USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 802 hydrogens (0 hets) HEADER VIRAL PROTEIN 11-APR-00 1ESX TITLE 1H, 15N AND 13C STRUCTURE OF THE HIV-1 REGULATORY PROTEIN VPR : TITLE 2 COMPARISON WITH THE N-AND C-TERMINAL DOMAIN STRUCTURE, (1-51)VPR AND TITLE 3 (52-96)VPR COMPND MOL_ID: 1; COMPND 2 MOLECULE: VPR PROTEIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: VIRAL PROTEIN OF REGULATION; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 OTHER_DETAILS: THIS SEQUENCE HAS BEEN OBTAINED BY SOLID PHASE SOURCE 4 SYNTHESIS. THE SEQUENCE OF THIS PROTEIN IS NATURALLY FOUND IN HUMAN SOURCE 5 IMMUNODEFICIENCY VIRUS TYPE 1 (HIV-1). KEYWDS HELIX, AMPHIPATIC, TURN, VIRAL PROTEIN EXPDTA SOLUTION NMR AUTHOR K.WECKER,N.MORELLET,S.BOUAZIZ,B.ROQUES REVDAT 5 27-MAR-13 1ESX 1 REMARK VERSN REVDAT 4 24-FEB-09 1ESX 1 VERSN REVDAT 3 01-APR-03 1ESX 1 JRNL REVDAT 2 30-OCT-02 1ESX 1 JRNL REVDAT 1 11-APR-01 1ESX 0 JRNL AUTH K.WECKER,N.MORELLET,S.BOUAZIZ,B.P.ROQUES JRNL TITL NMR STRUCTURE OF THE HIV-1 REGULATORY PROTEIN VPR IN JRNL TITL 2 H2O/TRIFLUOROETHANOL. COMPARISON WITH THE VPR N-TERMINAL JRNL TITL 3 (1-51) AND C-TERMINAL (52-96) DOMAINS. JRNL REF EUR.J.BIOCHEM. V. 269 3779 2002 JRNL REFN ISSN 0014-2956 JRNL PMID 12153575 JRNL DOI 10.1046/J.1432-1033.2002.03067.X REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : DISCOVER 98.0 REMARK 3 AUTHORS : MSI REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE STRUCTURE IS BASED ON A TOTAL OF REMARK 3 1420 DISTANCE CONSTRAINTS REMARK 4 REMARK 4 1ESX COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 13-APR-00. REMARK 100 THE RCSB ID CODE IS RCSB010865. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 323; 313 REMARK 210 PH : 3.4; 3.4 REMARK 210 IONIC STRENGTH : 0; 0 REMARK 210 PRESSURE : AMBIENT; AMBIENT REMARK 210 SAMPLE CONTENTS : 1 MM VPR 15N, 13C ; 10 MM DTT ; REMARK 210 HMDS ; 70 % H2O ; 30 % TFE REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D NOESY; DQF-COSY; HSQC (15N, REMARK 210 13C); HSQC-NOESY (15N, 13C); HSQC REMARK 210 -TOCSY(15N, 13C) REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DISCOVER 98.0, XWINNMR 2.1 REMARK 210 METHOD USED : SIMULATED ANNEALING, MOLECULAR REMARK 210 DYNAMICS, MINIMISATIONS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 20 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH ACCEPTABLE REMARK 210 COVALENT GEOMETRY,STRUCTURES WITH REMARK 210 FAVORABLE NON-BOND ENERGY, REMARK 210 STRUCTURES WITH THE LEAST REMARK 210 RESTRAINT VIOLATIONS,STRUCTURES REMARK 210 WITH THE LOWEST ENERGY REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 20 REMARK 210 REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED USING STANDARD 2D REMARK 210 HOMONUCLEAR TECHNIQUES, 2D HETERONUCLEAR TECHNIQUES AND REMARK 210 RELAXATION EXPERIMENTS REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. 