190 CG BGLU A 182 16.999 -13.531 -18.456 0.52 16.48 C ATOM 3191 CD AGLU A 182 17.072 -12.760 -17.217 0.48 26.37 C ATOM 3192 CD BGLU A 182 16.286 -12.382 -19.162 0.52 26.55 C ATOM 3193 OE1AGLU A 182 18.203 -12.551 -16.712 0.48 20.78 O ATOM 3194 OE1BGLU A 182 16.960 -11.622 -19.883 0.52 40.25 O ATOM 3195 OE2AGLU A 182 16.001 -12.384 -16.703 0.48 20.33 O ATOM 3196 OE2BGLU A 182 15.060 -12.236 -18.990 0.52 35.59 O ATOM 0 H AGLU A 182 17.813 -16.198 -19.767 0.48 13.20 H new ATOM 0 H BGLU A 182 17.802 -16.199 -19.763 0.52 13.20 H new ATOM 0 HA AGLU A 182 17.723 -13.888 -21.099 0.48 14.10 H new ATOM 0 HA BGLU A 182 17.724 -13.874 -21.068 0.52 14.10 H new ATOM 0 HB2AGLU A 182 18.785 -14.463 -18.517 0.48 15.94 H new ATOM 0 HB2BGLU A 182 18.798 -14.499 -18.504 0.52 15.94 H new ATOM 0 HB3AGLU A 182 18.865 -13.028 -19.123 0.48 15.94 H new ATOM 0 HB3BGLU A 182 18.884 -13.056 -19.087 0.52 15.94 H new ATOM 0 HG2AGLU A 182 16.478 -12.991 -19.160 0.48 16.48 H new ATOM 0 HG2BGLU A 182 16.435 -14.320 -18.481 0.52 16.48 H new ATOM 0 HG3AGLU A 182 16.493 -14.340 -18.379 0.48 16.48 H new ATOM 0 HG3BGLU A 182 17.125 -13.302 -17.522 0.52 16.48 H new ATOM 3209 N ILE A 183 20.372 -15.565 -21.013 1.00 14.64 N ATOM 3210 CA ILE A 183 21.771 -15.648 -21.399 1.00 13.23 C ATOM 3211 C ILE A 183 21.958 -16.442 -22.677 1.00 16.91 C ATOM 3212 O ILE A 183 22.701 -16.017 -23.568 1.00 16.93 O ATOM 3213 CB ILE A 183 22.640 -16.244 -20.266 1.00 15.64 C ATOM 3214 CG1 ILE A 183 22.492 -15.470 -18.961 1.00 16.05 C ATOM 3215 CG2 ILE A 183 24.116 -16.341 -20.736 1.00 14.94 C ATOM 3216 CD1 ILE A 183 22.875 -14.034 -19.006 1.00 17.53 C ATOM 0 H AILE A 183 20.042 -16.309 -20.736 0.48 14.64 H new ATOM 0 H BILE A 183 20.043 -16.311 -20.739 0.52 14.64 H new ATOM 0 HA ILE A 183 22.067 -14.739 -21.564 1.00 13.23 H new ATOM 0 HB ILE A 183 22.324 -17.141 -20.073 1.00 15.64 H new ATOM 0 HG12 ILE A 183 21.568 -15.531 -18.673 1.00 16.05 H new ATOM 0 HG13 ILE A 183 23.030 -15.908 -18.283 1.00 16.05 H new ATOM 0 HG21 ILE A 183 24.659 -16.715 -20.024 1.00 14.94 H new ATOM 0 HG22 ILE A 183 24.170 -16.913 -21.518 1.00 14.94 H new ATOM 0 HG23 ILE A 183 24.443 -15.456 -20.960 1.00 14.94 H new ATOM 0 HD11 ILE A 183 22.744 -13.636 -18.131 1.00 17.53 H new ATOM 0 HD12 ILE A 183 23.808 -13.955 -19.260 1.00 17.53 H new ATOM 0 HD13 ILE A 183 22.323 -13.572 -19.656 1.00 17.53 H new ATOM 3228 N ALA A 184 21.334 -17.637 -22.762 1.00 14.63 N ATOM 3229 CA ALA A 184 21.598 -18.608 -23.808 1.00 15.37 C ATOM 3230 C ALA A 184 20.646 -18.481 -24.983 1.00 13.93 C ATOM 3231 O ALA A 184 20.716 -19.317 -25.891 1.00 17.11 O ATOM 3232 CB ALA A 184 21.517 -20.024 -23.229 1.00 16.96 C ATOM 0 H ALA A 184 20.739 -17.895 -22.197 1.00 14.63 H new ATOM 0 HA ALA A 184 22.491 -18.430 -24.144 1.00 15.37 H new ATOM 0 HB1 ALA A 184 21.694 -20.671 -23.930 1.00 16.96 H new ATOM 0 HB2 ALA A 184 22.176 -20.124 -22.524 1.00 16.96 H new ATOM 0 HB3 ALA A 184 20.630 -20.175 -22.866 1.00 16.96 H new ATOM 3238 N ASN A 185 19.764 -17.484 -24.987 1.00 14.09 N ATOM 3239 CA ASN A 185 18.838 -17.280 -26.110 1.00 18.32 C ATOM 3240 C ASN A 185 18.020 -18.542 -26.378 1.00 18.48 C ATOM 3241 O ASN A 185 17.808 -18.945 -27.531 1.00 18.93 O ATOM 3242 CB ASN A 185 19.592 -16.871 -27.374 1.00 20.77 C ATOM 3243 CG ASN A 185 18.656 -16.337 -28.484 1.00 27.70 C ATOM 3244 OD1 ASN A 185 17.625 -15.717 -28.208 1.00 31.17 O ATOM 3245 ND2 ASN A 185 19.015 -16.605 -29.731 1.00 30.56 N ATOM 0 H ASN A 185 19.682 -16.912 -24.350 1.00 14.09 H new ATOM 0 HA ASN A 185 18.233 -16.563 -25.864 1.00 18.32 H new ATOM 0 HB2 ASN A 185 20.244 -16.188 -27.150 1.00 20.77 H new ATOM 0 HB3 ASN A 185 20.086 -17.634 -27.712 1.00 20.77 H new ATOM 0 HD21 ASN A 185 18.522 -16.344 -30.386 1.00 30.56 H new ATOM 0 HD22 ASN A 185 19.741 -17.040 -29.886 1.00 30.56 H new ATOM 3252 N SER A 186 17.578 -19.192 -25.305 1.00 14.97 N ATOM 3253 CA SER A 186 16.835 -20.458 -25.400 1.00 14.15 C ATOM 3254 C SER A 186 15.546 -20.385 -24.583 1.00 14.18 C ATOM 3255 O SER A 186 15.386 -21.075 -23.571 1.00 13.45 O ATOM 3256 CB SER A 186 17.702 -21.613 -24.932 1.00 15.91 C ATOM 3257 OG SER A 186 18.897 -21.751 -25.664 1.00 17.60 O ATOM 0 H SER A 186 17.698 -18.916 -24.499 1.00 14.97 H new ATOM 0 HA SER A 186 16.597 -20.609 -26.328 1.00 14.15 H new ATOM 0 HB2 SER A 186 17.918 -21.487 -23.995 1.00 15.91 H new ATOM 0 HB3 SER A 186 17.194 -22.437 -24.998 1.00 15.91 H new ATOM 0 HG SER A 186 18.768 -22.264 -26.317 1.00 17.60 H new ATOM 3263 N PRO A 187 14.614 -19.514 -24.974 1.00 14.28 N ATOM 3264 CA PRO A 187 13.402 -19.349 -24.162 1.00 14.66 C ATOM 3265 C PRO A 187 12.560 -20.608 -24.099 1.00 16.69 C ATOM 3266 O PRO A 187 11.907 -20.844 -23.074 1.00 14.99 O ATOM 3267 CB PRO A 187 12.660 -18.192 -24.846 1.00 15.82 C ATOM 3268 CG PRO A 187 13.215 -18.175 -26.245 1.00 17.14 C ATOM 3269 CD PRO A 187 14.648 -18.572 -26.118 1.00 16.89 C ATOM 0 HA PRO A 187 13.609 -19.165 -23.232 1.00 14.66 H new ATOM 0 HB2 PRO A 187 11.701 -18.337 -24.847 1.00 15.82 H new ATOM 0 HB3 PRO A 187 12.819 -17.350 -24.391 1.00 15.82 H new ATOM 0 HG2 PRO A 187 12.733 -18.791 -26.818 1.00 17.14 H new ATOM 0 HG3 PRO A 187 13.132 -17.294 -26.642 1.00 17.14 H new ATOM 0 HD2 PRO A 187 14.979 -18.995 -26.926 1.00 16.89 H new ATOM 0 HD3 PRO A 187 15.221 -17.809 -25.942 1.00 16.89 H new ATOM 3277 N GLU A 188 12.542 -21.430 -25.140 1.00 15.28 N ATOM 3278 CA GLU A 188 11.739 -22.645 -25.045 1.00 16.36 C ATOM 3279 C GLU A 188 12.308 -23.603 -24.010 1.00 12.03 C ATOM 3280 O GLU A 188 11.550 -24.267 -23.279 1.00 14.12 O ATOM 3281 CB GLU A 188 11.629 -23.303 -26.421 1.00 16.30 C ATOM 3282 CG GLU A 188 10.716 -22.541 -27.341 1.00 18.91 C ATOM 3283 CD GLU A 188 10.601 -23.123 -28.752 1.00 24.61 C ATOM 3284 OE1 GLU A 188 11.552 -23.783 -29.224 1.00 27.26 O ATOM 3285 OE2 GLU A 188 9.533 -22.910 -29.369 1.00 26.65 O ATOM 0 H GLU A 188 12.966 -21.314 -25.879 1.00 15.28 H new ATOM 0 HA GLU A 188 10.847 -22.407 -24.747 1.00 16.36 H new ATOM 0 HB2 GLU A 188 12.511 -23.364 -26.820 1.00 16.30 H new ATOM 0 HB3 GLU A 188 11.300 -24.210 -26.319 1.00 16.30 H new ATOM 0 HG2 GLU A 188 9.831 -22.508 -26.945 1.00 18.91 H new ATOM 0 HG3 GLU A 188 11.032 -21.626 -27.406 1.00 18.91 H new ATOM 3292 N GLU A 189 13.637 -23.728 -23.956 1.00 14.24 N ATOM 3293 CA GLU A 189 14.254 -24.573 -22.939 1.00 13.91 C ATOM 3294 C GLU A 189 13.974 -24.020 -21.557 1.00 13.47 C ATOM 3295 O GLU A 189 13.725 -24.777 -20.599 1.00 13.52 O ATOM 3296 CB GLU A 189 15.760 -24.677 -23.171 1.00 13.36 C ATOM 3297 CG GLU A 189 16.478 -25.616 -22.258 1.00 12.66 C ATOM 3298 CD GLU A 189 16.262 -27.125 -22.569 1.00 22.68 C ATOM 3299 OE1 GLU A 189 16.597 -27.950 -21.707 1.00 19.87 O ATOM 3300 OE2 GLU A 189 15.782 -27.439 -23.658 1.00 17.68 O ATOM 0 H GLU A 189 14.187 -23.339 -24.490 1.00 14.24 H new ATOM 0 HA GLU A 189 13.870 -25.462 -23.003 1.00 13.91 H new ATOM 0 HB2 GLU A 189 15.914 -24.958 -24.087 1.00 13.36 H new ATOM 0 HB3 GLU A 189 16.150 -23.794 -23.076 1.00 13.36 H new ATOM 0 HG2 GLU A 189 17.428 -25.423 -22.299 1.00 12.66 H new ATOM 0 HG3 GLU A 189 16.192 -25.443 -21.347 1.00 12.66 H new ATOM 3307 N ALA A 190 14.034 -22.703 -21.426 1.00 12.01 N ATOM 3308 CA ALA A 190 13.718 -22.081 -20.144 1.00 10.03 C ATOM 3309 C ALA A 190 12.312 -22.419 -19.682 1.00 14.71 C ATOM 3310 O ALA A 190 12.091 -22.750 -18.512 1.00 13.63 O ATOM 3311 CB ALA A 190 13.865 -20.563 -20.231 1.00 12.25 C ATOM 0 H ALA A 190 14.251 -22.157 -22.054 1.00 12.01 H new ATOM 0 HA ALA A 190 14.348 -22.435 -19.496 1.00 10.03 H new ATOM 0 HB1 ALA A 190 13.651 -20.167 -19.372 1.00 12.25 H new ATOM 0 HB2 ALA A 190 14.778 -20.339 -20.472 1.00 12.25 H new ATOM 0 HB3 ALA A 190 13.259 -20.217 -20.905 1.00 12.25 H new ATOM 3317 N ILE A 191 11.346 -22.306 -20.581 1.00 12.58 N ATOM 3318 CA ILE A 191 9.947 -22.566 -20.243 1.00 15.45 C ATOM 3319 C ILE A 191 9.725 -24.044 -19.920 1.00 13.29 C ATOM 3320 O ILE A 191 9.054 -24.385 -18.941 1.00 13.69 O ATOM 3321 CB ILE A 191 9.049 -22.075 -21.398 1.00 13.78 C ATOM 3322 CG1 ILE A 191 9.080 -20.563 -21.486 1.00 15.89 C ATOM 3323 CG2 ILE A 191 7.634 -22.602 -21.242 1.00 16.99 C ATOM 3324 CD1 ILE A 191 8.597 -20.012 -22.836 1.00 16.68 C ATOM 0 H ILE A 191 11.477 -22.078 -21.400 1.00 12.58 H new ATOM 0 HA ILE A 191 9.708 -22.075 -19.441 1.00 15.45 H new ATOM 0 HB ILE A 191 9.396 -22.425 -22.233 1.00 13.78 H new ATOM 0 HG12 ILE A 191 8.527 -20.195 -20.779 1.00 15.89 H new ATOM 0 HG13 ILE A 191 9.986 -20.256 -21.326 1.00 15.89 H new ATOM 0 HG21 ILE A 191 7.087 -22.283 -21.976 1.00 16.99 H new ATOM 0 HG22 ILE A 191 7.647 -23.572 -21.247 1.00 16.99 H new ATOM 0 HG23 ILE A 191 7.263 -22.289 -20.403 1.00 16.99 H new ATOM 0 HD11 ILE A 191 8.642 -19.043 -22.825 1.00 16.68 H new ATOM 0 HD12 ILE A 191 9.163 -20.354 -23.546 1.00 16.68 H new ATOM 0 HD13 ILE A 191 7.681 -20.291 -22.990 1.00 16.68 H new ATOM 3336 N SER A 192 10.286 -24.934 -20.733 1.00 11.00 N ATOM 3337 CA ASER A 192 10.157 -26.367 -20.491 0.31 13.42 C ATOM 3338 CA BSER A 192 10.172 -26.370 -20.497 0.69 13.26 C ATOM 3339 C SER A 192 10.745 -26.753 -19.142 1.00 14.50 C ATOM 3340 O SER A 192 10.137 -27.524 -18.384 1.00 15.04 O ATOM 3341 CB ASER A 192 10.855 -27.137 -21.608 0.31 16.62 C ATOM 3342 CB BSER A 192 10.907 -27.133 -21.590 0.69 16.21 C ATOM 3343 OG ASER A 192 10.191 -26.944 -22.846 0.31 16.51 O ATOM 3344 OG BSER A 192 10.774 -28.539 -21.362 0.69 21.97 O ATOM 0 H ASER A 192 10.746 -24.729 -21.430 0.31 11.00 H new ATOM 0 H BSER A 192 10.741 -24.725 -21.432 0.69 11.00 H new ATOM 0 HA ASER A 192 9.214 -26.593 -20.480 0.31 13.26 H new ATOM 0 HA BSER A 192 9.230 -26.602 -20.509 0.69 13.26 H new ATOM 0 HB2ASER A 192 11.777 -26.843 -21.682 0.31 16.21 H new ATOM 0 HB2BSER A 192 10.545 -26.901 -22.459 0.69 16.21 H new ATOM 0 HB3ASER A 192 10.875 -28.082 -21.391 0.31 16.21 H new ATOM 0 HB3BSER A 192 11.844 -26.884 -21.597 0.69 16.21 H new ATOM 0 HG ASER A 192 10.477 -26.244 -23.212 0.31 21.97 H new ATOM 0 HG BSER A 192 11.456 -28.824 -20.963 0.69 21.97 H new ATOM 3355 N LEU A 193 11.931 -26.227 -18.820 1.00 13.30 N ATOM 3356 CA LEU A 193 12.532 -26.569 -17.532 1.00 14.25 C ATOM 3357 C LEU A 193 11.683 -26.064 -16.373 1.00 12.89 C ATOM 3358 O LEU A 193 11.468 -26.800 -15.390 1.00 13.10 O ATOM 3359 CB LEU A 193 13.949 -26.036 -17.472 1.00 13.52 C ATOM 3360 CG LEU A 193 14.680 -26.286 -16.169 1.00 13.42 C ATOM 3361 CD1 LEU A 193 14.707 -27.741 -15.785 1.00 14.53 C ATOM 3362 CD2 LEU A 193 16.113 -25.747 -16.301 1.00 15.04 C ATOM 0 H LEU A 193 12.387 -25.691 -19.313 1.00 13.30 H new ATOM 0 HA LEU A 193 12.567 -27.535 -17.447 1.00 14.25 H new ATOM 0 HB2 LEU A 193 14.460 -26.435 -18.194 1.00 13.52 H new ATOM 0 HB3 LEU A 193 13.926 -25.080 -17.635 1.00 13.52 H new ATOM 0 HG LEU A 193 14.202 -25.825 -15.462 1.00 13.42 H new ATOM 0 HD11 LEU A 193 15.185 -27.846 -14.947 1.00 14.53 H new ATOM 0 HD12 LEU A 193 13.799 -28.066 -15.682 1.00 14.53 H new ATOM 0 HD13 LEU A 193 15.155 -28.251 -16.478 1.00 14.53 H new ATOM 0 HD21 LEU A 193 16.594 -25.900 -15.473 1.00 15.04 H new ATOM 0 HD22 LEU A 193 16.565 -26.205 -17.027 1.00 15.04 H new ATOM 0 HD23 LEU A 193 16.085 -24.795 -16.487 1.00 15.04 H new ATOM 3374 N ALA A 194 11.199 -24.821 -16.462 1.00 12.84 N ATOM 3375 CA ALA A 194 10.401 -24.268 -15.374 1.00 13.98 C ATOM 3376 C ALA A 194 9.129 -25.079 -15.172 1.00 15.33 C ATOM 3377 O ALA A 194 8.751 -25.378 -14.031 1.00 14.28 O ATOM 3378 CB ALA A 194 10.047 -22.814 -15.648 1.00 14.40 C ATOM 0 H ALA A 194 11.320 -24.294 -17.131 1.00 12.84 H new ATOM 0 HA ALA A 194 10.933 -24.313 -14.564 1.00 13.98 H new ATOM 0 HB1 ALA A 194 9.517 -22.466 -14.914 1.00 14.40 H new ATOM 0 HB2 ALA A 194 10.861 -22.293 -15.734 1.00 14.40 H new ATOM 0 HB3 ALA A 194 9.537 -22.754 -16.471 1.00 14.40 H new ATOM 3384 N LYS A 195 8.470 -25.463 -16.276 1.00 15.20 N ATOM 3385 CA ALYS A 195 7.220 -26.219 -16.198 0.45 14.50 C ATOM 3386 CA BLYS A 195 7.216 -26.209 -16.180 0.55 14.43 C ATOM 3387 C LYS A 195 7.432 -27.604 -15.593 1.00 13.82 C ATOM 3388 O LYS A 195 6.713 -28.015 -14.676 1.00 15.03 O ATOM 3389 CB ALYS A 195 6.607 -26.366 -17.596 0.45 15.42 C ATOM 3390 CB BLYS A 195 6.557 -26.299 -17.564 0.55 15.22 C ATOM 3391 CG ALYS A 195 5.941 -25.146 -18.150 0.45 13.01 C ATOM 3392 CG BLYS A 195 5.044 -26.256 -17.505 0.55 26.73 C ATOM 3393 CD ALYS A 195 5.409 -25.424 -19.555 0.45 19.85 C ATOM 3394 CD BLYS A 195 4.398 -26.907 -18.713 0.55 30.18 C ATOM 3395 CE ALYS A 195 4.544 -24.284 -20.059 0.45 30.54 C ATOM 3396 CE BLYS A 195 2.886 -26.995 -18.524 0.55 29.12 C ATOM 3397 NZ ALYS A 195 4.045 -24.537 -21.435 0.45 32.73 N ATOM 3398 NZ BLYS A 195 2.513 -27.815 -17.331 0.55 28.08 N ATOM 0 H ALYS A 195 8.734 -25.293 -17.077 0.45 15.20 H new ATOM 0 H BLYS A 195 8.733 -25.301 -17.079 0.55 15.20 H new ATOM 0 HA ALYS A 195 6.617 -25.725 -15.621 0.45 14.43 H new ATOM 0 HA BLYS A 195 6.626 -25.732 -15.576 0.55 14.43 H new ATOM 0 HB2ALYS A 195 7.307 -26.638 -18.210 0.45 15.22 H new ATOM 0 HB2BLYS A 195 6.875 -25.567 -18.116 0.55 15.22 H new ATOM 0 HB3ALYS A 195 5.956 -27.085 -17.571 0.45 15.22 H new ATOM 0 HB3BLYS A 195 6.835 -27.122 -17.996 0.55 15.22 H new ATOM 0 HG2ALYS A 195 5.213 -24.876 -17.569 0.45 26.73 H new ATOM 0 HG2BLYS A 195 4.742 -26.704 -16.699 0.55 26.73 H new ATOM 0 HG3ALYS A 195 6.571 -24.409 -18.176 0.45 26.73 H new ATOM 0 HG3BLYS A 195 4.752 -25.333 -17.443 0.55 26.73 H new ATOM 0 HD2ALYS A 195 6.153 -25.560 -20.163 0.45 30.18 H new ATOM 0 HD2BLYS A 195 4.601 -26.395 -19.511 0.55 30.18 H new ATOM 0 HD3ALYS A 195 4.893 -26.245 -19.550 0.45 30.18 H new ATOM 0 HD3BLYS A 195 4.766 -27.795 -18.845 0.55 30.18 H new ATOM 0 HE2ALYS A 195 3.791 -24.160 -19.460 0.45 29.12 H new ATOM 0 HE2BLYS A 195 2.521 -26.101 -18.427 0.55 29.12 H new ATOM 0 HE3ALYS A 195 5.056 -23.460 -20.047 0.45 29.12 H new ATOM 0 HE3BLYS A 195 2.484 -27.381 -19.318 0.55 29.12 H new ATOM 0 HZ1ALYS A 195 3.543 -23.852 -21.700 0.45 28.08 H new ATOM 0 HZ1BLYS A 195 1.860 -28.379 -17.550 0.55 28.08 H new ATOM 0 HZ2ALYS A 195 4.735 -24.630 -21.989 0.45 28.08 H new ATOM 0 HZ2BLYS A 195 3.222 -28.276 -17.054 0.55 28.08 H new ATOM 0 HZ3ALYS A 195 3.557 -25.282 -21.442 0.45 28.08 H new ATOM 0 HZ3BLYS A 195 2.234 -27.279 -16.678 0.55 28.08 H new ATOM 3425 N THR A 196 8.405 -28.352 -16.107 1.00 13.53 N ATOM 3426 CA ATHR A 196 8.667 -29.692 -15.594 0.62 13.29 C ATOM 3427 CA BTHR A 196 8.640 -29.692 -15.586 0.38 13.44 C ATOM 3428 C THR A 196 9.058 -29.639 -14.124 1.00 13.78 C ATOM 3429 O THR A 196 8.614 -30.467 -13.317 1.00 14.78 O ATOM 3430 CB ATHR A 196 9.774 -30.361 -16.409 0.62 15.75 C ATOM 3431 CB BTHR A 196 9.698 -30.434 -16.401 0.38 15.81 C ATOM 3432 OG1ATHR A 196 9.288 -30.653 -17.732 0.62 20.37 O ATOM 3433 OG1BTHR A 196 10.883 -29.649 -16.516 0.38 15.72 O ATOM 3434 CG2ATHR A 196 10.236 -31.637 -15.775 0.62 15.82 C ATOM 3435 CG2BTHR A 196 9.162 -30.750 -17.790 0.38 18.87 C ATOM 0 H ATHR A 196 8.921 -28.104 -16.749 0.62 13.53 H new ATOM 0 H BTHR A 196 8.929 -28.108 -16.744 0.38 13.53 H new ATOM 0 HA ATHR A 196 7.854 -30.215 -15.676 0.62 13.44 H new ATOM 0 HA BTHR A 196 7.804 -30.179 -15.658 0.38 13.44 H new ATOM 0 HB ATHR A 196 10.524 -29.747 -16.446 0.62 15.81 H new ATOM 0 HB BTHR A 196 9.911 -31.261 -15.942 0.38 15.81 H new ATOM 0 HG1ATHR A 196 9.929 -30.642 -18.275 0.62 15.72 H new ATOM 0 HG1BTHR A 196 10.764 -29.043 -17.085 0.38 15.72 H new ATOM 0 HG21ATHR A 196 10.936 -32.033 -16.317 0.62 18.87 H new ATOM 0 HG21BTHR A 196 9.840 -31.221 -18.299 0.38 18.87 H new ATOM 0 HG22ATHR A 196 10.581 -31.451 -14.888 0.62 18.87 H new ATOM 0 HG22BTHR A 196 8.371 -31.307 -17.713 0.38 18.87 H new ATOM 0 HG23ATHR A 196 9.491 -32.254 -15.709 0.62 18.87 H new ATOM 0 HG23BTHR A 196 8.932 -29.924 -18.244 0.38 18.87 H new ATOM 3450 N THR A 197 9.925 -28.691 -13.771 1.00 13.79 N ATOM 3451 CA THR A 197 10.341 -28.529 -12.377 1.00 11.83 C ATOM 3452 C THR A 197 9.147 -28.269 -11.471 1.00 12.74 C ATOM 3453 O THR A 197 9.020 -28.880 -10.401 1.00 13.90 O ATOM 3454 CB THR A 197 11.340 -27.378 -12.261 1.00 13.74 C ATOM 3455 OG1 THR A 197 12.486 -27.646 -13.054 1.00 13.60 O ATOM 3456 CG2 THR A 197 11.825 -27.232 -10.832 1.00 12.81 C ATOM 0 H THR A 197 10.283 -28.134 -14.320 1.00 13.79 H new ATOM 0 HA THR A 197 10.763 -29.355 -12.092 1.00 11.83 H new ATOM 0 HB THR A 197 10.888 -26.572 -12.555 1.00 13.74 H new ATOM 0 HG1 THR A 197 12.332 -27.431 -13.851 1.00 13.60 H new ATOM 0 HG21 THR A 197 12.457 -26.498 -10.778 1.00 12.81 H new ATOM 0 HG22 THR A 197 11.070 -27.051 -10.251 1.00 12.81 H new ATOM 0 HG23 THR A 197 12.259 -28.053 -10.552 1.00 12.81 H new ATOM 3464 N PHE A 198 8.265 -27.361 -11.886 1.00 12.24 N ATOM 3465 CA PHE A 198 7.094 -27.022 -11.085 1.00 13.06 C ATOM 3466 C PHE A 198 6.180 -28.234 -10.933 1.00 12.33 C ATOM 3467 O PHE A 198 5.744 -28.563 -9.828 1.00 14.33 O ATOM 3468 CB PHE A 198 6.358 -25.852 -11.719 1.00 14.11 C ATOM 3469 CG PHE A 198 5.133 -25.396 -10.951 1.00 12.46 C ATOM 3470 CD1 PHE A 198 3.927 -26.066 -11.079 1.00 15.41 C ATOM 3471 CD2 PHE A 198 5.192 -24.314 -10.091 1.00 13.46 C ATOM 3472 CE1 PHE A 198 2.810 -25.653 -10.381 1.00 19.27 C ATOM 3473 CE2 PHE A 198 4.087 -23.889 -9.402 1.00 19.46 C ATOM 3474 CZ PHE A 198 2.885 -24.557 -9.531 1.00 18.37 C ATOM 0 H PHE A 198 8.328 -26.931 -12.628 1.00 12.24 H new ATOM 0 HA PHE A 198 7.381 -26.758 -10.197 1.00 13.06 H new ATOM 0 HB2 PHE A 198 6.971 -25.105 -11.803 1.00 14.11 H new ATOM 0 HB3 PHE A 198 6.090 -26.101 -12.617 1.00 14.11 H new ATOM 0 HD1 PHE A 198 3.869 -26.804 -11.643 1.00 15.41 H new ATOM 0 HD2 PHE A 198 5.999 -23.866 -9.978 1.00 13.46 H new ATOM 0 HE1 PHE A 198 2.006 -26.109 -10.480 1.00 19.27 H new ATOM 0 HE2 PHE A 198 4.146 -23.147 -8.845 1.00 19.46 H new ATOM 0 HZ PHE A 198 2.136 -24.277 -9.055 1.00 18.37 H new ATOM 3484 N ASP A 199 5.896 -28.917 -12.031 1.00 14.48 N ATOM 3485 CA ASP A 199 4.970 -30.049 -11.990 1.00 16.78 C ATOM 3486 C ASP A 199 5.504 -31.196 -11.134 1.00 16.10 C ATOM 3487 O ASP A 199 4.753 -31.812 -10.383 1.00 18.53 O ATOM 3488 CB ASP A 199 4.673 -30.519 -13.419 1.00 16.10 C ATOM 3489 CG ASP A 199 3.846 -29.519 -14.215 1.00 22.51 C ATOM 3490 OD1 ASP A 199 3.199 -28.624 -13.595 1.00 37.31 O ATOM 3491 OD2 ASP A 199 3.850 -29.606 -15.480 1.00 37.38 O ATOM 0 H ASP A 199 6.224 -28.747 -12.808 1.00 14.48 H new ATOM 0 HA ASP A 199 4.146 -29.753 -11.573 1.00 16.78 H new ATOM 0 HB2 ASP A 199 5.510 -30.680 -13.882 1.00 16.10 H new ATOM 0 HB3 ASP A 199 4.201 -31.366 -13.384 1.00 16.10 H new ATOM 3496 N GLU A 200 6.788 -31.514 -11.239 1.00 13.59 N ATOM 3497 CA AGLU A 200 7.349 -32.594 -10.438 0.60 16.97 C ATOM 3498 CA BGLU A 200 7.335 -32.599 -10.438 0.40 16.97 C ATOM 3499 C GLU A 200 7.399 -32.220 -8.964 1.00 17.41 C ATOM 3500 O GLU A 200 7.226 -33.077 -8.092 1.00 15.68 O ATOM 3501 CB AGLU A 200 8.735 -32.962 -10.969 0.60 16.54 C ATOM 3502 CB BGLU A 200 8.714 -32.993 -10.960 0.40 16.60 C ATOM 3503 CG AGLU A 200 8.687 -33.686 -12.331 0.60 14.45 C ATOM 3504 CG BGLU A 200 9.187 -34.343 -10.447 0.40 25.12 C ATOM 3505 CD AGLU A 200 10.044 -33.851 -12.985 0.60 43.26 C ATOM 3506 CD BGLU A 200 10.312 -34.941 -11.277 0.40 46.70 C ATOM 3507 OE1AGLU A 200 10.074 -34.252 -14.171 0.60 41.80 O ATOM 3508 OE1BGLU A 200 10.365 -34.679 -12.497 0.40 51.33 O ATOM 3509 OE2AGLU A 200 11.078 -33.583 -12.335 0.60 38.93 O ATOM 3510 OE2BGLU A 200 11.149 -35.671 -10.703 0.40 26.63 O ATOM 0 H AGLU A 200 7.347 -31.122 -11.762 0.60 13.59 H new ATOM 0 H BGLU A 200 7.350 -31.122 -11.758 0.40 13.59 H new ATOM 0 HA AGLU A 200 6.772 -33.371 -10.513 0.60 16.97 H new ATOM 0 HA BGLU A 200 6.743 -33.364 -10.516 0.40 16.97 H new ATOM 0 HB2AGLU A 200 9.267 -32.156 -11.056 0.60 16.60 H new ATOM 0 HB2BGLU A 200 8.693 -33.012 -11.930 0.40 16.60 H new ATOM 0 HB3AGLU A 200 9.183 -33.529 -10.322 0.60 16.60 H new ATOM 0 HB3BGLU A 200 9.357 -32.313 -10.703 0.40 16.60 H new ATOM 0 HG2AGLU A 200 8.288 -34.562 -12.208 0.60 25.12 H new ATOM 0 HG2BGLU A 200 9.487 -34.246 -9.529 0.40 25.12 H new ATOM 0 HG3AGLU A 200 8.107 -33.191 -12.930 0.60 25.12 H new ATOM 0 HG3BGLU A 200 8.438 -34.959 -10.438 0.40 25.12 H new ATOM 3523 N ALA A 201 7.612 -30.952 -8.654 1.00 13.99 N ATOM 3524 CA ALA A 201 7.533 -30.558 -7.260 1.00 12.55 C ATOM 3525 C ALA A 201 6.097 -30.653 -6.742 1.00 16.08 C ATOM 3526 O ALA A 201 5.867 -31.110 -5.616 1.00 15.54 O ATOM 3527 CB ALA A 201 8.089 -29.138 -7.084 1.00 18.16 C ATOM 0 H ALA A 201 7.797 -30.325 -9.212 1.00 13.99 H new ATOM 0 HA ALA A 201 8.073 -31.169 -6.735 1.00 12.55 H new ATOM 0 HB1 ALA A 201 8.033 -28.882 -6.150 1.00 18.16 H new ATOM 0 HB2 ALA A 201 9.016 -29.115 -7.370 1.00 18.16 H new ATOM 0 HB3 ALA A 201 7.570 -28.518 -7.621 1.00 18.16 H new ATOM 3533 N MET A 202 5.129 -30.183 -7.526 1.00 13.63 N ATOM 3534 CA AMET A 202 3.732 -30.250 -7.110 0.57 15.32 C ATOM 3535 CA BMET A 202 3.727 -30.256 -7.125 0.43 15.37 C ATOM 3536 C MET A 202 3.345 -31.661 -6.678 1.00 14.22 C ATOM 3537 O MET A 202 2.675 -31.845 -5.646 1.00 14.84 O ATOM 3538 CB AMET A 202 2.823 -29.782 -8.248 0.57 18.56 C ATOM 3539 CB BMET A 202 2.829 -29.828 -8.289 0.43 18.57 C ATOM 3540 CG AMET A 202 1.339 -29.830 -7.909 0.57 23.36 C ATOM 3541 CG BMET A 202 2.768 -28.334 -8.526 0.43 15.08 C ATOM 3542 SD AMET A 202 0.833 -28.608 -6.698 0.57 30.17 S ATOM 3543 SD BMET A 202 1.904 -27.512 -7.188 0.43 17.24 S ATOM 3544 CE AMET A 202 0.815 -27.120 -7.709 0.57 48.04 C ATOM 3545 CE BMET A 202 0.195 -27.859 -7.608 0.43 42.09 C ATOM 0 H AMET A 202 5.259 -29.824 -8.297 0.57 13.63 H new ATOM 0 H BMET A 202 5.263 -29.818 -8.293 0.43 