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: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 GLU A 2 CD GLU A 2 OE2 0.111 REMARK 500 GLU A 6 CD GLU A 6 OE2 0.112 REMARK 500 GLU A 13 CD GLU A 13 OE2 0.112 REMARK 500 GLU A 21 CD GLU A 21 OE2 0.112 REMARK 500 GLU A 24 CD GLU A 24 OE2 0.112 REMARK 500 GLU A 25 CD GLU A 25 OE2 0.111 REMARK 500 GLU A 29 CD GLU A 29 OE2 0.112 REMARK 500 GLU A 48 CD GLU A 48 OE2 0.112 REMARK 500 GLU A 58 CD GLU A 58 OE2 0.112 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ARG A 87 CB - CA - C ANGL. DEV. = 13.8 DEGREES 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 GLU A 6 -48.58 -161.34 REMARK 500 GLN A 8 -54.44 -153.83 REMARK 500 PRO A 14 36.79 -64.80 REMARK 500 TYR A 15 -125.50 -143.41 REMARK 500 ASN A 16 -126.34 55.95 REMARK 500 ARG A 36 -68.28 -100.98 REMARK 500 ILE A 37 97.70 -2.12 REMARK 500 TRP A 38 -79.14 -147.37 REMARK 500 GLU A 48 -73.74 -69.68 REMARK 500 THR A 55 -57.15 -145.84 REMARK 500 HIS A 78 54.09 -91.11 REMARK 500 SER A 79 -58.05 -161.12 REMARK 500 ILE A 84 42.19 -106.82 REMARK 500 SER A 94 86.97 -55.43 REMARK 500 LYS A 95 -63.96 -140.94 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 TYR A 50 0.12 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 PHE A 34 21.5 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL DBREF 1ESX A 1 96 UNP Q73369 Q73369_9HIV1 1 96 SEQRES 1 A 96 MET GLU GLN ALA PRO GLU ASP GLN GLY PRO GLN ARG GLU SEQRES 2 A 96 PRO TYR ASN ASP TRP THR LEU GLU LEU LEU GLU GLU LEU SEQRES 3 A 96 LYS ASN GLU ALA VAL ARG HIS PHE PRO ARG ILE TRP LEU SEQRES 4 A 96 HIS SER LEU GLY GLN HIS ILE TYR GLU THR TYR GLY ASP SEQRES 5 A 96 THR TRP THR GLY VAL GLU ALA LEU ILE ARG ILE LEU GLN SEQRES 6 A 96 GLN LEU LEU PHE ILE HIS PHE ARG ILE GLY CYS ARG HIS SEQRES 7 A 96 SER ARG ILE GLY ILE ILE GLN GLN ARG ARG THR ARG ASN SEQRES 8 A 96 GLY ALA SER LYS SER HELIX 1 1 ASN A 16 HIS A 33 1 18 HELIX 2 2 TRP A 38 TYR A 50 1 13 HELIX 3 3 THR A 55 ILE A 81 1 27 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 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 Set 1.1: A 85 GLN : amide:sc= -0.135 K(o=0.48,f=-0.5) USER MOD Set 1.2: A 86 GLN : amide:sc= 0.613 K(o=0.48,f=-0.5) USER MOD Set 2.1: A 40 HIS : no HD1:sc= 0.638 K(o=1.3,f=-3.3!) USER MOD Set 2.2: A 41 SER OG : rot 29:sc= 0.694 USER MOD Set 3.1: A 8 GLN : amide:sc= 0.83 K(o=2.1,f=-3.8) USER MOD Set 3.2: A 11 GLN : amide:sc= 1.28 K(o=2.1,f=-3.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -124:sc= 0.0718 (180deg=-0.134) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.141 K(o=-0.14,f=-4.3!) USER MOD Single : A 19 THR OG1 : rot 89:sc= 0.504 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 33 HIS : no HE2:sc= -0.022 K(o=-0.022,f=-0.77) USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 HIS : no HD1:sc= -0.0328 X(o=-0.033,f=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 152:sc= 0.575 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0576 USER MOD Single : A 55 THR OG1 : rot 86:sc= 0.251 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 66 GLN : amide:sc= -1.27 X(o=-1.3,f=-1.4) USER MOD Single : A 71 HIS : no HD1:sc= -0.0329 X(o=-0.033,f=-0.16) USER MOD Single : A 76 CYS SG : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot -61:sc= 0.62 USER MOD Single : A 91 ASN : amide:sc= 0.356 X(o=0.36,f=0.0028) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -39.085 -34.505 23.775 1.00 0.00 N ATOM 2 CA MET A 1 -39.053 -34.140 25.204 1.00 0.00 C ATOM 3 C MET A 1 -37.828 -34.742 25.893 1.00 0.00 C ATOM 4 O MET A 1 -37.215 -35.668 25.364 1.00 0.00 O ATOM 5 CB MET A 1 -40.339 -34.578 25.921 1.00 0.00 C ATOM 6 CG MET A 1 -41.588 -33.884 25.368 1.00 0.00 C ATOM 7 SD MET A 1 -43.108 -34.299 26.262 1.00 0.00 S ATOM 8 CE MET A 1 -44.293 -33.294 25.332 1.00 0.00 C ATOM 0 H1 MET A 1 -39.129 -33.642 23.197 