13.63 H new ATOM 0 HA AMET A 202 3.620 -29.663 -6.346 0.57 15.37 H new ATOM 0 HA BMET A 202 3.602 -29.655 -6.374 0.43 15.37 H new ATOM 0 HB2AMET A 202 3.062 -28.873 -8.489 0.57 18.57 H new ATOM 0 HB2BMET A 202 3.143 -30.259 -9.099 0.43 18.57 H new ATOM 0 HB3AMET A 202 2.986 -30.334 -9.029 0.57 18.57 H new ATOM 0 HB3BMET A 202 1.930 -30.154 -8.125 0.43 18.57 H new ATOM 0 HG2AMET A 202 0.826 -29.699 -8.722 0.57 15.08 H new ATOM 0 HG2BMET A 202 3.667 -27.978 -8.603 0.43 15.08 H new ATOM 0 HG3AMET A 202 1.121 -30.714 -7.575 0.57 15.08 H new ATOM 0 HG3BMET A 202 2.318 -28.154 -9.366 0.43 15.08 H new ATOM 0 HE1AMET A 202 0.347 -26.414 -7.237 0.57 42.09 H new ATOM 0 HE1BMET A 202 -0.296 -27.026 -7.681 0.43 42.09 H new ATOM 0 HE2AMET A 202 1.726 -26.839 -7.889 0.57 42.09 H new ATOM 0 HE2BMET A 202 0.159 -28.330 -8.455 0.43 42.09 H new ATOM 0 HE3AMET A 202 0.363 -27.303 -8.547 0.57 42.09 H new ATOM 0 HE3BMET A 202 -0.203 -28.409 -6.916 0.43 42.09 H new ATOM 3564 N ALA A 203 3.776 -32.670 -7.431 1.00 13.37 N ATOM 3565 CA ALA A 203 3.417 -34.058 -7.165 1.00 17.43 C ATOM 3566 C ALA A 203 4.119 -34.659 -5.967 1.00 18.19 C ATOM 3567 O ALA A 203 3.729 -35.753 -5.537 1.00 17.09 O ATOM 3568 CB ALA A 203 3.720 -34.896 -8.419 1.00 20.41 C ATOM 0 H ALA A 203 4.288 -32.567 -8.114 1.00 13.37 H new ATOM 0 HA ALA A 203 2.471 -34.068 -6.950 1.00 17.43 H new ATOM 0 HB1 ALA A 203 3.485 -35.822 -8.254 1.00 20.41 H new ATOM 0 HB2 ALA A 203 3.201 -34.560 -9.166 1.00 20.41 H new ATOM 0 HB3 ALA A 203 4.665 -34.835 -8.629 1.00 20.41 H new ATOM 3574 N ASP A 204 5.105 -33.965 -5.391 1.00 14.15 N ATOM 3575 CA ASP A 204 5.837 -34.430 -4.219 1.00 15.30 C ATOM 3576 C ASP A 204 5.521 -33.638 -2.958 1.00 15.39 C ATOM 3577 O ASP A 204 5.997 -34.023 -1.879 1.00 15.73 O ATOM 3578 CB ASP A 204 7.343 -34.377 -4.543 1.00 16.84 C ATOM 3579 CG ASP A 204 8.236 -35.028 -3.496 1.00 26.19 C ATOM 3580 OD1 ASP A 204 8.181 -36.259 -3.339 1.00 30.98 O ATOM 3581 OD2 ASP A 204 9.070 -34.308 -2.863 1.00 29.26 O ATOM 0 H ASP A 204 5.368 -33.198 -5.679 1.00 14.15 H new ATOM 0 HA ASP A 204 5.559 -35.339 -4.026 1.00 15.30 H new ATOM 0 HB2 ASP A 204 7.494 -34.812 -5.397 1.00 16.84 H new ATOM 0 HB3 ASP A 204 7.608 -33.450 -4.646 1.00 16.84 H new ATOM 3586 N LEU A 205 4.690 -32.600 -3.052 1.00 13.96 N ATOM 3587 CA LEU A 205 4.380 -31.782 -1.896 1.00 16.92 C ATOM 3588 C LEU A 205 3.704 -32.599 -0.803 1.00 16.89 C ATOM 3589 O LEU A 205 3.816 -32.254 0.378 1.00 14.96 O ATOM 3590 CB LEU A 205 3.470 -30.620 -2.264 1.00 14.26 C ATOM 3591 CG LEU A 205 4.140 -29.500 -3.086 1.00 15.10 C ATOM 3592 CD1 LEU A 205 3.124 -28.491 -3.511 1.00 14.68 C ATOM 3593 CD2 LEU A 205 5.230 -28.825 -2.279 1.00 16.70 C ATOM 0 H LEU A 205 4.299 -32.358 -3.778 1.00 13.96 H new ATOM 0 HA LEU A 205 5.226 -31.438 -1.568 1.00 16.92 H new ATOM 0 HB2 LEU A 205 2.716 -30.965 -2.767 1.00 14.26 H new ATOM 0 HB3 LEU A 205 3.114 -30.235 -1.448 1.00 14.26 H new ATOM 0 HG LEU A 205 4.539 -29.899 -3.875 1.00 15.10 H new ATOM 0 HD11 LEU A 205 3.557 -27.793 -4.026 1.00 14.68 H new ATOM 0 HD12 LEU A 205 2.448 -28.922 -4.056 1.00 14.68 H new ATOM 0 HD13 LEU A 205 2.707 -28.102 -2.727 1.00 14.68 H new ATOM 0 HD21 LEU A 205 5.640 -28.125 -2.810 1.00 16.70 H new ATOM 0 HD22 LEU A 205 4.846 -28.439 -1.476 1.00 16.70 H new ATOM 0 HD23 LEU A 205 5.903 -29.479 -2.033 1.00 16.70 H new ATOM 3605 N HIS A 206 2.977 -33.658 -1.174 1.00 16.03 N ATOM 3606 CA HIS A 206 2.195 -34.398 -0.188 1.00 19.69 C ATOM 3607 C HIS A 206 3.086 -35.089 0.834 1.00 21.14 C ATOM 3608 O HIS A 206 2.592 -35.480 1.903 1.00 19.42 O ATOM 3609 CB HIS A 206 1.293 -35.428 -0.884 1.00 19.21 C ATOM 3610 CG HIS A 206 2.031 -36.607 -1.425 1.00 17.14 C ATOM 3611 ND1 HIS A 206 2.577 -36.629 -2.691 1.00 20.22 N ATOM 3612 CD2 HIS A 206 2.309 -37.810 -0.874 1.00 16.55 C ATOM 3613 CE1 HIS A 206 3.170 -37.790 -2.892 1.00 18.68 C ATOM 3614 NE2 HIS A 206 3.014 -38.527 -1.808 1.00 24.39 N ATOM 0 H HIS A 206 2.925 -33.958 -1.978 1.00 16.03 H new ATOM 0 HA HIS A 206 1.642 -33.758 0.286 1.00 19.69 H new ATOM 0 HB2 HIS A 206 0.624 -35.737 -0.254 1.00 19.21 H new ATOM 0 HB3 HIS A 206 0.819 -34.993 -1.610 1.00 19.21 H new ATOM 0 HD2 HIS A 206 2.068 -38.097 -0.023 1.00 16.55 H new ATOM 0 HE1 HIS A 206 3.620 -38.045 -3.664 1.00 18.68 H new ATOM 0 HE2 HIS A 206 3.307 -39.329 -1.704 1.00 24.39 H new ATOM 3622 N THR A 207 4.380 -35.241 0.525 1.00 15.24 N ATOM 3623 CA THR A 207 5.311 -35.918 1.412 1.00 16.35 C ATOM 3624 C THR A 207 5.849 -35.008 2.496 1.00 16.44 C ATOM 3625 O THR A 207 6.527 -35.512 3.399 1.00 19.32 O ATOM 3626 CB THR A 207 6.494 -36.496 0.630 1.00 17.22 C ATOM 3627 OG1 THR A 207 7.274 -35.415 0.109 1.00 17.30 O ATOM 3628 CG2 THR A 207 6.051 -37.403 -0.494 1.00 19.70 C ATOM 0 H THR A 207 4.734 -34.953 -0.204 1.00 15.24 H new ATOM 0 HA THR A 207 4.806 -36.632 1.832 1.00 16.35 H new ATOM 0 HB THR A 207 7.023 -37.037 1.237 1.00 17.22 H new ATOM 0 HG1 THR A 207 6.841 -35.023 -0.495 1.00 17.30 H new ATOM 0 HG21 THR A 207 6.830 -37.745 -0.960 1.00 19.70 H new ATOM 0 HG22 THR A 207 5.541 -38.144 -0.130 1.00 19.70 H new ATOM 0 HG23 THR A 207 5.497 -36.903 -1.114 1.00 19.70 H new ATOM 3636 N LEU A 208 5.575 -33.708 2.410 1.00 15.36 N ATOM 3637 CA LEU A 208 6.266 -32.698 3.184 1.00 17.38 C ATOM 3638 C LEU A 208 5.515 -32.257 4.435 1.00 20.80 C ATOM 3639 O LEU A 208 4.286 -32.216 4.472 1.00 17.89 O ATOM 3640 CB LEU A 208 6.519 -31.445 2.360 1.00 16.49 C ATOM 3641 CG LEU A 208 7.368 -31.685 1.099 1.00 14.63 C ATOM 3642 CD1 LEU A 208 7.568 -30.320 0.448 1.00 17.45 C ATOM 3643 CD2 LEU A 208 8.663 -32.384 1.395 1.00 17.83 C ATOM 0 H LEU A 208 4.970 -33.389 1.889 1.00 15.36 H new ATOM 0 HA LEU A 208 7.095 -33.127 3.448 1.00 17.38 H new ATOM 0 HB2 LEU A 208 5.666 -31.065 2.097 1.00 16.49 H new ATOM 0 HB3 LEU A 208 6.963 -30.787 2.917 1.00 16.49 H new ATOM 0 HG LEU A 208 6.912 -32.288 0.491 1.00 14.63 H new ATOM 0 HD11 LEU A 208 8.101 -30.420 -0.356 1.00 17.45 H new ATOM 0 HD12 LEU A 208 6.705 -29.941 0.219 1.00 17.45 H new ATOM 0 HD13 LEU A 208 8.025 -29.730 1.067 1.00 17.45 H new ATOM 0 HD21 LEU A 208 9.158 -32.511 0.571 1.00 17.83 H new ATOM 0 HD22 LEU A 208 9.188 -31.846 2.008 1.00 17.83 H new ATOM 0 HD23 LEU A 208 8.480 -33.247 1.798 1.00 17.83 H new ATOM 3655 N ASER A 209 6.288 -31.870 5.446 0.85 20.58 N ATOM 3656 N BSER A 209 6.288 -31.862 5.444 0.15 20.49 N ATOM 3657 CA ASER A 209 5.751 -31.203 6.614 0.85 18.45 C ATOM 3658 CA BSER A 209 5.729 -31.211 6.614 0.15 18.66 C ATOM 3659 C ASER A 209 5.280 -29.793 6.254 0.85 21.62 C ATOM 3660 C BSER A 209 5.274 -29.796 6.258 0.15 21.53 C ATOM 3661 O ASER A 209 5.588 -29.249 5.178 0.85 18.83 O ATOM 3662 O BSER A 209 5.565 -29.265 5.181 0.15 18.94 O ATOM 3663 CB ASER A 209 6.820 -31.112 7.707 0.85 22.46 C ATOM 3664 CB BSER A 209 6.757 -31.173 7.744 0.15 22.52 C ATOM 3665 OG ASER A 209 7.818 -30.186 7.296 0.85 20.02 O ATOM 3666 OG BSER A 209 7.171 -32.480 8.092 0.15 28.22 O ATOM 0 H ASER A 209 7.139 -31.990 5.469 0.85 20.49 H new ATOM 0 H BSER A 209 7.142 -31.964 5.466 0.15 20.49 H new ATOM 0 HA ASER A 209 4.997 -31.719 6.939 0.85 18.66 H new ATOM 0 HA BSER A 209 4.960 -31.719 6.917 0.15 18.66 H new ATOM 0 HB2ASER A 209 6.421 -30.827 8.544 0.85 22.52 H new ATOM 0 HB2BSER A 209 7.525 -30.648 7.470 0.15 22.52 H new ATOM 0 HB3ASER A 209 7.215 -31.984 7.864 0.85 22.52 H new ATOM 0 HB3BSER A 209 6.375 -30.733 8.520 0.15 22.52 H new ATOM 0 HG ASER A 209 8.525 -30.600 7.109 0.85 28.22 H new ATOM 0 HG BSER A 209 7.288 -32.525 8.923 0.15 28.22 H new ATOM 3677 N GLU A 210 4.537 -29.187 7.185 1.00 17.07 N ATOM 3678 CA GLU A 210 4.079 -27.818 6.988 1.00 20.79 C ATOM 3679 C GLU A 210 5.242 -26.873 6.693 1.00 25.95 C ATOM 3680 O GLU A 210 5.152 -26.041 5.785 1.00 20.49 O ATOM 3681 CB GLU A 210 3.311 -27.359 8.235 1.00 33.47 C ATOM 3682 CG GLU A 210 2.964 -25.877 8.290 1.00 49.79 C ATOM 3683 CD GLU A 210 2.005 -25.449 7.197 1.00 81.03 C ATOM 3684 OE1 GLU A 210 2.374 -25.557 6.007 1.00 77.75 O ATOM 3685 OE2 GLU A 210 0.882 -25.000 7.524 1.00 75.10 O ATOM 0 H AGLU A 210 4.293 -29.549 7.926 0.85 17.07 H new ATOM 0 H BGLU A 210 4.294 -29.547 7.928 0.15 17.07 H new ATOM 0 HA GLU A 210 3.491 -27.796 6.217 1.00 20.79 H new ATOM 0 HB2 GLU A 210 2.488 -27.869 8.294 1.00 33.47 H new ATOM 0 HB3 GLU A 210 3.838 -27.580 9.019 1.00 33.47 H new ATOM 0 HG2 GLU A 210 2.572 -25.674 9.154 1.00 49.79 H new ATOM 0 HG3 GLU A 210 3.780 -25.357 8.219 1.00 49.79 H new ATOM 3692 N ASP A 211 6.343 -26.987 7.440 1.00 20.76 N ATOM 3693 CA ASP A 211 7.445 -26.048 7.243 1.00 21.40 C ATOM 3694 C ASP A 211 8.176 -26.291 5.918 1.00 19.12 C ATOM 3695 O ASP A 211 8.535 -25.328 5.221 1.00 20.27 O ATOM 3696 CB ASP A 211 8.421 -26.137 8.412 1.00 27.88 C ATOM 3697 CG ASP A 211 7.887 -25.467 9.672 1.00 58.14 C ATOM 3698 OD1 ASP A 211 6.713 -25.033 9.669 1.00 43.30 O ATOM 3699 OD2 ASP A 211 8.641 -25.375 10.662 1.00 52.08 O ATOM 0 H ASP A 211 6.469 -27.582 8.048 1.00 20.76 H new ATOM 0 HA ASP A 211 7.068 -25.155 7.205 1.00 21.40 H new ATOM 0 HB2 ASP A 211 8.610 -27.069 8.601 1.00 27.88 H new ATOM 0 HB3 ASP A 211 9.261 -25.722 8.160 1.00 27.88 H new ATOM 3704 N SER A 212 8.429 -27.561 5.569 1.00 21.38 N ATOM 3705 CA SER A 212 9.064 -27.854 4.291 1.00 16.89 C ATOM 3706 C SER A 212 8.158 -27.457 3.131 1.00 18.57 C ATOM 3707 O SER A 212 8.628 -26.952 2.120 1.00 17.05 O ATOM 3708 CB SER A 212 9.429 -29.321 4.202 1.00 23.22 C ATOM 3709 OG SER A 212 10.392 -29.665 5.187 1.00 25.21 O ATOM 0 H SER A 212 8.243 -28.248 6.051 1.00 21.38 H new ATOM 0 HA SER A 212 9.878 -27.331 4.232 1.00 16.89 H new ATOM 0 HB2 SER A 212 8.633 -29.864 4.319 1.00 23.22 H new ATOM 0 HB3 SER A 212 9.779 -29.518 3.319 1.00 23.22 H new ATOM 0 HG SER A 212 10.014 -29.743 5.933 1.00 25.21 H new ATOM 3715 N TYR A 213 6.853 -27.676 3.263 1.00 15.07 N ATOM 3716 CA TYR A 213 5.892 -27.213 2.262 1.00 15.93 C ATOM 3717 C TYR A 213 6.025 -25.715 1.998 1.00 18.32 C ATOM 3718 O TYR A 213 6.025 -25.278 0.833 1.00 17.96 O ATOM 3719 CB TYR A 213 4.487 -27.595 2.747 1.00 16.36 C ATOM 3720 CG TYR A 213 3.339 -27.120 1.909 1.00 14.63 C ATOM 3721 CD1 TYR A 213 2.780 -27.944 0.955 1.00 17.45 C ATOM 3722 CD2 TYR A 213 2.789 -25.861 2.113 1.00 23.80 C ATOM 3723 CE1 TYR A 213 1.685 -27.504 0.191 1.00 20.43 C ATOM 3724 CE2 TYR A 213 1.734 -25.412 1.353 1.00 27.36 C ATOM 3725 CZ TYR A 213 1.195 -26.237 0.399 1.00 21.77 C ATOM 3726 OH TYR A 213 0.126 -25.794 -0.353 1.00 45.34 O ATOM 0 H TYR A 213 6.501 -28.093 3.928 1.00 15.07 H new ATOM 0 HA TYR A 213 6.069 -27.641 1.410 1.00 15.93 H new ATOM 0 HB2 TYR A 213 4.439 -28.562 2.808 1.00 16.36 H new ATOM 0 HB3 TYR A 213 4.371 -27.248 3.645 1.00 16.36 H new ATOM 0 HD1 TYR A 213 3.129 -28.795 0.816 1.00 17.45 H new ATOM 0 HD2 TYR A 213 3.141 -25.311 2.776 1.00 23.80 H new ATOM 0 HE1 TYR A 213 1.298 -28.061 -0.445 1.00 20.43 H new ATOM 0 HE2 TYR A 213 1.390 -24.558 1.485 1.00 27.36 H new ATOM 0 HH TYR A 213 -0.071 -25.010 -0.125 1.00 45.34 H new ATOM 3736 N LYS A 214 6.163 -24.913 3.060 1.00 15.93 N ATOM 3737 CA ALYS A 214 6.310 -23.476 2.879 0.58 17.12 C ATOM 3738 CA BLYS A 214 6.319 -23.474 2.892 0.42 17.22 C ATOM 3739 C LYS A 214 7.618 -23.133 2.170 1.00 17.00 C ATOM 3740 O LYS A 214 7.634 -22.261 1.295 1.00 19.11 O ATOM 3741 CB ALYS A 214 6.233 -22.772 4.233 0.58 22.62 C ATOM 3742 CB BLYS A 214 6.276 -22.792 4.261 0.42 22.54 C ATOM 3743 CG ALYS A 214 4.856 -22.846 4.887 0.58 25.72 C ATOM 3744 CG BLYS A 214 6.291 -21.278 4.201 0.42 20.94 C ATOM 3745 CD ALYS A 214 4.821 -22.021 6.173 0.58 34.03 C ATOM 3746 CD BLYS A 214 6.240 -20.651 5.588 0.42 40.38 C ATOM 3747 CE ALYS A 214 3.535 -22.259 6.946 0.58 46.12 C ATOM 3748 CE BLYS A 214 7.527 -20.829 6.335 0.42 41.97 C ATOM 3749 NZ ALYS A 214 2.330 -22.013 6.109 0.58 58.44 N ATOM 3750 NZ BLYS A 214 7.538 -20.166 7.662 0.42 63.74 N ATOM 0 H ALYS A 214 6.173 -25.181 3.877 0.58 15.93 H new ATOM 0 H BLYS A 214 6.168 -25.184 3.876 0.42 15.93 H new ATOM 0 HA ALYS A 214 5.583 -23.165 2.316 0.58 17.22 H new ATOM 0 HA BLYS A 214 5.587 -23.149 2.344 0.42 17.22 H new ATOM 0 HB2ALYS A 214 6.888 -23.166 4.831 0.58 22.54 H new ATOM 0 HB2BLYS A 214 5.477 -23.079 4.729 0.42 22.54 H new ATOM 0 HB3ALYS A 214 6.478 -21.840 4.118 0.58 22.54 H new ATOM 0 HB3BLYS A 214 7.035 -23.092 4.785 0.42 22.54 H new ATOM 0 HG2ALYS A 214 4.182 -22.520 4.270 0.58 20.94 H new ATOM 0 HG2BLYS A 214 7.092 -20.981 3.742 0.42 20.94 H new ATOM 0 HG3ALYS A 214 4.636 -23.770 5.084 0.58 20.94 H new ATOM 0 HG3BLYS A 214 5.534 -20.968 3.679 0.42 20.94 H new ATOM 0 HD2ALYS A 214 5.582 -22.251 6.728 0.58 40.38 H new ATOM 0 HD2BLYS A 214 6.043 -19.705 5.507 0.42 40.38 H new ATOM 0 HD3ALYS A 214 4.902 -21.079 5.958 0.58 40.38 H new ATOM 0 HD3BLYS A 214 5.515 -21.049 6.095 0.42 40.38 H new ATOM 0 HE2ALYS A 214 3.520 -23.172 7.274 0.58 41.97 H new ATOM 0 HE2BLYS A 214 7.695 -21.777 6.454 0.42 41.97 H new ATOM 0 HE3ALYS A 214 3.513 -21.678 7.723 0.58 41.97 H new ATOM 0 HE3BLYS A 214 8.255 -20.477 5.799 0.42 41.97 H new ATOM 0 HZ1ALYS A 214 1.613 -21.947 6.632 0.58 63.74 H new ATOM 0 HZ1BLYS A 214 8.323 -20.305 8.057 0.42 63.74 H new ATOM 0 HZ2ALYS A 214 2.435 -21.256 5.653 0.58 63.74 H new ATOM 0 HZ2BLYS A 214 7.409 -19.291 7.558 0.42 63.74 H new ATOM 0 HZ3ALYS A 214 2.220 -22.689 5.541 0.58 63.74 H new ATOM 0 HZ3BLYS A 214 6.888 -20.503 8.168 0.42 63.74 H new ATOM 3777 N ASP A 215 8.723 -23.804 2.535 1.00 17.41 N ATOM 3778 CA ASP A 215 9.996 -23.568 1.853 1.00 14.72 C ATOM 3779 C ASP A 215 9.891 -23.869 0.358 1.00 16.70 C ATOM 3780 O ASP A 215 10.331 -23.080 -0.486 1.00 17.87 O ATOM 3781 CB ASP A 215 11.108 -24.438 2.439 1.00 19.10 C ATOM 3782 CG ASP A 215 11.436 -24.120 3.892 1.00 20.90 C ATOM 3783 OD1 ASP A 215 11.277 -22.946 4.306 1.00 25.95 O ATOM 3784 OD2 ASP A 215 11.892 -25.059 4.577 1.00 28.36 O ATOM 0 H ASP A 215 8.752 -24.389 3.165 1.00 17.41 H new ATOM 0 HA ASP A 215 10.209 -22.631 1.983 1.00 14.72 H new ATOM 0 HB2 ASP A 215 10.848 -25.370 2.371 1.00 19.10 H new ATOM 0 HB3 ASP A 215 11.909 -24.328 1.904 1.00 19.10 H new ATOM 3789 N SER A 216 9.330 -25.025 0.017 1.00 14.49 N ATOM 3790 CA SER A 216 9.259 -25.463 -1.378 1.00 14.38 C ATOM 3791 C SER A 216 8.304 -24.590 -2.187 1.00 14.00 C ATOM 3792 O SER A 216 8.601 -24.213 -3.333 1.00 15.08 O ATOM 3793 CB SER A 216 8.805 -26.925 -1.436 1.00 17.11 C ATOM 3794 OG SER A 216 9.753 -27.796 -0.853 1.00 16.40 O ATOM 0 H SER A 216 8.982 -25.574 0.580 1.00 14.49 H new ATOM 0 HA SER A 216 10.143 -25.379 -1.768 1.00 14.38 H new ATOM 0 HB2 SER A 216 7.956 -27.018 -0.976 1.00 17.11 H new ATOM 0 HB3 SER A 216 8.657 -27.181 -2.360 1.00 17.11 H new ATOM 0 HG SER A 216 10.320 -28.020 -1.430 1.00 16.40 H new ATOM 3800 N THR A 217 7.131 -24.277 -1.633 1.00 13.81 N ATOM 3801 CA THR A 217 6.160 -23.521 -2.421 1.00 13.89 C ATOM 3802 C THR A 217 6.629 -22.086 -2.672 1.00 13.60 C ATOM 3803 O THR A 217 6.236 -21.477 -3.670 1.00 16.29 O ATOM 3804 CB THR A 217 4.773 -23.523 -1.759 1.00 19.13 C ATOM 3805 OG1 THR A 217 4.859 -22.993 -0.431 1.00 17.83 O ATOM 3806 CG2 THR A 217 4.184 -24.915 -1.742 1.00 18.20 C ATOM 0 H THR A 217 6.886 -24.483 -0.835 1.00 13.81 H new ATOM 0 HA THR A 217 6.087 -23.967 -3.279 1.00 13.89 H new ATOM 0 HB THR A 217 4.183 -22.957 -2.282 1.00 19.13 H new ATOM 0 HG1 THR A 217 5.207 -23.565 0.077 1.00 17.83 H new ATOM 0 HG21 THR A 217 3.311 -24.892 -1.321 1.00 18.20 H new ATOM 0 HG22 THR A 217 4.095 -25.240 -2.652 1.00 18.20 H new ATOM 0 HG23 THR A 217 4.768 -25.508 -1.243 1.00 18.20 H new ATOM 3814 N LEU A 218 7.484 -21.546 -1.809 1.00 14.06 N ATOM 3815 CA ALEU A 218 8.035 -20.212 -2.033 0.41 17.49 C ATOM 3816 CA BLEU A 218 8.014 -20.207 -2.044 0.59 17.51 C ATOM 3817 C LEU A 218 8.819 -20.171 -3.335 1.00 14.55 C ATOM 3818 O LEU A 218 8.661 -19.249 -4.142 1.00 19.19 O ATOM 3819 CB ALEU A 218 8.924 -19.811 -0.857 0.41 17.10 C ATOM 3820 CB BLEU A 218 8.869 -19.754 -0.863 0.59 16.76 C ATOM 3821 CG ALEU A 218 9.661 -18.476 -0.936 0.41 27.59 C ATOM 3822 CG BLEU A 218 9.344 -18.303 -0.897 0.59 31.78 C ATOM 3823 CD1ALEU A 218 8.677 -17.321 -0.857 0.41 37.28 C ATOM 3824 CD1BLEU A 218 9.356 -17.727 0.520 0.59 33.11 C ATOM 3825 CD2ALEU A 218 10.711 -18.372 0.174 0.41 20.90 C ATOM 3826 CD2BLEU A 218 10.714 -18.178 -1.543 0.59 38.73 C ATOM 0 H ALEU A 218 7.757 -21.932 -1.091 0.41 14.06 H new ATOM 0 H BLEU A 218 7.766 -21.930 -1.093 0.59 14.06 H new ATOM 0 HA ALEU A 218 7.304 -19.578 -2.101 0.41 17.51 H new ATOM 0 HA BLEU A 218 7.268 -19.593 -2.133 0.59 17.51 H new ATOM 0 HB2ALEU A 218 8.373 -19.799 -0.059 0.41 16.76 H new ATOM 0 HB2BLEU A 218 8.361 -19.890 -0.048 0.59 16.76 H new ATOM 0 HB3ALEU A 218 9.586 -20.509 -0.734 0.41 16.76 H new ATOM 0 HB3BLEU A 218 9.648 -20.329 -0.811 0.59 16.76 H new ATOM 0 HG ALEU A 218 10.119 -18.428 -1.790 0.41 31.78 H new ATOM 0 HG BLEU A 218 8.723 -17.793 -1.440 0.59 31.78 H new ATOM 0 HD11ALEU A 218 9.159 -16.481 -0.908 0.41 33.11 H new ATOM 0 HD11BLEU A 218 9.658 -16.806 0.492 0.59 33.11 H new ATOM 0 HD12ALEU A 218 8.050 -17.379 -1.595 0.41 33.11 H new ATOM 0 HD12BLEU A 218 8.461 -17.762 0.891 0.59 33.11 H new ATOM 0 HD13ALEU A 218 8.193 -17.365 -0.017 0.41 33.11 H new ATOM 0 HD13BLEU A 218 9.957 -18.247 1.076 0.59 33.11 H new ATOM 0 HD21ALEU A 218 11.168 -17.519 0.108 0.41 38.73 H new ATOM 0 HD21BLEU A 218 10.986 -17.247 -1.549 0.59 38.73 H new ATOM 0 HD22ALEU A 218 10.276 -18.439 1.038 0.41 38.73 H new ATOM 0 HD22BLEU A 218 11.358 -18.699 -1.039 0.59 38.73 H new ATOM 0 HD23ALEU A 218 11.355 -19.092 0.079 0.41 38.73 H new ATOM 0 HD23BLEU A 218 10.674 -18.508 -2.454 0.59 38.73 H new ATOM 3849 N ILE A 219 9.655 -21.187 -3.573 1.00 14.67 N ATOM 3850 CA AILE A 219 10.448 -21.235 -4.804 0.55 14.67 C ATOM 3851 CA BILE A 219 10.438 -21.198 -4.810 0.45 14.86 C ATOM 3852 C ILE A 219 9.570 -21.593 -5.992 1.00 13.82 C ATOM 3853 O ILE A 219 9.777 -21.104 -7.103 1.00 16.09 O ATOM 3854 CB AILE A 219 11.609 -22.235 -4.667 0.55 16.29 C ATOM 3855 CB BILE A 219 11.656 -22.123 -4.674 0.45 16.30 C ATOM 3856 CG1AILE A 219 12.363 -22.028 -3.354 0.55 23.04 C ATOM 3857 CG1BILE A 219 12.586 -21.601 -3.572 0.45 21.21 C ATOM 3858 CG2AILE A 219 12.562 -22.102 -5.854 0.55 19.75 C ATOM 3859 CG2BILE A 219 12.408 -22.214 -5.994 0.45 20.60 C ATOM 3860 CD1AILE A 219 12.927 -20.651 -3.203 0.55 18.32 C ATOM 3861 CD1BILE A 219 13.522 -22.645 -3.016 0.45 22.68 C ATOM 0 H AILE A 219 9.776 -21.851 -3.040 0.55 14.67 H new ATOM 0 H BILE A 219 9.780 -21.858 -3.050 0.45 14.67 H new ATOM 0 HA AILE A 219 10.824 -20.354 -4.957 0.55 14.86 H new ATOM 0 HA BILE A 219 10.767 -20.300 -4.973 0.45 14.86 H new ATOM 0 HB AILE A 219 11.237 -23.131 -4.660 0.55 16.30 H new ATOM 0 HB BILE A 219 11.347 -23.011 -4.435 0.45 16.30 H new ATOM 0 HG12AILE A 219 11.764 -22.208 -2.613 0.55 21.21 H new ATOM 0 HG12BILE A 219 13.110 -20.865 -3.925 0.45 21.21 H new ATOM 0 HG13AILE A 219 13.085 -22.674 -3.298 0.55 21.21 H new ATOM 0 HG13BILE A 219 12.047 -21.244 -2.849 0.45 21.21 H new ATOM 0 HG21AILE A 219 13.290 -22.736 -5.758 0.55 20.60 H new ATOM 0 HG21BILE A 219 13.173 -22.801 -5.891 0.45 20.60 H new ATOM 0 HG22AILE A 219 12.082 -22.284 -6.677 0.55 20.60 H new ATOM 0 HG22BILE A 219 11.819 -22.568 -6.678 0.45 20.60 H new ATOM 0 HG23AILE A 219 12.921 -21.201 -5.882 0.55 20.60 H new ATOM 0 HG23BILE A 219 12.712 -21.331 -6.255 0.45 20.60 H new ATOM 0 HD11AILE A 219 13.391 -20.583 -2.354 0.55 22.68 H new ATOM 0 HD11BILE A 219 14.078 -22.248 -2.327 0.45 22.68 H new ATOM 0 HD12AILE A 219 13.549 -20.475 -3.926 0.55 22.68 H new ATOM 0 HD12BILE A 219 13.006 -23.372 -2.635 0.45 22.68 H new ATOM 0 HD13AILE A 219 12.207 -20.001 -3.230 0.55 22.68 H new ATOM 0 HD13BILE A 219 14.085 -22.987 -3.728 0.45 22.68 H new ATOM 3884 N MET A 220 8.586 -22.478 -5.779 1.00 13.36 N ATOM 3885 CA MET A 220 7.663 -22.837 -6.850 1.00 14.44 C ATOM 3886 C MET A 220 6.909 -21.619 -7.366 1.00 13.88 C ATOM 3887 O MET A 220 6.644 -21.508 -8.567 1.00 15.95 O ATOM 3888 CB MET A 220 6.695 -23.914 -6.351 1.00 15.30 C ATOM 3889 CG MET A 220 7.365 -25.220 -6.107 1.00 13.72 C ATOM 3890 SD MET A 220 6.229 -26.410 -5.346 1.00 19.12 S ATOM 3891 CE MET A 220 5.035 -26.683 -6.636 1.00 21.46 C ATOM 0 H MET A 220 8.442 -22.874 -5.029 1.00 13.36 H new ATOM 0 HA MET A 220 8.174 -23.191 -7.595 1.00 14.44 H new ATOM 0 HB2 MET A 220 6.276 -23.612 -5.530 1.00 15.30 H new ATOM 0 HB3 MET A 220 5.987 -24.035 -7.003 1.00 15.30 H new ATOM 0 HG2 MET A 220 7.697 -25.577 -6.945 1.00 13.72 H new ATOM 0 HG3 MET A 220 8.134 -25.089 -5.530 1.00 13.72 H new ATOM 0 HE1 MET A 220 4.623 -27.553 -6.517 1.00 21.46 H new ATOM 0 HE2 MET A 220 4.353 -25.995 -6.597 1.00 21.46 H new ATOM 0 HE3 MET A 220 5.477 -26.650 -7.499 1.00 21.46 H new ATOM 3901 N GLN A 221 6.549 -20.694 -6.478 1.00 14.29 N ATOM 3902 CA GLN A 221 5.867 -19.486 -6.912 1.00 11.60 C ATOM 3903 C GLN A 221 6.739 -18.630 -7.836 1.00 13.58 C ATOM 3904 O GLN A 221 6.216 -17.964 -8.735 1.00 15.81 O ATOM 3905 CB GLN A 221 5.449 -18.665 -5.694 1.00 16.57 C ATOM 3906 CG GLN A 221 4.648 -17.426 -6.059 1.00 22.33 C ATOM 3907 CD GLN A 221 3.320 -17.777 -6.721 1.00 41.86 C ATOM 3908 OE1 GLN A 221 2.551 -18.577 -6.197 1.00 43.70 O ATOM 3909 NE2 GLN A 221 3.068 -17.199 -7.890 1.00 30.81 N ATOM 0 H GLN A 221 6.690 -20.748 -5.631 1.00 14.29 H new ATOM 0 HA GLN A 221 5.084 -19.758 -7.417 1.00 11.60 H new ATOM 0 HB2 GLN A 221 4.921 -19.222 -5.101 1.00 16.57 H new ATOM 0 HB3 GLN A 221 6.242 -18.398 -5.203 1.00 16.57 H new ATOM 0 HG2 GLN A 221 4.481 -16.903 -5.259 1.00 22.33 H new ATOM 0 HG3 GLN A 221 5.170 -16.870 -6.658 1.00 22.33 H new