1.00 0.00 H new ATOM 0 H2 MET A 1 -38.226 -35.039 23.534 1.00 0.00 H new ATOM 0 H3 MET A 1 -39.922 -35.092 23.585 1.00 0.00 H new ATOM 0 HA MET A 1 -38.985 -33.054 25.264 1.00 0.00 H new ATOM 0 HB2 MET A 1 -40.455 -35.657 25.824 1.00 0.00 H new ATOM 0 HB3 MET A 1 -40.249 -34.361 26.985 1.00 0.00 H new ATOM 0 HG2 MET A 1 -41.439 -32.805 25.404 1.00 0.00 H new ATOM 0 HG3 MET A 1 -41.709 -34.154 24.319 1.00 0.00 H new ATOM 0 HE1 MET A 1 -45.291 -33.428 25.750 1.00 0.00 H new ATOM 0 HE2 MET A 1 -44.010 -32.243 25.398 1.00 0.00 H new ATOM 0 HE3 MET A 1 -44.292 -33.604 24.287 1.00 0.00 H new ATOM 20 N GLU A 2 -37.478 -34.210 27.070 1.00 0.00 N ATOM 21 CA GLU A 2 -36.373 -34.680 27.891 1.00 0.00 C ATOM 22 C GLU A 2 -36.582 -34.206 29.331 1.00 0.00 C ATOM 23 O GLU A 2 -37.288 -33.224 29.562 1.00 0.00 O ATOM 24 CB GLU A 2 -35.027 -34.211 27.313 1.00 0.00 C ATOM 25 CG GLU A 2 -34.949 -32.694 27.089 1.00 0.00 C ATOM 26 CD GLU A 2 -33.573 -32.275 26.571 1.00 0.00 C ATOM 27 OE1 GLU A 2 -32.844 -31.579 27.275 1.00 0.00 O ATOM 28 OE2 GLU A 2 -33.245 -32.721 25.325 1.00 0.00 O ATOM 0 H GLU A 2 -37.974 -33.420 27.482 1.00 0.00 H new ATOM 0 HA GLU A 2 -36.348 -35.770 27.890 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -34.226 -34.512 27.989 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -34.851 -34.719 26.365 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -35.715 -32.390 26.376 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -35.160 -32.176 28.024 1.00 0.00 H new ATOM 36 N GLN A 3 -35.979 -34.913 30.295 1.00 0.00 N ATOM 37 CA GLN A 3 -36.097 -34.619 31.717 1.00 0.00 C ATOM 38 C GLN A 3 -35.110 -33.506 32.080 1.00 0.00 C ATOM 39 O GLN A 3 -34.116 -33.735 32.769 1.00 0.00 O ATOM 40 CB GLN A 3 -35.884 -35.912 32.519 1.00 0.00 C ATOM 41 CG GLN A 3 -36.236 -35.737 34.002 1.00 0.00 C ATOM 42 CD GLN A 3 -36.033 -37.036 34.777 1.00 0.00 C ATOM 43 OE1 GLN A 3 -36.997 -37.673 35.194 1.00 0.00 O ATOM 44 NE2 GLN A 3 -34.774 -37.433 34.974 1.00 0.00 N ATOM 0 H GLN A 3 -35.386 -35.719 30.098 1.00 0.00 H new ATOM 0 HA GLN A 3 -37.093 -34.254 31.967 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -36.496 -36.707 32.093 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -34.844 -36.227 32.428 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -35.616 -34.952 34.435 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -37.272 -35.413 34.096 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -34.001 -36.875 34.611 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -34.585 -38.294 35.487 1.00 0.00 H new ATOM 53 N ALA A 4 -35.398 -32.298 31.586 1.00 0.00 N ATOM 54 CA ALA A 4 -34.589 -31.101 31.743 1.00 0.00 C ATOM 55 C ALA A 4 -35.500 -29.883 31.564 1.00 0.00 C ATOM 56 O ALA A 4 -36.513 -29.989 30.873 1.00 0.00 O ATOM 57 CB ALA A 4 -33.484 -31.106 30.679 1.00 0.00 C ATOM 0 H ALA A 4 -36.243 -32.128 31.041 1.00 0.00 H new ATOM 0 HA ALA A 4 -34.126 -31.067 32.729 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -32.870 -30.212 30.787 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -32.861 -31.991 30.806 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -33.935 -31.119 29.687 1.00 0.00 H new ATOM 63 N PRO A 5 -35.165 -28.727 32.162 1.00 0.00 N ATOM 64 CA PRO A 5 -35.932 -27.501 32.008 1.00 0.00 C ATOM 65 C PRO A 5 -35.917 -27.028 30.551 1.00 0.00 C ATOM 66 O PRO A 5 -36.946 -26.606 30.029 1.00 0.00 O ATOM 67 CB PRO A 5 -35.273 -26.500 32.958 1.00 0.00 C ATOM 68 CG PRO A 5 -33.837 -26.983 33.094 1.00 0.00 C ATOM 69 CD PRO A 5 -34.001 -28.494 33.001 1.00 0.00 C ATOM 0 HA PRO A 5 -36.986 -27.632 32.252 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -35.314 -25.487 32.556 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -35.777 -26.480 33.924 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -33.198 -26.592 32.302 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -33.392 -26.678 34.041 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -33.113 -28.956 32.570 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -34.140 -28.932 33.990 1.00 0.00 H new ATOM 77 N GLU A 6 -34.752 -27.121 29.899 1.00 0.00 N ATOM 78 CA GLU A 6 -34.564 -26.824 28.488 1.00 0.00 C ATOM 79 C GLU A 6 -33.266 -27.470 28.003 1.00 0.00 C ATOM 80 O GLU A 6 -33.269 -28.152 26.981 1.00 0.00 O ATOM 81 CB GLU A 6 -34.615 -25.309 28.223 1.00 0.00 C ATOM 82 CG GLU A 6 -33.633 -24.474 29.058 1.00 0.00 C ATOM 83 CD GLU A 6 -33.851 -22.981 28.827 1.00 0.00 C ATOM 84 OE1 GLU A 6 -33.024 -22.345 28.177 1.00 0.00 O ATOM 85 OE2 GLU A 6 -34.980 -22.450 29.378 1.00 0.00 O ATOM 0 H GLU A 6 -33.891 -27.415 30.361 1.00 0.00 H new ATOM 0 HA GLU A 6 -35.385 -27.252 27.913 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -34.413 -25.132 27.167 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -35.627 -24.955 28.417 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -33.762 -24.705 30.116 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -32.609 -24.741 28.796 1.00 0.00 H new ATOM 93 N ASP A 7 -32.179 -27.266 28.758 1.00 0.00 N ATOM 94 CA ASP A 7 -30.854 -27.821 28.543 1.00 0.00 C ATOM 95 C ASP A 7 -30.362 -28.421 29.860 1.00 0.00 C ATOM 96 O ASP A 7 -30.897 -28.106 30.924 1.00 0.00 O ATOM 97 CB ASP A 7 -29.916 -26.703 28.063 1.00 0.00 C ATOM 98 CG ASP A 7 -28.502 -27.190 27.744 1.00 0.00 C ATOM 99 OD1 ASP A 7 -27.539 -26.521 28.111 1.00 0.00 O ATOM 100 OD2 ASP A 7 -28.402 -28.361 27.050 1.00 0.00 O ATOM 0 H ASP A 7 -32.213 -26.670 29.585 1.00 0.00 H new ATOM 0 HA ASP A 7 -30.876 -28.602 27.783 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -30.342 -26.239 27.173 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -29.862 -25.931 28.830 1.00 0.00 H new ATOM 106 N GLN A 8 -29.344 -29.286 29.785 1.00 0.00 N ATOM 107 CA GLN A 8 -28.770 -29.954 30.943 1.00 0.00 C ATOM 108 C GLN A 8 -27.313 -30.325 30.665 1.00 0.00 C ATOM 109 O GLN A 8 -26.428 -29.952 31.432 1.00 0.00 O ATOM 110 CB GLN A 8 -29.636 -31.171 31.287 1.00 0.00 C ATOM 111 CG GLN A 8 -29.208 -31.887 32.568 1.00 0.00 C ATOM 112 CD GLN A 8 -30.159 -33.049 32.824 1.00 0.00 C ATOM 113 OE1 GLN A 8 -29.788 -34.212 32.677 1.00 0.00 O ATOM 114 NE2 GLN A 8 -31.409 -32.728 33.160 1.00 0.00 N ATOM 0 H GLN A 8 -28.895 -29.540 28.905 1.00 0.00 H new ATOM 0 HA GLN A 8 -28.762 -29.291 31.808 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -30.673 -30.851 31.389 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -29.601 -31.877 30.457 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -28.185 -32.251 32.473 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -29.223 -31.195 33.410 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -31.672 -31.749 33.271 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -32.102 -33.462 33.306 1.00 0.00 H new ATOM 123 N GLY A 9 -27.066 -31.052 29.569 1.00 0.00 N ATOM 124 CA GLY A 9 -25.735 -31.495 29.178 1.00 0.00 C ATOM 125 C GLY A 9 -25.875 -32.776 28.361 1.00 0.00 C ATOM 126 O GLY A 9 -25.818 -32.710 27.134 1.00 0.00 O ATOM 0 H GLY A 9 -27.799 -31.350 28.925 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -25.236 -30.724 28.592 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -25.120 -31.673 30.060 1.00 0.00 H new ATOM 130 N PRO A 10 -26.067 -33.935 29.020 1.00 0.00 N ATOM 131 CA PRO A 10 -26.333 -35.198 28.345 1.00 0.00 C ATOM 132 C PRO A 10 -27.607 -35.018 27.531 1.00 0.00 C ATOM 133 O PRO A 10 -27.604 -35.100 26.304 1.00 0.00 O ATOM 134 CB PRO A 10 -26.508 -36.237 29.458 1.00 0.00 C ATOM 135 CG PRO A 10 -26.748 -35.442 30.743 1.00 0.00 C ATOM 136 CD PRO A 10 -26.086 -34.093 30.466 1.00 0.00 C ATOM 0 HA PRO A 10 -25.539 -35.515 27.669 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -27.348 -36.898 29.246 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -25.622 -36.866 29.548 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -27.812 -35.330 30.951 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -26.304 -35.935 31.608 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -26.642 -33.283 30.938 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -25.075 -34.065 30.873 1.00 0.00 H new ATOM 144 N GLN A 11 -28.687 -34.738 28.258 1.00 0.00 N ATOM 145 CA GLN A 11 -29.980 -34.402 27.698 1.00 0.00 C ATOM 146 C GLN A 11 -29.837 -33.008 27.085 1.00 0.00 C ATOM 147 O GLN A 11 -29.521 -32.045 27.787 1.00 0.00 O ATOM 148 CB GLN A 11 -31.054 -34.437 28.788 1.00 0.00 C ATOM 149 CG GLN A 11 -31.290 -35.870 29.278 1.00 0.00 C ATOM 150 CD GLN A 11 -32.440 -35.917 30.278 1.00 0.00 C ATOM 151 OE1 GLN A 11 -33.534 -36.370 29.951 1.00 0.00 O ATOM 152 NE2 GLN A 11 -32.196 -35.435 31.496 1.00 0.00 N ATOM 0 H GLN A 11 -28.679 -34.741 29.278 1.00 0.00 H new ATOM 0 HA GLN A 11 -30.290 -35.118 26.937 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -30.749 -33.808 29.624 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -31.985 -34.023 28.400 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -31.513 -36.517 28.430 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -30.382 -36.255 29.743 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -31.272 -35.068 31.724 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -32.933 -35.433 32.201 1.00 0.00 H new ATOM 161 N ARG A 12 -30.016 -32.926 25.763 1.00 0.00 N ATOM 162 CA ARG A 12 -29.816 -31.719 24.983 1.00 0.00 C ATOM 163 C ARG A 12 -30.627 -31.837 23.694 1.00 0.00 C ATOM 164 O ARG A 12 -30.442 -32.791 22.940 1.00 0.00 O ATOM 165 CB ARG A 12 -28.315 -31.566 24.692 1.00 0.00 C ATOM 166 CG ARG A 12 -28.006 -30.441 23.697 1.00 0.00 C ATOM 167 CD ARG A 12 -26.502 -30.359 23.424 1.00 0.00 C ATOM 168 NE ARG A 12 -26.219 -29.434 22.317 1.00 0.00 N ATOM 169 CZ ARG A 12 -24.992 -29.146 21.851 1.00 0.00 C ATOM 170 NH1 ARG A 12 -23.901 -29.679 22.419 1.00 0.00 N ATOM 171 NH2 ARG A 12 -24.856 -28.304 20.819 1.00 0.00 N ATOM 0 H ARG A 12 -30.312 -33.723 25.199 1.00 0.00 H new ATOM 0 HA ARG A 12 -30.152 -30.835 25.524 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -27.788 -31.371 25.626 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -27.930 -32.507 24.299 