ATOM 0 HE21 GLN A 221 3.632 -16.643 -8.225 1.00 30.81 H new ATOM 0 HE22 GLN A 221 2.341 -17.381 -8.312 1.00 30.81 H new ATOM 3918 N LEU A 222 8.062 -18.645 -7.642 1.00 14.42 N ATOM 3919 CA LEU A 222 8.947 -17.906 -8.533 1.00 13.43 C ATOM 3920 C LEU A 222 8.992 -18.544 -9.918 1.00 10.98 C ATOM 3921 O LEU A 222 9.068 -17.824 -10.929 1.00 15.17 O ATOM 3922 CB LEU A 222 10.360 -17.823 -7.945 1.00 14.64 C ATOM 3923 CG LEU A 222 10.492 -17.220 -6.539 1.00 14.50 C ATOM 3924 CD1 LEU A 222 11.913 -17.362 -6.080 1.00 15.95 C ATOM 3925 CD2 LEU A 222 10.057 -15.791 -6.568 1.00 17.23 C ATOM 0 H LEU A 222 8.458 -19.072 -7.009 1.00 14.42 H new ATOM 0 HA LEU A 222 8.592 -17.008 -8.623 1.00 13.43 H new ATOM 0 HB2 LEU A 222 10.732 -18.719 -7.926 1.00 14.64 H new ATOM 0 HB3 LEU A 222 10.909 -17.301 -8.550 1.00 14.64 H new ATOM 0 HG LEU A 222 9.922 -17.689 -5.910 1.00 14.50 H new ATOM 0 HD11 LEU A 222 12.006 -16.983 -5.192 1.00 15.95 H new ATOM 0 HD12 LEU A 222 12.154 -18.301 -6.057 1.00 15.95 H new ATOM 0 HD13 LEU A 222 12.500 -16.893 -6.694 1.00 15.95 H new ATOM 0 HD21 LEU A 222 10.140 -15.409 -5.680 1.00 17.23 H new ATOM 0 HD22 LEU A 222 10.616 -15.295 -7.186 1.00 17.23 H new ATOM 0 HD23 LEU A 222 9.132 -15.740 -6.856 1.00 17.23 H new ATOM 3937 N LEU A 223 8.989 -19.891 -9.985 1.00 12.52 N ATOM 3938 CA LEU A 223 8.868 -20.573 -11.271 1.00 10.85 C ATOM 3939 C LEU A 223 7.570 -20.166 -11.959 1.00 14.56 C ATOM 3940 O LEU A 223 7.553 -19.842 -13.155 1.00 14.33 O ATOM 3941 CB LEU A 223 8.912 -22.082 -11.072 1.00 17.11 C ATOM 3942 CG LEU A 223 10.224 -22.682 -10.612 1.00 14.31 C ATOM 3943 CD1 LEU A 223 10.001 -24.097 -10.038 1.00 18.66 C ATOM 3944 CD2 LEU A 223 11.239 -22.778 -11.757 1.00 13.14 C ATOM 0 H LEU A 223 9.055 -20.412 -9.304 1.00 12.52 H new ATOM 0 HA LEU A 223 9.613 -20.314 -11.835 1.00 10.85 H new ATOM 0 HB2 LEU A 223 8.230 -22.320 -10.425 1.00 17.11 H new ATOM 0 HB3 LEU A 223 8.667 -22.503 -11.911 1.00 17.11 H new ATOM 0 HG LEU A 223 10.576 -22.093 -9.927 1.00 14.31 H new ATOM 0 HD11 LEU A 223 10.850 -24.466 -9.748 1.00 18.66 H new ATOM 0 HD12 LEU A 223 9.395 -24.048 -9.282 1.00 18.66 H new ATOM 0 HD13 LEU A 223 9.617 -24.667 -10.722 1.00 18.66 H new ATOM 0 HD21 LEU A 223 12.064 -23.166 -11.426 1.00 13.14 H new ATOM 0 HD22 LEU A 223 10.879 -23.338 -12.463 1.00 13.14 H new ATOM 0 HD23 LEU A 223 11.416 -21.891 -12.108 1.00 13.14 H new ATOM 3956 N ARG A 224 6.469 -20.152 -11.198 1.00 14.98 N ATOM 3957 CA ARG A 224 5.180 -19.749 -11.761 1.00 18.73 C ATOM 3958 C ARG A 224 5.212 -18.306 -12.228 1.00 17.86 C ATOM 3959 O ARG A 224 4.706 -17.997 -13.309 1.00 17.99 O ATOM 3960 CB ARG A 224 4.069 -19.965 -10.733 1.00 18.06 C ATOM 3961 CG ARG A 224 2.698 -19.441 -11.155 1.00 29.23 C ATOM 3962 CD ARG A 224 2.259 -20.055 -12.478 1.00 76.39 C ATOM 3963 NE ARG A 224 2.373 -21.515 -12.482 1.00 51.49 N ATOM 3964 CZ ARG A 224 2.255 -22.275 -13.570 1.00 59.85 C ATOM 3965 NH1 ARG A 224 2.009 -21.722 -14.756 1.00 63.85 N ATOM 3966 NH2 ARG A 224 2.380 -23.593 -13.471 1.00 50.53 N ATOM 0 H ARG A 224 6.449 -20.369 -10.366 1.00 14.98 H new ATOM 0 HA ARG A 224 4.998 -20.302 -12.537 1.00 18.73 H new ATOM 0 HB2 ARG A 224 3.996 -20.914 -10.549 1.00 18.06 H new ATOM 0 HB3 ARG A 224 4.325 -19.534 -9.903 1.00 18.06 H new ATOM 0 HG2 ARG A 224 2.045 -19.646 -10.468 1.00 29.23 H new ATOM 0 HG3 ARG A 224 2.729 -18.475 -11.238 1.00 29.23 H new ATOM 0 HD2 ARG A 224 1.339 -19.805 -12.658 1.00 76.39 H new ATOM 0 HD3 ARG A 224 2.799 -19.689 -13.196 1.00 76.39 H new ATOM 0 HE ARG A 224 2.526 -21.908 -11.732 1.00 51.49 H new ATOM 0 HH11 ARG A 224 1.925 -20.869 -14.824 1.00 63.85 H new ATOM 0 HH12 ARG A 224 1.934 -22.218 -15.454 1.00 63.85 H new ATOM 0 HH21 ARG A 224 2.537 -23.954 -12.706 1.00 50.53 H new ATOM 0 HH22 ARG A 224 2.304 -24.086 -14.172 1.00 50.53 H new ATOM 3980 N ASP A 225 5.826 -17.419 -11.441 1.00 14.99 N ATOM 3981 CA ASP A 225 5.906 -16.020 -11.817 1.00 15.17 C ATOM 3982 C ASP A 225 6.647 -15.871 -13.136 1.00 15.91 C ATOM 3983 O ASP A 225 6.246 -15.085 -14.005 1.00 17.62 O ATOM 3984 CB ASP A 225 6.620 -15.196 -10.752 1.00 18.15 C ATOM 3985 CG ASP A 225 5.808 -15.011 -9.480 1.00 27.72 C ATOM 3986 OD1 ASP A 225 4.575 -15.221 -9.509 1.00 28.49 O ATOM 3987 OD2 ASP A 225 6.432 -14.634 -8.460 1.00 29.95 O ATOM 0 H ASP A 225 6.199 -17.612 -10.690 1.00 14.99 H new ATOM 0 HA ASP A 225 4.998 -15.692 -11.908 1.00 15.17 H new ATOM 0 HB2 ASP A 225 7.461 -15.626 -10.530 1.00 18.15 H new ATOM 0 HB3 ASP A 225 6.836 -14.324 -11.119 1.00 18.15 H new ATOM 3992 N ASN A 226 7.738 -16.632 -13.310 1.00 14.62 N ATOM 3993 CA ASN A 226 8.500 -16.545 -14.546 1.00 12.17 C ATOM 3994 C ASN A 226 7.698 -17.076 -15.718 1.00 14.20 C ATOM 3995 O ASN A 226 7.709 -16.478 -16.796 1.00 17.09 O ATOM 3996 CB ASN A 226 9.814 -17.300 -14.398 1.00 13.13 C ATOM 3997 CG ASN A 226 10.832 -16.516 -13.567 1.00 17.88 C ATOM 3998 OD1 ASN A 226 10.610 -15.346 -13.242 1.00 18.00 O ATOM 3999 ND2 ASN A 226 11.949 -17.162 -13.239 1.00 15.00 N ATOM 0 H ASN A 226 8.042 -17.192 -12.732 1.00 14.62 H new ATOM 0 HA ASN A 226 8.696 -15.612 -14.725 1.00 12.17 H new ATOM 0 HB2 ASN A 226 9.648 -18.159 -13.979 1.00 13.13 H new ATOM 0 HB3 ASN A 226 10.184 -17.480 -15.276 1.00 13.13 H new ATOM 0 HD21 ASN A 226 12.557 -16.764 -12.779 1.00 15.00 H new ATOM 0 HD22 ASN A 226 12.062 -17.978 -13.487 1.00 15.00 H new ATOM 4006 N LEU A 227 7.039 -18.226 -15.545 1.00 15.11 N ATOM 4007 CA LEU A 227 6.206 -18.762 -16.619 1.00 14.29 C ATOM 4008 C LEU A 227 5.138 -17.764 -17.037 1.00 18.38 C ATOM 4009 O LEU A 227 4.849 -17.628 -18.228 1.00 20.42 O ATOM 4010 CB LEU A 227 5.596 -20.075 -16.171 1.00 12.81 C ATOM 4011 CG LEU A 227 6.585 -21.260 -16.184 1.00 13.48 C ATOM 4012 CD1 LEU A 227 5.985 -22.423 -15.428 1.00 19.55 C ATOM 4013 CD2 LEU A 227 7.000 -21.644 -17.570 1.00 14.46 C ATOM 0 H LEU A 227 7.061 -18.701 -14.828 1.00 15.11 H new ATOM 0 HA LEU A 227 6.758 -18.924 -17.400 1.00 14.29 H new ATOM 0 HB2 LEU A 227 5.244 -19.969 -15.273 1.00 12.81 H new ATOM 0 HB3 LEU A 227 4.845 -20.286 -16.747 1.00 12.81 H new ATOM 0 HG LEU A 227 7.400 -20.983 -15.737 1.00 13.48 H new ATOM 0 HD11 LEU A 227 6.605 -23.169 -15.435 1.00 19.55 H new ATOM 0 HD12 LEU A 227 5.810 -22.158 -14.512 1.00 19.55 H new ATOM 0 HD13 LEU A 227 5.154 -22.690 -15.851 1.00 19.55 H new ATOM 0 HD21 LEU A 227 7.619 -22.390 -17.528 1.00 14.46 H new ATOM 0 HD22 LEU A 227 6.218 -21.902 -18.082 1.00 14.46 H new ATOM 0 HD23 LEU A 227 7.433 -20.889 -17.999 1.00 14.46 H new ATOM 4025 N THR A 228 4.541 -17.058 -16.077 1.00 18.14 N ATOM 4026 CA THR A 228 3.527 -16.052 -16.403 1.00 22.40 C ATOM 4027 C THR A 228 4.121 -14.884 -17.181 1.00 24.31 C ATOM 4028 O THR A 228 3.466 -14.323 -18.066 1.00 25.66 O ATOM 4029 CB THR A 228 2.850 -15.565 -15.119 1.00 20.41 C ATOM 4030 OG1 THR A 228 2.247 -16.684 -14.477 1.00 26.26 O ATOM 4031 CG2 THR A 228 1.781 -14.522 -15.443 1.00 30.62 C ATOM 0 H THR A 228 4.706 -17.144 -15.237 1.00 18.14 H new ATOM 0 HA THR A 228 2.862 -16.466 -16.975 1.00 22.40 H new ATOM 0 HB THR A 228 3.510 -15.156 -14.537 1.00 20.41 H new ATOM 0 HG1 THR A 228 2.841 -17.146 -14.103 1.00 26.26 H new ATOM 0 HG21 THR A 228 1.361 -14.223 -14.621 1.00 30.62 H new ATOM 0 HG22 THR A 228 2.192 -13.765 -15.890 1.00 30.62 H new ATOM 0 HG23 THR A 228 1.111 -14.915 -16.024 1.00 30.62 H new ATOM 4039 N LEU A 229 5.364 -14.522 -16.892 1.00 20.01 N ATOM 4040 CA LEU A 229 6.033 -13.471 -17.640 1.00 21.30 C ATOM 4041 C LEU A 229 6.400 -13.940 -19.042 1.00 23.33 C ATOM 4042 O LEU A 229 6.310 -13.165 -20.004 1.00 25.36 O ATOM 4043 CB LEU A 229 7.282 -13.038 -16.892 1.00 20.84 C ATOM 4044 CG LEU A 229 8.084 -11.878 -17.450 1.00 37.16 C ATOM 4045 CD1 LEU A 229 7.276 -10.599 -17.333 1.00 33.05 C ATOM 4046 CD2 LEU A 229 9.406 -11.758 -16.701 1.00 41.49 C ATOM 0 H LEU A 229 5.837 -14.874 -16.266 1.00 20.01 H new ATOM 0 HA LEU A 229 5.426 -12.720 -17.727 1.00 21.30 H new ATOM 0 HB2 LEU A 229 7.021 -12.809 -15.986 1.00 20.84 H new ATOM 0 HB3 LEU A 229 7.873 -13.805 -16.832 1.00 20.84 H new ATOM 0 HG LEU A 229 8.278 -12.035 -18.387 1.00 37.16 H new ATOM 0 HD11 LEU A 229 7.790 -9.858 -17.690 1.00 33.05 H new ATOM 0 HD12 LEU A 229 6.450 -10.691 -17.834 1.00 33.05 H new ATOM 0 HD13 LEU A 229 7.071 -10.430 -16.400 1.00 33.05 H new ATOM 0 HD21 LEU A 229 9.916 -11.015 -17.061 1.00 41.49 H new ATOM 0 HD22 LEU A 229 9.232 -11.604 -15.759 1.00 41.49 H new ATOM 0 HD23 LEU A 229 9.913 -12.578 -16.806 1.00 41.49 H new ATOM 4058 N TRP A 230 6.798 -15.207 -19.179 1.00 19.59 N ATOM 4059 CA TRP A 230 7.368 -15.710 -20.431 1.00 16.63 C ATOM 4060 C TRP A 230 6.345 -16.289 -21.388 1.00 22.10 C ATOM 4061 O TRP A 230 6.706 -16.575 -22.532 1.00 25.39 O ATOM 4062 CB TRP A 230 8.400 -16.790 -20.133 1.00 20.94 C ATOM 4063 CG TRP A 230 9.607 -16.300 -19.371 1.00 15.94 C ATOM 4064 CD1 TRP A 230 10.080 -15.032 -19.294 1.00 18.70 C ATOM 4065 CD2 TRP A 230 10.514 -17.121 -18.625 1.00 16.79 C ATOM 4066 NE1 TRP A 230 11.234 -15.009 -18.527 1.00 17.05 N ATOM 4067 CE2 TRP A 230 11.507 -16.280 -18.101 1.00 16.68 C ATOM 4068 CE3 TRP A 230 10.554 -18.485 -18.324 1.00 17.24 C ATOM 4069 CZ2 TRP A 230 12.557 -16.757 -17.327 1.00 16.67 C ATOM 4070 CZ3 TRP A 230 11.608 -18.972 -17.562 1.00 16.89 C ATOM 4071 CH2 TRP A 230 12.587 -18.110 -17.061 1.00 15.12 C ATOM 0 H TRP A 230 6.746 -15.795 -18.553 1.00 19.59 H new ATOM 0 HA TRP A 230 7.767 -14.939 -20.863 1.00 16.63 H new ATOM 0 HB2 TRP A 230 7.975 -17.498 -19.624 1.00 20.94 H new ATOM 0 HB3 TRP A 230 8.695 -17.181 -20.970 1.00 20.94 H new ATOM 0 HD1 TRP A 230 9.689 -14.290 -19.695 1.00 18.70 H new ATOM 0 HE1 TRP A 230 11.702 -14.310 -18.348 1.00 17.05 H new ATOM 0 HE3 TRP A 230 9.887 -19.057 -18.629 1.00 17.24 H new ATOM 0 HZ2 TRP A 230 13.215 -16.186 -17.001 1.00 16.67 H new ATOM 0 HZ3 TRP A 230 11.663 -19.883 -17.383 1.00 16.89 H new ATOM 0 HH2 TRP A 230 13.273 -18.456 -16.537 1.00 15.12 H new ATOM 4082 N THR A 231 5.122 -16.539 -20.933 1.00 27.67 N ATOM 4083 CA THR A 231 4.095 -17.144 -21.767 1.00 29.45 C ATOM 4084 C THR A 231 2.826 -16.283 -21.788 1.00 55.09 C ATOM 4085 O THR A 231 1.783 -16.703 -22.292 1.00 56.90 O ATOM 4086 CB THR A 231 3.731 -18.554 -21.275 1.00 31.88 C ATOM 4087 OG1 THR A 231 3.116 -18.470 -19.983 1.00 32.92 O ATOM 4088 CG2 THR A 231 4.971 -19.433 -21.203 1.00 29.99 C ATOM 4089 OXT THR A 231 2.810 -15.152 -21.294 1.00 64.26 O ATOM 0 H THR A 231 4.866 -16.362 -20.131 1.00 27.67 H new ATOM 0 HA THR A 231 4.460 -17.205 -22.664 1.00 29.45 H new ATOM 0 HB THR A 231 3.109 -18.952 -21.903 1.00 31.88 H new ATOM 0 HG1 THR A 231 3.711 -18.415 -19.392 1.00 32.92 H new ATOM 0 HG21 THR A 231 4.723 -20.317 -20.891 1.00 29.99 H new ATOM 0 HG22 THR A 231 5.371 -19.501 -22.084 1.00 29.99 H new ATOM 0 HG23 THR A 231 5.610 -19.041 -20.588 1.00 29.99 H new TER 4097 THR A 231 ATOM 4098 N ALA P 125 12.859 -11.397 -14.998 1.00 45.83 N ATOM 4099 CA ALA P 125 12.621 -12.706 -14.395 1.00 23.83 C ATOM 4100 C ALA P 125 13.222 -12.815 -13.005 1.00 18.92 C ATOM 4101 O ALA P 125 14.240 -12.206 -12.701 1.00 24.04 O ATOM 4102 CB ALA P 125 13.195 -13.829 -15.280 1.00 21.18 C ATOM 0 HA ALA P 125 11.659 -12.805 -14.321 1.00 23.83 H new ATOM 0 HB1 ALA P 125 13.027 -14.688 -14.862 1.00 21.18 H new ATOM 0 HB2 ALA P 125 12.769 -13.804 -16.151 1.00 21.18 H new ATOM 0 HB3 ALA P 125 14.151 -13.702 -15.384 1.00 21.18 H new ATOM 4107 N AHIS P 126 12.580 -13.620 -12.169 0.55 14.45 N ATOM 4108 N BHIS P 126 12.572 -13.606 -12.161 0.45 14.45 N ATOM 4109 CA AHIS P 126 13.036 -13.866 -10.822 0.55 13.98 C ATOM 4110 CA BHIS P 126 13.042 -13.853 -10.815 0.45 14.13 C ATOM 4111 C AHIS P 126 14.057 -14.974 -10.754 0.55 14.76 C ATOM 4112 C BHIS P 126 14.068 -14.960 -10.775 0.45 14.75 C ATOM 4113 O AHIS P 126 13.843 -16.053 -11.302 0.55 16.44 O ATOM 4114 O BHIS P 126 13.876 -16.014 -11.375 0.45 16.69 O ATOM 4115 CB AHIS P 126 11.851 -14.243 -9.913 0.55 19.89 C ATOM 4116 CB BHIS P 126 11.872 -14.228 -9.890 0.45 19.87 C ATOM 4117 CG AHIS P 126 10.691 -13.302 -9.998 0.55 33.01 C ATOM 4118 CG BHIS P 126 10.846 -13.149 -9.737 0.45 36.13 C ATOM 4119 ND1AHIS P 126 10.426 -12.359 -9.027 0.55 36.36 N ATOM 4120 ND1BHIS P 126 9.599 -13.382 -9.195 0.45 43.35 N ATOM 4121 CD2AHIS P 126 9.719 -13.166 -10.933 0.55 30.24 C ATOM 4122 CD2BHIS P 126 10.881 -11.831 -10.050 0.45 36.31 C ATOM 4123 CE1AHIS P 126 9.344 -11.678 -9.367 0.55 45.29 C ATOM 4124 CE1BHIS P 126 8.908 -12.256 -9.185 0.45 35.79 C ATOM 4125 NE2AHIS P 126 8.897 -12.148 -10.519 0.55 35.99 N ATOM 4126 NE2BHIS P 126 9.662 -11.300 -9.701 0.45 41.68 N ATOM 0 H AHIS P 126 11.859 -14.041 -12.376 0.55 14.45 H new ATOM 0 H BHIS P 126 11.842 -14.015 -12.358 0.45 14.45 H new ATOM 0 HA AHIS P 126 13.451 -13.043 -10.519 0.55 14.13 H new ATOM 0 HA BHIS P 126 13.456 -13.031 -10.507 0.45 14.13 H new ATOM 0 HB2AHIS P 126 11.549 -15.135 -10.145 0.55 19.87 H new ATOM 0 HB2BHIS P 126 11.441 -15.025 -10.236 0.45 19.87 H new ATOM 0 HB3AHIS P 126 12.159 -14.278 -8.994 0.55 19.87 H new ATOM 0 HB3BHIS P 126 12.224 -14.454 -9.015 0.45 19.87 H new ATOM 0 HD2AHIS P 126 9.626 -13.669 -11.710 0.55 36.31 H new ATOM 0 HD2BHIS P 126 11.595 -11.372 -10.430 0.45 36.31 H new ATOM 0 HE1AHIS P 126 8.962 -10.985 -8.878 0.55 35.79 H new ATOM 0 HE1BHIS P 126 8.039 -12.153 -8.869 0.45 35.79 H new ATOM 0 HE2AHIS P 126 8.204 -11.862 -10.940 0.55 41.68 H new ATOM 0 HE2BHIS P 126 9.428 -10.479 -9.802 0.45 41.68 H new HETATM 4141 N SEP P 127 15.163 -14.734 -10.056 1.00 13.77 N HETATM 4142 CA SEP P 127 16.095 -15.858 -9.762 1.00 13.53 C HETATM 4143 CB SEP P 127 17.551 -15.475 -10.129 1.00 12.13 C HETATM 4144 OG SEP P 127 17.900 -14.287 -9.472 1.00 11.77 O HETATM 4145 C SEP P 127 15.927 -16.248 -8.285 1.00 13.78 C HETATM 4146 O SEP P 127 15.145 -15.638 -7.555 1.00 15.67 O HETATM 4147 P SEP P 127 19.367 -13.767 -9.858 1.00 12.50 P HETATM 4148 O1P SEP P 127 19.426 -13.406 -11.351 1.00 13.29 O HETATM 4149 O2P SEP P 127 19.491 -12.500 -8.931 1.00 12.72 O HETATM 4150 O3P SEP P 127 20.450 -14.859 -9.497 1.00 13.84 O HETATM 0 HB3 SEP P 127 18.158 -16.188 -9.874 1.00 12.13 H new HETATM 0 HB2 SEP P 127 17.634 -15.362 -11.089 1.00 12.13 H new HETATM 0 HA SEP P 127 15.883 -16.632 -10.307 1.00 13.53 H new ATOM 4154 N SER P 128 16.668 -17.257 -7.858 1.00 12.22 N ATOM 4155 CA ASER P 128 16.466 -17.873 -6.567 0.32 13.20 C ATOM 4156 CA BSER P 128 16.500 -17.888 -6.564 0.68 13.03 C ATOM 4157 C SER P 128 16.901 -16.935 -5.458 1.00 16.14 C ATOM 4158 O SER P 128 17.802 -16.129 -5.646 1.00 13.94 O ATOM 4159 CB ASER P 128 17.241 -19.186 -6.477 0.32 14.03 C ATOM 4160 CB BSER P 128 17.338 -19.164 -6.521 0.68 14.02 C ATOM 4161 OG ASER P 128 18.634 -18.948 -6.444 0.32 24.03 O ATOM 4162 OG BSER P 128 17.258 -19.830 -5.292 0.68 14.16 O ATOM 0 H ASER P 128 17.308 -17.605 -8.316 0.32 12.22 H new ATOM 0 H BSER P 128 17.300 -17.603 -8.327 0.68 12.22 H new ATOM 0 HA ASER P 128 15.520 -18.061 -6.462 0.32 13.03 H new ATOM 0 HA BSER P 128 15.567 -18.118 -6.429 0.68 13.03 H new ATOM 0 HB2ASER P 128 16.973 -19.670 -5.680 0.32 14.02 H new ATOM 0 HB2BSER P 128 17.045 -19.761 -7.227 0.68 14.02 H new ATOM 0 HB3ASER P 128 17.023 -19.748 -7.237 0.32 14.02 H new ATOM 0 HB3BSER P 128 18.265 -18.943 -6.704 0.68 14.02 H new ATOM 0 HG ASER P 128 18.864 -18.738 -5.664 0.32 14.16 H new ATOM 0 HG BSER P 128 17.698 -19.407 -4.715 0.68 14.16 H new ATOM 4173 N PRO P 129 16.247 -17.033 -4.306 1.00 14.46 N ATOM 4174 CA PRO P 129 16.817 -16.406 -3.107 1.00 17.00 C ATOM 4175 C PRO P 129 18.199 -16.994 -2.849 1.00 13.55 C ATOM 4176 O PRO P 129 18.529 -18.098 -3.291 1.00 16.81 O ATOM 4177 CB PRO P 129 15.845 -16.783 -1.974 1.00 23.26 C ATOM 4178 CG PRO P 129 14.623 -17.342 -2.642 1.00 29.16 C ATOM 4179 CD PRO P 129 15.072 -17.871 -3.995 1.00 15.47 C ATOM 0 HA PRO P 129 16.919 -15.445 -3.187 1.00 17.00 H new ATOM 0 HB2 PRO P 129 16.244 -17.436 -1.378 1.00 23.26 H new ATOM 0 HB3 PRO P 129 15.622 -16.007 -1.436 1.00 23.26 H new ATOM 0 HG2 PRO P 129 14.231 -18.050 -2.107 1.00 29.16 H new ATOM 0 HG3 PRO P 129 13.944 -16.657 -2.747 1.00 29.16 H new ATOM 0 HD2 PRO P 129 15.303 -18.812 -3.954 1.00 15.47 H new ATOM 0 HD3 PRO P 129 14.377 -17.778 -4.665 1.00 15.47 H new ATOM 4187 N ALA P 130 19.010 -16.240 -2.110 1.00 19.71 N ATOM 4188 CA ALA P 130 20.348 -16.707 -1.771 1.00 20.51 C ATOM 4189 C ALA P 130 20.306 -17.841 -0.764 1.00 17.17 C ATOM 4190 O ALA P 130 21.110 -18.783 -0.830 1.00 19.84 O ATOM 4191 CB ALA P 130 21.164 -15.550 -1.202 1.00 17.69 C ATOM 0 H ALA P 130 18.806 -15.464 -1.799 1.00 19.71 H new ATOM 0 HA ALA P 130 20.763 -17.041 -2.582 1.00 20.51 H new ATOM 0 HB1 ALA P 130 22.054 -15.862 -0.977 1.00 17.69 H new ATOM 0 HB2 ALA P 130 21.227 -14.843 -1.863 1.00 17.69 H new ATOM 0 HB3 ALA P 130 20.730 -15.209 -0.404 1.00 17.69 H new ATOM 4197 N SER P 131 19.385 -17.769 0.189 1.00 16.46 N ATOM 4198 CA SER P 131 19.324 -18.748 1.274 1.00 15.99 C ATOM 4199 C SER P 131 18.339 -19.842 0.879 1.00 20.47 C ATOM 4200 O SER P 131 17.171 -19.555 0.608 1.00 21.89 O ATOM 4201 CB SER P 131 18.897 -18.062 2.565 1.00 18.91 C ATOM 4202 OG SER P 131 18.958 -18.969 3.652 1.00 24.58 O ATOM 0 H SER P 131 18.781 -17.158 0.228 1.00 16.46 H new ATOM 0 HA SER P 131 20.196 -19.144 1.425 1.00 15.99 H new ATOM 0 HB2 SER P 131 19.473 -17.301 2.739 1.00 18.91 H new ATOM 0 HB3 SER P 131 17.994 -17.720 2.473 1.00 18.91 H new ATOM 0 HG SER P 131 18.722 -18.578 4.357 1.00 24.58 H new ATOM 4208 N LEU P 132 18.807 -21.089 0.878 1.00 17.55 N ATOM 4209 CA LEU P 132 18.019 -22.247 0.457 1.00 14.84 C ATOM 4210 C LEU P 132 18.175 -23.349 1.495 1.00 26.76 C ATOM 4211 O LEU P 132 19.297 -23.744 1.837 1.00 30.87 O ATOM 4212 CB LEU P 132 18.476 -22.734 -0.906 1.00 17.47 C ATOM 4213 CG LEU P 132 18.281 -21.738 -2.036 1.00 17.34 C ATOM 4214 CD1 LEU P 132 19.075 -22.153 -3.269 1.00 21.70 C ATOM 4215 CD2 LEU P 132 16.794 -21.600 -2.354 1.00 22.30 C ATOM 0 H LEU P 132 19.606 -21.289 1.126 1.00 17.55 H new ATOM 0 HA LEU P 132 17.085 -21.996 0.386 1.00 14.84 H new ATOM 0 HB2 LEU P 132 19.417 -22.965 -0.854 1.00 17.47 H new ATOM 0 HB3 LEU P 132 17.995 -23.548 -1.123 1.00 17.47 H new ATOM 0 HG LEU P 132 18.616 -20.873 -1.754 1.00 17.34 H new ATOM 0 HD11 LEU P 132 18.936 -21.504 -3.977 1.00 21.70 H new ATOM 0 HD12 LEU P 132 20.019 -22.193 -3.048 1.00 21.70 H new ATOM 0 HD13 LEU P 132 18.776 -23.026 -3.568 1.00 21.70 H new ATOM 0 HD21 LEU P 132 16.675 -20.963 -3.076 1.00 22.30 H new ATOM 0 HD22 LEU P 132 16.439 -22.462 -2.622 1.00 22.30 H new ATOM 0 HD23 LEU P 132 16.322 -21.287 -1.566 1.00 22.30 H new ATOM 4227 N GLN P 133 17.061 -23.826 2.009 1.00 29.29 N ATOM 4228 CA GLN P 133 17.111 -24.844 3.065 1.00 40.36 C ATOM 4229 C GLN P 133 17.518 -26.225 2.524 1.00 64.78 C ATOM 4230 O GLN P 133 17.062 -26.712 1.492 1.00 34.27 O ATOM 4231 CB GLN P 133 15.755 -24.915 3.778 1.00 37.93 C ATOM 4232 CG GLN P 133 15.304 -23.608 4.396 1.00 51.82 C ATOM 4233 CD GLN P 133 14.804 -22.596 3.367 1.00 80.31 C ATOM 4234 OE1 GLN P 133 14.584 -22.933 2.188 1.00 39.83 O ATOM 4235 NE2 GLN P 133 14.618 -21.347 3.809 1.00 64.94 N ATOM 4236 OXT GLN P 133 18.354 -26.911 3.121 1.00 60.47 O ATOM 0 H GLN P 133 16.270 -23.585 1.772 1.00 29.29 H new ATOM 0 HA GLN P 133 17.796 -24.582 3.700 1.00 40.36 H new ATOM 0 HB2 GLN P 133 15.083 -25.209 3.143 1.00 37.93 H new ATOM 0 HB3 GLN P 133 15.802 -25.590 4.473 1.00 37.93 H new ATOM 0 HG2 GLN P 133 14.597 -23.787 5.035 1.00 51.82 H new ATOM 0 HG3 GLN P 133 16.042 -23.219 4.891 1.00 51.82 H new ATOM 0 HE21 GLN P 133 14.781 -21.153 4.631 1.00 64.94 H new ATOM 0 HE22 GLN P 133 14.335 -20.738 3.271 1.00 64.94 H new TER 4244 GLN P 133 HETATM 4245 CL CL A 301 35.305 -6.311 13.505 0.86 16.10 CL1- HETATM 4246 MG MG A 302 18.888 -37.633 -0.897 1.00 21.13 MG2+ HETATM 4247 NA NA A 303 32.095 14.986 -20.625 0.97 31.47 NA1+ HETATM 4248 NA NA A 304 36.630 -17.374 20.728 0.75 36.77 NA1+ HETATM 4249 O HOH A 401 12.556 -19.895 -14.150 1.00 23.42 O HETATM 4250 O HOH A 402 13.110 -12.482 -18.270 1.00 30.28 O HETATM 4251 O HOH A 403 16.136 -9.751 -20.366 1.00 38.44 O HETATM 4252 O HOH A 404 10.236 -26.552 11.374 1.00 38.93 O HETATM 4253 O HOH A 405 35.060 -4.248 -19.481 1.00 17.45 O HETATM 4254 O HOH A 406 36.066 -26.925 2.043 1.00 23.89 O HETATM 4255 O HOH A 407 33.770 -33.381 2.341 1.00 5.15 O HETATM 4256 O HOH A 408 3.102 -22.554 -21.928 1.00 41.24 O HETATM 4257 O HOH A 409 38.487 -9.775 -12.139 1.00 44.25 O HETATM 4258 O HOH A 410 35.712 -4.720 -17.306 1.00 36.24 O HETATM 4259 O HOH A 411 34.159 -0.781 -22.654 1.00 38.87 O HETATM 4260 O HOH A 412 42.858 -10.460 10.714 1.00 29.88 O HETATM 4261 O HOH A 413 5.146 -31.105 -16.718 1.00 32.85 O HETATM 4262 O HOH A 414 27.098 -38.095 1.330 1.00 28.36 O HETATM 4263 O HOH A 415 41.059 -21.089 15.637 0.50 5.57 O HETATM 4264 O HOH A 416 19.670 -8.177 -10.428 1.00 44.37 O HETATM 4265 O HOH A 417 41.793 -14.927 5.221 1.00 24.38 O HETATM 4266 O HOH A 418 38.007 2.875 -18.445 1.00 40.55 O HETATM 4267 O HOH A 419 1.535 -14.025 -19.523 1.00 25.71 O HETATM 4268 O HOH A 420 12.299 -31.710 -11.362 1.00 20.60 O HETATM 4269 O HOH A 421 19.892 -10.924 -17.455 1.00 44.52 O HETATM 4270 O HOH A 422 23.478 -12.155 15.307 1.00 29.88 O HETATM 4271 O HOH A 423 37.061 -18.858 -15.512 1.00 48.03 O HETATM 4272 O HOH A 424 18.371 5.192 -18.890 1.00 38.24 O HETATM 4273 O HOH A 425 38.740 7.185 -21.502 1.00 27.30 O HETATM 4274 O HOH A 426 26.615 -15.699 19.071 1.00 47.68 O HETATM 4275 O HOH A 427 18.177 11.121 -39.773 1.00 44.26 O HETATM 4276 O HOH A 428 22.829 -7.198 -15.095 1.00 27.86 O HETATM 4277 O HOH A 429 10.091 -37.930 -3.193 1.00 46.75 O HETATM 4278 O HOH A 430 19.692 -15.033 5.566 1.00 31.36 O HETATM 4279 O HOH A 431 29.916 4.062 -24.894 1.00 31.17 O HETATM 4280 O HOH A 432 34.114 -5.039 -21.087 1.00 42.20 O HETATM 4281 O HOH A 433 41.890 -26.410 -7.210 1.00 47.14 O HETATM 4282 O HOH A 434 17.517 -19.693 -29.962 1.00 37.80 O HETATM 4283 O HOH A 435 43.082 -24.123 -6.353 1.00 38.27 O HETATM 4284 O HOH A 436 27.306 -34.379 -14.886 1.00 39.12 O HETATM 4285 O HOH A 437 33.571 1.516 -5.821 1.00 40.25 O HETATM 4286 O HOH A 438 28.852 -21.856 12.686 1.00 22.17 O HETATM 4287 O HOH A 439 24.522 -18.675 -5.909 1.00 33.02 O HETATM 4288 O HOH A 440 40.420 -16.847 -1.428 1.00 38.08 O HETATM 4289 O HOH A 441 33.510 -8.769 -22.676 1.00 47.70 O HETATM 4290 O HOH A 442 38.782 -20.146 19.928 1.00 29.58 O HETATM 4291 O HOH A 443 7.012 -33.364 10.516 1.00 28.44 O HETATM 4292 O HOH A 444 32.987 -27.069 9.444 1.00 27.87 O HETATM 4293 O HOH A 445 18.271 -11.263 -14.459 1.00 49.99 O HETATM 4294 O HOH A 446 -0.638 -17.234 -21.517 1.00 47.76 O HETATM 4295 O HOH A 447 17.294 -30.452 -21.803 1.00 16.51 O HETATM 4296 O HOH A 448 25.780 -32.636 4.703 1.00 21.07 O HETATM 4297 O HOH A 449 6.017 -17.759 -24.752 1.00 37.13 O HETATM 4298 O HOH A 450 42.276 -20.422 17.708 1.00 18.35 O HETATM 4299 O HOH A 451 35.976 -34.071 1.969 1.00 27.69 O HETATM 4300 O HOH A 452 17.922 -23.349 -27.526 1.00 25.91 O HETATM 4301 O HOH A 453 26.084 -9.074 -13.951 1.00 13.46 O HETATM 4302 O HOH A 454 23.046 -2.297 2.474 1.00 29.07 O HETATM 4303 O HOH A 455 9.787 -11.928 -21.468 1.00 47.81 O HETATM 4304 O HOH A 456 18.491 -35.193 -0.446 1.00 32.94 O HETATM 4305 O HOH A 457 23.445 -26.312 1.251 1.00 27.30 O HETATM 4306 O HOH A 458 30.039 -4.818 -21.022 1.00 18.14 O HETATM 4307 O HOH A 459 37.622 -31.521 3.643 1.00 49.01 O HETATM 4308 O HOH A 460 31.688 -27.056 2.460 1.00 16.77 O HETATM 4309 O HOH A 461 26.095 -21.012 12.140 1.00 42.65 O HETATM 4310 O HOH A 462 24.863 -11.799 -21.903 1.00 40.01 O HETATM 4311 O HOH A 463 31.927 -26.968 -13.369 1.00 30.80 O HETATM 4312 O HOH A 464 32.050 -26.941 -15.278 1.00 43.19 O HETATM 4313 O HOH A 465 22.295 -19.401 -3.284 1.00 25.33 O HETATM 4314 O HOH A 466 20.345 -29.099 -20.208 1.00 41.83 O HETATM 4315 O HOH A 467 21.204 -5.512 -0.884 1.00 31.75 O HETATM 4316 O HOH A 468 37.778 -7.372 -15.057 1.00 41.63 O HETATM 4317 O HOH A 469 42.624 -22.545 3.841 1.00 15.63 O HETATM 4318 O HOH A 470 23.172 -0.202 -6.967 1.00 30.81 O HETATM 4319 O HOH A 471 20.921 -15.535 8.688 1.00 38.65 O HETATM 4320 O HOH A 472 30.521 -36.665 2.076 1.00 32.13 O HETATM 4321 O HOH A 473 29.569 -29.366 5.751 1.00 24.13 O HETATM 4322 O HOH A 474 15.085 -15.272 -24.643 1.00 26.93 O HETATM 4323 O HOH A 475 23.873 -13.603 -23.808 1.00 27.69 O HETATM 4324 O HOH A 476 6.691 -14.906 -5.790 1.00 36.77 O HETATM 4325 O HOH A 477 35.665 -5.946 -7.005 1.00 21.41 O HETATM 4326 O HOH A 478 36.946 3.049 -16.218 1.00 22.83 O HETATM 4327 O HOH A 479 18.491 -8.128 0.457 1.00 55.24 O HETATM 4328 O HOH A 480 27.273 -3.645 -4.065 1.00 19.62 O HETATM 4329 O HOH A 481 40.238 -26.614 2.360 1.00 27.35 O HETATM 4330 O HOH A 482 36.153 -21.207 -12.036 1.00 25.48 O HETATM 4331 O HOH A 483 28.461 6.927 -23.832 1.00 31.54 O HETATM 4332 O HOH A 484 24.655 -34.191 -18.418 1.00 44.91 O HETATM 4333 O HOH A 485 36.202 -29.525 7.334 1.00 23.31 O HETATM 4334 O HOH A 486 19.760 -41.601 -5.029 1.00 36.82 O HETATM 4335 O HOH A 487 29.953 -18.352 18.127 1.00 42.97 O HETATM 4336 O HOH A 488 13.967 -27.473 -20.409 1.00 41.23 O HETATM 4337 O HOH A 489 31.058 -20.640 -31.714 1.00 25.06 O HETATM 4338 O HOH A 490 7.299 -35.779 -8.359 1.00 23.09 O HETATM 4339 O HOH A 491 34.766 15.050 -21.545 1.00 28.27 O HETATM 4340 O HOH A 492 8.771 -15.409 -23.860 1.00 27.21 O HETATM 4341 O HOH A 493 17.998 -27.635 -19.399 1.00 22.37 O HETATM 4342 O HOH A 494 22.940 -8.009 -19.552 1.00 27.97 O HETATM 4343 O HOH A 495 26.737 -1.015 -21.838 1.00 28.09 O HETATM 4344 O HOH A 496 11.992 -25.995 7.128 1.00 41.05 O HETATM 4345 O HOH A 497 18.311 -6.456 3.202 1.00 45.35 O HETATM 4346 O HOH A 498 36.156 -22.888 7.096 1.00 14.59 O HETATM 4347 O HOH A 499 38.807 -15.805 -4.065 1.00 20.85 O HETATM 4348 O HOH A 500 13.703 -30.086 -13.126 1.00 17.94 O HETATM 4349 O HOH A 501 20.684 -13.598 -15.689 1.00 15.53 O HETATM 4350 O HOH A 502 27.277 -22.966 -24.082 1.00 24.34 O HETATM 4351 O HOH A 503 2.561 -33.024 -11.484 1.00 37.12 O HETATM 4352 O HOH A 504 22.273 -3.295 -20.935 1.00 43.48 O HETATM 4353 O HOH A 505 22.422 8.934 -22.401 1.00 28.43 O HETATM 4354 O HOH A 506 11.199 -30.681 -19.691 1.00 26.05 O HETATM 4355 O HOH A 507 41.355 -10.138 11.316 1.00 35.24 O HETATM 4356 O HOH A 508 20.782 -37.273 -13.077 1.00 25.71 O HETATM 4357 O HOH A 509 35.069 -10.111 -0.480 1.00 25.23 O HETATM 4358 O HOH A 510 33.669 -27.898 0.921 1.00 16.53 O HETATM 4359 O HOH A 511 20.418 -6.669 -8.796 1.00 28.86 O HETATM 4360 O HOH A 512 25.081 -16.114 -4.250 1.00 19.73 O HETATM 4361 O HOH A 513 20.202 -23.410 -23.713 1.00 18.20 O HETATM 4362 O HOH A 514 11.442 -20.515 3.028 1.00 34.12 O HETATM 4363 O HOH A 515 36.860 -23.871 3.193 1.00 17.12 O HETATM 4364 O HOH A 516 26.477 -12.122 18.279 1.00 30.75 O HETATM 4365 O HOH A 517 21.211 -0.910 8.733 1.00 29.54 O HETATM 4366 O HOH A 518 41.604 -23.401 10.229 1.00 27.60 O HETATM 4367 O HOH A 519 2.860 -21.722 0.989 1.00 39.00 O HETATM 4368 O HOH A 520 26.115 -24.079 11.479 1.00 28.50 O HETATM 4369 O HOH A 521 11.200 -28.833 1.263 1.00 23.09 O HETATM 4370 O HOH A 522 40.951 -16.708 7.088 1.00 17.02 O HETATM 4371 O HOH A 523 20.877 16.667 -29.430 1.00 39.91 O HETATM 4372 O HOH A 524 28.752 -20.823 -25.344 1.00 19.91 O HETATM 4373 O HOH A 525 19.010 -14.988 -24.054 1.00 22.18 O HETATM 4374 O HOH A 526 3.000 -13.874 -11.351 1.00 50.43 O HETATM 4375 O HOH A 527 1.940 -15.736 -11.888 1.00 42.26 O HETATM 4376 O HOH A 528 35.780 -16.974 18.801 1.00 20.67 O HETATM 4377 O HOH A 529 20.517 -1.920 -18.920 1.00 29.43 O HETATM 4378 O HOH A 530 31.579 -1.606 4.092 1.00 36.29 O HETATM 4379 O HOH A 531 41.138 -20.014 -6.949 1.00 37.10 O HETATM 4380 O HOH A 532 4.888 -12.722 -13.416 1.00 26.85 O HETATM 4381 O HOH A 533 33.592 -7.648 0.732 1.00 17.23 O HETATM 4382 O HOH A 534 38.539 -16.817 -9.908 1.00 31.04 O HETATM 4383 O HOH A 535 12.492 -21.520 0.350 1.00 27.23 O HETATM 4384 O HOH A 536 15.658 -30.597 -10.974 1.00 22.49 O HETATM 4385 O HOH A 537 40.405 -27.141 -8.269 1.00 45.88 O HETATM 4386 O HOH A 538 10.296 -35.001 -16.858 1.00 20.83 O HETATM 4387 O HOH A 539 22.131 -17.564 9.843 1.00 33.91 O HETATM 4388 O HOH A 540 23.792 -28.527 -20.671 1.00 19.78 O HETATM 4389 O HOH A 541 7.816 -11.255 -21.396 1.00 43.90 O HETATM 4390 O HOH A 542 29.949 -18.482 15.509 1.00 19.84 O HETATM 4391 O HOH A 543 21.900 -12.471 10.786 1.00 21.50 O HETATM 4392 O HOH A 544 18.107 -5.787 11.804 1.00 42.31 O HETATM 4393 O HOH A 545 21.753 -5.909 -3.379 1.00 37.10 O HETATM 4394 O HOH A 546 5.659 -20.290 0.976 1.00 43.85 O HETATM 4395 O HOH A 547 7.713 -16.623 -3.827 1.00 22.26 O HETATM 4396 O HOH A 548 8.914 -24.860 -24.232 1.00 27.18 O HETATM 4397 O HOH A 549 14.037 -10.386 -20.841 1.00 50.65 O HETATM 4398 O HOH A 550 26.983 -34.203 -12.191 1.00 36.05 O HETATM 4399 O HOH A 551 27.107 -35.718 -4.159 1.00 44.53 O HETATM 4400 O HOH A 552 20.868 -17.906 -5.068 1.00 27.04 O HETATM 4401 O HOH A 553 38.871 -10.804 -7.635 1.00 29.78 O HETATM 4402 O HOH A 554 7.944 -20.640 -29.880 1.00 32.60 O HETATM 4403 O HOH A 555 18.951 -1.229 -12.243 1.00 23.34 O HETATM 4404 O HOH A 556 38.083 -11.212 3.722 1.00 19.63 O HETATM 4405 O HOH A 557 11.107 -30.394 -9.250 1.00 18.38 O HETATM 4406 O HOH A 558 32.054 -24.684 -15.307 1.00 21.41 O HETATM 4407 O HOH A 559 43.683 -18.067 9.416 1.00 20.80 O HETATM 4408 O HOH A 560 30.634 -29.645 2.813 1.00 26.70 O HETATM 4409 O HOH A 561 14.072 -31.261 -15.588 1.00 27.69 O HETATM 4410 O HOH A 562 30.875 7.670 -22.793 1.00 17.57 O HETATM 4411 O HOH A 563 36.803 -0.780 -10.885 1.00 24.64 O HETATM 4412 O HOH A 564 40.812 -19.552 -2.210 1.00 33.16 O HETATM 4413 O HOH A 565 34.898 -21.875 -9.578 1.00 20.35 O HETATM 4414 O HOH A 566 34.838 -18.007 -26.451 1.00 32.96 O HETATM 4415 O HOH A 567 27.325 -17.737 15.193 1.00 22.57 O HETATM 4416 O HOH A 568 23.531 -16.656 -26.221 1.00 32.67 O HETATM 4417 O HOH A 569 19.695 -10.732 4.556 1.00 29.47 O HETATM 4418 O HOH A 570 22.208 -10.422 -6.898 1.00 16.43 O HETATM 4419 O HOH A 571 32.716 -27.673 -11.715 1.00 48.33 O HETATM 4420 O HOH A 572 40.240 -12.556 2.917 1.00 33.99 O HETATM 4421 O HOH A 573 24.386 -20.466 -25.931 1.00 37.25 O HETATM 4422 O HOH A 574 37.249 -26.773 -5.394 1.00 17.54 O HETATM 4423 O HOH A 575 23.654 15.846 -20.331 1.00 41.88 O HETATM 4424 O HOH A 576 38.052 -7.191 -12.329 1.00 25.34 O HETATM 4425 O HOH A 577 14.219 -26.442 -25.848 1.00 20.57 O HETATM 4426 O HOH A 578 2.091 -37.755 -6.782 1.00 19.51 O HETATM 4427 O HOH A 579 11.991 -31.539 0.093 1.00 16.83 O HETATM 4428 O HOH A 580 25.989 -12.936 15.687 1.00 16.30 O HETATM 4429 O HOH A 581 22.116 -26.648 -21.831 1.00 22.80 O HETATM 4430 O HOH A 582 19.158 -3.099 9.355 1.00 42.07 O HETATM 4431 O HOH A 583 27.939 -30.479 -19.306 1.00 35.16 O HETATM 4432 O HOH A 584 17.548 -28.897 -10.284 1.00 25.20 O HETATM 4433 O HOH A 585 43.004 -14.043 1.392 1.00 39.25 O HETATM 4434 O HOH A 586 12.411 -31.375 4.014 1.00 41.80 O HETATM 4435 O HOH A 587 14.629 -31.946 0.570 1.00 26.59 O HETATM 4436 O HOH A 588 6.309 -28.505 9.911 1.00 26.96 O HETATM 4437 O HOH A 589 18.687 -29.835 1.514 1.00 40.40 O HETATM 4438 O HOH A 590 23.852 12.349 -24.462 1.00 36.44 O HETATM 4439 O HOH A 591 42.007 -9.111 2.846 1.00 40.30 O HETATM 4440 O HOH A 592 9.198 -22.886 6.663 1.00 39.46 O HETATM 4441 O HOH A 593 32.463 -10.648 -17.818 1.00 14.91 O HETATM 4442 O HOH A 594 29.692 10.547 -21.209 1.00 21.57 O HETATM 4443 O HOH A 595 32.907 -7.325 -20.981 1.00 34.17 O HETATM 4444 O HOH A 596 26.588 -7.703 -22.095 1.00 34.66 O HETATM 4445 O HOH A 597 35.553 -24.583 -9.422 1.00 22.75 O HETATM 4446 O HOH A 598 32.223 16.343 -22.574 1.00 39.37 O HETATM 4447 O HOH A 599 7.282 -29.717 -19.642 1.00 38.25 O HETATM 4448 O HOH A 600 23.313 -16.520 -6.475 1.00 22.37 O HETATM 4449 O HOH A 601 36.601 -20.216 -16.921 1.00 46.62 O HETATM 4450 O HOH A 602 27.019 1.396 5.645 1.00 19.84 O HETATM 4451 O HOH A 603 40.992 -12.297 4.712 1.00 27.97 O HETATM 4452 O HOH A 604 21.017 -20.341 -28.624 1.00 47.50 O HETATM 4453 O HOH A 605 36.126 -33.562 -5.730 1.00 44.35 O HETATM 4454 O HOH A 606 43.074 -9.716 15.356 1.00 39.22 O HETATM 4455 O HOH A 607 33.352 -21.689 13.443 1.00 20.93 O HETATM 4456 O HOH A 608 34.213 -27.439 -10.267 1.00 46.00 O HETATM 4457 O HOH A 609 35.531 -19.500 -18.604 1.00 38.08 O HETATM 4458 O HOH A 610 12.793 -27.481 3.163 1.00 29.02 O HETATM 4459 O HOH A 611 18.028 -9.177 -11.127 1.00 36.49 O HETATM 4460 O HOH A 612 34.445 -4.605 4.196 1.00 43.46 O HETATM 4461 O HOH A 613 39.439 -22.098 1.363 1.00 34.64 O HETATM 4462 O HOH A 614 17.247 -13.337 -6.539 1.00 30.27 O HETATM 4463 O HOH A 615 38.632 -17.074 -29.332 1.00 44.22 O HETATM 4464 O HOH A 616 35.492 -31.415 -7.826 1.00 29.76 O HETATM 4465 O HOH A 617 18.595 2.734 -23.023 1.00 38.78 O HETATM 4466 O HOH A 618 36.835 -20.593 15.816 1.00 19.36 O HETATM 4467 O HOH A 619 21.210 -36.954 -0.782 1.00 37.98 O HETATM 4468 O HOH A 620 28.160 10.691 -25.406 1.00 36.96 O HETATM 4469 O HOH A 621 3.531 -30.927 9.386 1.00 34.68 O HETATM 4470 O HOH A 622 9.197 -32.519 5.483 1.00 20.49 O HETATM 4471 O HOH A 623 2.600 -21.468 -6.952 1.00 49.10 O HETATM 4472 O HOH A 624 32.020 -4.211 -22.648 1.00 36.09 O HETATM 4473 O HOH A 625 7.259 -26.430 -22.523 1.00 31.37 O HETATM 4474 O HOH A 626 19.231 4.277 -16.569 1.00 27.53 O HETATM 4475 O HOH A 627 37.988 -27.420 -7.841 1.00 46.18 O HETATM 4476 O HOH A 628 28.696 -30.504 -17.031 1.00 27.44 O HETATM 4477 O HOH A 629 32.542 -15.002 -27.622 1.00 31.26 O HETATM 4478 O HOH A 630 38.915 -22.068 15.458 1.00 41.04 O HETATM 4479 O HOH A 631 22.136 -18.794 7.299 1.00 26.32 O HETATM 4480 O HOH A 632 25.715 -37.150 -11.330 1.00 43.69 O HETATM 4481 O HOH A 633 23.529 -21.740 -4.415 1.00 18.43 O HETATM 4482 O HOH A 634 34.299 -11.710 -23.040 1.00 45.88 O HETATM 4483 O HOH A 635 15.867 -12.023 -22.706 1.00 46.60 O HETATM 4484 O HOH A 636 2.549 -23.047 -17.470 1.00 42.01 O HETATM 4485 O HOH A 637 33.075 6.735 -25.002 1.00 32.91 O HETATM 4486 O HOH A 638 29.302 -3.293 4.449 1.00 13.51 O HETATM 4487 O HOH A 639 24.500 -37.141 -0.620 1.00 27.76 O HETATM 4488 O HOH A 640 5.599 -26.602 12.075 1.00 44.60 O HETATM 4489 O HOH A 641 27.870 -38.620 -1.252 1.00 48.87 O HETATM 4490 O HOH A 642 37.872 -25.104 0.992 1.00 27.23 O HETATM 4491 O HOH A 643 3.457 -22.041 -4.937 1.00 43.79 O HETATM 4492 O HOH A 644 20.138 -21.599 6.992 1.00 35.09 O HETATM 4493 O HOH A 645 35.522 -6.722 -19.499 1.00 40.28 O HETATM 4494 O HOH A 646 37.331 -16.418 -12.855 1.00 43.55 O HETATM 4495 O HOH A 647 25.623 -3.164 1.962 1.00 33.18 O HETATM 4496 O HOH A 648 33.741 -34.557 4.484 1.00 26.55 O HETATM 4497 O HOH A 649 13.344 -30.333 -18.412 1.00 42.00 O HETATM 4498 O HOH A 650 4.563 -33.155 9.819 1.00 33.88 O HETATM 4499 O HOH A 651 34.343 -23.869 -16.030 1.00 45.89 O HETATM 4500 O HOH A 652 39.848 -10.280 -10.284 1.00 39.43 O HETATM 4501 O HOH A 653 23.376 -30.201 4.505 1.00 40.56 O HETATM 4502 O HOH A 654 19.085 -11.744 0.816 1.00 40.86 O HETATM 4503 O HOH A 655 37.086 -31.768 5.973 1.00 50.68 O HETATM 4504 O HOH A 656 21.652 -7.036 -17.416 1.00 40.28 O HETATM 4505 O HOH A 657 33.014 -17.007 19.303 1.00 45.19 O HETATM 4506 O HOH A 658 19.752 -35.349 -15.268 1.00 48.77 O HETATM 4507 O HOH A 659 36.395 -11.618 -15.159 1.00 44.81 O HETATM 4508 O HOH A 660 27.553 -32.551 -16.707 1.00 41.36 O HETATM 4509 O HOH A 661 41.406 -17.877 -26.998 1.00 36.53 O HETATM 4510 O HOH A 662 14.841 4.542 -28.937 1.00 52.07 O HETATM 4511 O HOH A 663 21.757 -18.489 -29.860 1.00 35.89 O HETATM 4512 O HOH A 664 33.691 -32.828 6.428 1.00 42.59 O HETATM 4513 O HOH A 665 39.324 -22.606 17.148 1.00 41.14 O HETATM 4514 O HOH A 666 36.554 -8.267 -4.989 1.00 41.72 O HETATM 4515 O HOH A 667 29.555 -35.729 -7.907 1.00 44.97 O HETATM 4516 O HOH A 668 18.960 -31.518 -17.055 1.00 37.01 O HETATM 4517 O HOH A 669 25.134 -0.229 4.630 1.00 39.88 O HETATM 4518 O HOH A 670 41.316 -30.730 4.001 1.00 44.02 O HETATM 4519 O HOH A 671 0.166 -31.881 -1.819 1.00 23.16 O HETATM 4520 O HOH A 672 27.240 -2.807 2.080 1.00 34.93 O HETATM 4521 O HOH A 673 35.722 7.600 -25.865 1.00 37.14 O HETATM 4522 O HOH A 674 37.727 0.263 -15.213 1.00 33.24 O HETATM 4523 O HOH A 675 36.652 -16.272 -14.316 1.00 54.28 O HETATM 4524 O HOH A 676 34.600 -7.088 7.303 1.00 31.61 O HETATM 4525 O HOH A 677 32.870 -35.611 -8.604 1.00 53.33 O HETATM 4526 O HOH A 678 2.874 -32.060 -17.716 1.00 44.83 O HETATM 4527 O HOH A 679 40.039 -13.259 -4.336 1.00 34.86 O HETATM 4528 O HOH A 680 32.775 -5.042 -3.028 1.00 31.28 O HETATM 4529 O HOH A 681 2.685 -20.024 -3.016 1.00 50.51 O HETATM 4530 O HOH A 682 34.674 9.890 -26.012 1.00 39.92 O HETATM 4531 O HOH A 683 4.808 -22.260 -23.999 1.00 43.21 O HETATM 4532 O HOH A 684 35.962 5.481 -5.917 1.00 41.66 O HETATM 4533 O HOH A 685 42.055 -10.934 1.838 1.00 49.46 O HETATM 4534 O HOH A 686 12.571 -14.602 -25.790 1.00 42.55 O HETATM 4535 O HOH A 687 33.846 -10.205 -20.146 1.00 26.60 O HETATM 4536 O HOH A 688 5.632 -34.627 -12.586 1.00 39.71 O HETATM 4537 O HOH A 689 34.089 -4.333 -4.763 1.00 46.64 O HETATM 4538 O HOH A 690 46.409 -14.785 6.847 1.00 31.98 O HETATM 4539 O HOH A 691 10.585 -22.909 8.761 1.00 43.52 O HETATM 4540 O HOH A 692 24.081 -4.518 -22.813 1.00 44.23 O HETATM 4541 O HOH A 693 38.491 -19.409 -10.393 1.00 45.29 O HETATM 4542 O HOH A 694 20.100 -27.655 -22.965 1.00 41.60 O HETATM 4543 O HOH A 695 34.311 -35.356 -2.554 1.00 47.49 O HETATM 4544 O HOH A 696 4.335 -19.119 -1.462 1.00 42.11 O HETATM 4545 O HOH A 697 33.136 -35.581 -4.840 1.00 53.28 O HETATM 4546 O HOH A 698 27.499 9.859 -22.901 1.00 30.75 O HETATM 4547 O HOH A 699 18.063 -0.429 -14.827 1.00 37.57 O HETATM 4548 O HOH A 700 19.953 -8.778 -6.927 1.00 28.49 O HETATM 4549 O HOH A 701 22.710 -11.161 18.065 1.00 37.71 O HETATM 4550 O HOH A 702 41.059 -10.396 15.637 0.50 42.25 O HETATM 4551 O HOH A 703 25.270 -6.476 -14.555 1.00 16.80 O HETATM 4552 O HOH A 704 21.549 -10.415 -19.695 1.00 36.74 O HETATM 4553 O HOH A 705 35.525 -5.834 1.443 1.00 46.87 O HETATM 4554 O HOH A 706 36.316 -19.502 18.456 1.00 28.73 O HETATM 4555 O HOH A 707 29.527 -2.268 -24.690 1.00 37.91 O HETATM 4556 O HOH A 708 36.099 -35.894 -1.560 1.00 52.41 O HETATM 4557 O HOH A 709 37.592 4.718 -14.347 1.00 24.83 O HETATM 4558 O HOH A 710 38.023 -2.820 -9.591 1.00 36.18 O HETATM 4559 O HOH A 711 22.048 -3.013 -3.120 1.00 42.39 O HETATM 4560 O HOH A 712 15.957 -34.034 1.263 1.00 39.16 O HETATM 4561 O HOH A 713 19.349 -25.964 -24.591 1.00 27.89 O HETATM 4562 O HOH A 714 34.815 -9.188 -2.997 1.00 27.39 O HETATM 4563 O HOH A 715 23.228 -16.169 16.135 1.00 42.85 O HETATM 4564 O HOH A 716 11.379 -10.635 -19.602 1.00 45.73 O HETATM 4565 O HOH A 717 34.841 -12.180 -17.100 1.00 26.91 O HETATM 4566 O HOH A 718 18.122 -14.329 3.442 1.00 35.55 O HETATM 4567 O HOH A 719 39.466 -7.309 11.065 1.00 45.06 O HETATM 4568 O HOH A 720 21.421 -13.897 12.880 1.00 44.85 O HETATM 4569 O HOH A 721 25.836 -15.642 16.439 1.00 26.84 O HETATM 4570 O HOH A 722 35.045 -22.894 15.329 1.00 24.54 O HETATM 4571 O HOH A 723 18.346 0.469 -10.054 1.00 45.10 O HETATM 4572 O HOH A 724 3.581 -11.108 -15.332 1.00 42.12 O HETATM 4573 O HOH A 725 29.488 -21.754 -29.939 1.00 23.13 O HETATM 4574 O HOH A 726 17.967 -3.869 -17.806 1.00 47.40 O HETATM 4575 O HOH A 727 18.849 8.114 -19.369 1.00 44.25 O HETATM 4576 O HOH A 728 9.179 -19.238 -26.461 1.00 36.65 O HETATM 4577 O HOH A 729 18.473 -16.168 7.428 1.00 44.86 O HETATM 4578 O HOH A 730 20.597 1.353 5.538 1.00 48.38 O HETATM 4579 O HOH A 731 38.488 0.129 -12.722 1.00 33.59 O HETATM 4580 O HOH A 732 18.079 -12.409 2.850 1.00 48.83 O HETATM 4581 O HOH A 733 28.353 -3.356 -22.520 1.00 33.00 O HETATM 4582 O HOH A 734 43.541 -21.273 -10.869 1.00 42.13 O HETATM 4583 O HOH A 735 37.037 6.598 -11.005 1.00 23.03 O HETATM 4584 O HOH A 736 29.948 -22.269 -27.351 1.00 27.66 O HETATM 4585 O HOH A 737 12.507 -24.021 8.817 1.00 46.17 O HETATM 4586 O HOH A 738 39.111 -8.470 4.368 1.00 40.38 O HETATM 4587 O HOH A 739 27.144 -20.270 -29.440 1.00 26.11 O HETATM 4588 O HOH A 740 27.476 -16.219 -27.247 1.00 37.85 O HETATM 4589 O HOH A 741 17.273 -9.087 -6.833 1.00 47.43 O HETATM 4590 O HOH A 742 24.686 10.550 -22.149 1.00 37.15 O HETATM 4591 O HOH A 743 28.205 -36.467 -6.284 1.00 44.67 O HETATM 4592 O HOH A 744 36.438 -17.458 -18.375 1.00 45.60 O HETATM 4593 O HOH A 745 39.099 -31.472 5.312 1.00 20.67 O HETATM 4594 O HOH A 746 5.440 -16.563 -2.432 1.00 37.37 O HETATM 4595 O HOH A 747 17.442 2.616 -15.554 1.00 37.77 O HETATM 4596 O HOH A 748 19.863 -4.883 -18.690 1.00 49.44 O HETATM 4597 O HOH A 749 42.679 -22.608 19.536 1.00 21.86 O HETATM 4598 O HOH A 750 37.226 -9.346 1.159 1.00 30.34 O HETATM 4599 O HOH A 751 24.613 11.502 -20.008 1.00 36.28 O HETATM 4600 O HOH A 752 17.758 -29.639 -17.498 1.00 32.80 O HETATM 4601 O HOH A 753 9.665 -14.917 -2.669 1.00 31.95 O HETATM 4602 O HOH A 754 25.976 -5.287 -22.976 1.00 33.57 O HETATM 4603 O HOH A 755 21.968 -5.822 -21.075 1.00 43.92 O HETATM 4604 O HOH A 756 32.825 -7.552 -1.837 1.00 28.59 O HETATM 4605 O HOH A 757 27.033 -19.099 -26.807 1.00 24.20 O HETATM 4606 O HOH A 758 16.446 -3.704 12.632 1.00 41.36 O HETATM 4607 O HOH A 759 40.638 -1.138 -12.465 1.00 47.28 O HETATM 4608 O HOH A 760 1.856 -24.130 -4.907 1.00 45.83 O HETATM 4609 O HOH A 761 40.552 -3.053 -10.762 1.00 43.90 O HETATM 4610 O HOH A 762 38.494 -6.747 4.659 1.00 43.18 O HETATM 4611 O HOH A 763 41.059 2.272 -15.637 0.50 46.57 O HETATM 4612 O HOH P 201 21.710 -24.301 1.444 1.00 44.04 O HETATM 4613 O HOH P 202 17.780 -10.583 -9.033 1.00 30.08 O HETATM 4614 O HOH P 203 17.072 -20.662 4.286 1.00 43.70 O HETATM 4615 O HOH P 204 19.923 -16.589 -7.480 1.00 12.05 O HETATM 4616 O HOH P 205 14.479 -19.526 0.305 1.00 51.21 O HETATM 4617 O HOH P 206 13.928 -14.245 -5.567 1.00 29.40 O HETATM 4618 O HOH P 207 17.273 -12.200 -12.600 1.00 31.57 O HETATM 4619 O HOH P 208 15.093 -17.772 1.314 1.00 43.14 O HETATM 4620 O HOH P 209 6.761 -11.326 -12.320 1.00 41.30 O HETATM 4621 O HOH P 210 15.311 -12.228 -8.444 1.00 28.90 O HETATM 4622 O HOH P 211 17.725 -15.325 0.909 1.00 24.97 O HETATM 4623 O HOH P 212 18.119 -13.346 -1.646 1.00 21.62 O HETATM 4624 O HOH P 213 21.109 -17.266 5.561 1.00 43.34 O HETATM 4625 O HOH P 214 9.612 -7.763 -9.981 1.00 49.42 O HETATM 4626 O HOH P 215 14.281 -21.830 8.235 1.00 50.35 O HETATM 4627 O HOH P 216 12.328 -14.988 -3.166 1.00 38.42 O HETATM 4628 O HOH P 217 12.867 -14.817 -0.412 1.00 46.27 O HETATM 4629 O HOH P 218 9.894 -8.407 -19.192 1.00 51.47 O CONECT 1338 4247 CONECT 1385 4247 CONECT 1386 4247 CONECT 2822 4246 CONECT 4111 4141 CONECT 4112 4141 CONECT 4141 4111 4112 4142 CONECT 4142 4141 4143 4145 4151 CONECT 4143 4142 4144 4152 4153 CONECT 4144 4143 4147 CONECT 4145 4142 4146 4154 CONECT 4146 4145 CONECT 4147 4144 4148 4149 4150 CONECT 4148 4147 CONECT 4149 4147 CONECT 4150 4147 CONECT 4151 4142 CONECT 4152 4143 CONECT 4153 4143 CONECT 4154 4145 CONECT 4246 2822 4304 4467 CONECT 4247 1338 1385 1386 4339 CONECT 4247 4446 CONECT 4248 4376 4554 CONECT 4304 4246 CONECT 4339 4247 CONECT 4376 4248 CONECT 4446 4247 CONECT 4467 4246 CONECT 4554 4248 END