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -28.541 -30.617 22.764 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -28.361 -29.490 24.094 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -25.983 -30.026 24.323 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -26.118 -31.350 23.182 1.00 0.00 H new ATOM 0 HE ARG A 12 -27.013 -28.977 21.869 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -23.997 -30.311 23.214 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -22.975 -29.453 22.056 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -25.681 -27.885 20.391 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -23.927 -28.082 20.461 1.00 0.00 H new ATOM 185 N GLU A 13 -31.512 -30.867 23.439 1.00 0.00 N ATOM 186 CA GLU A 13 -32.273 -30.788 22.197 1.00 0.00 C ATOM 187 C GLU A 13 -31.441 -30.072 21.119 1.00 0.00 C ATOM 188 O GLU A 13 -30.453 -29.425 21.467 1.00 0.00 O ATOM 189 CB GLU A 13 -33.663 -30.175 22.434 1.00 0.00 C ATOM 190 CG GLU A 13 -33.589 -28.863 23.201 1.00 0.00 C ATOM 191 CD GLU A 13 -34.896 -28.077 23.160 1.00 0.00 C ATOM 192 OE1 GLU A 13 -34.869 -26.871 22.931 1.00 0.00 O ATOM 193 OE2 GLU A 13 -36.033 -28.791 23.398 1.00 0.00 O ATOM 0 H GLU A 13 -31.718 -30.113 24.095 1.00 0.00 H new ATOM 0 HA GLU A 13 -32.469 -31.791 21.819 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -34.152 -30.006 21.475 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -34.281 -30.883 22.987 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -33.327 -29.069 24.239 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -32.789 -28.250 22.786 1.00 0.00 H new ATOM 201 N PRO A 14 -31.813 -30.188 19.825 1.00 0.00 N ATOM 202 CA PRO A 14 -31.230 -29.503 18.657 1.00 0.00 C ATOM 203 C PRO A 14 -31.375 -27.978 18.599 1.00 0.00 C ATOM 204 O PRO A 14 -31.537 -27.373 17.541 1.00 0.00 O ATOM 205 CB PRO A 14 -31.895 -30.123 17.426 1.00 0.00 C ATOM 206 CG PRO A 14 -32.305 -31.504 17.898 1.00 0.00 C ATOM 207 CD PRO A 14 -32.595 -31.325 19.383 1.00 0.00 C ATOM 0 HA PRO A 14 -30.151 -29.649 18.715 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -32.756 -29.539 17.099 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -31.207 -30.176 16.583 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -33.184 -31.863 17.362 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -31.511 -32.233 17.733 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -33.658 -31.153 19.552 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -32.325 -32.221 19.941 1.00 0.00 H new ATOM 215 N TYR A 15 -31.276 -27.387 19.775 1.00 0.00 N ATOM 216 CA TYR A 15 -31.252 -25.981 20.117 1.00 0.00 C ATOM 217 C TYR A 15 -30.263 -25.910 21.281 1.00 0.00 C ATOM 218 O TYR A 15 -29.154 -26.426 21.151 1.00 0.00 O ATOM 219 CB TYR A 15 -32.667 -25.503 20.461 1.00 0.00 C ATOM 220 CG TYR A 15 -33.675 -25.745 19.355 1.00 0.00 C ATOM 221 CD1 TYR A 15 -33.705 -24.892 18.237 1.00 0.00 C ATOM 222 CD2 TYR A 15 -34.473 -26.905 19.370 1.00 0.00 C ATOM 223 CE1 TYR A 15 -34.539 -25.189 17.145 1.00 0.00 C ATOM 224 CE2 TYR A 15 -35.303 -27.205 18.277 1.00 0.00 C ATOM 225 CZ TYR A 15 -35.335 -26.348 17.163 1.00 0.00 C ATOM 226 OH TYR A 15 -36.138 -26.646 16.101 1.00 0.00 O ATOM 0 H TYR A 15 -31.201 -27.957 20.618 1.00 0.00 H new ATOM 0 HA TYR A 15 -30.936 -25.320 19.310 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -33.003 -26.011 21.365 1.00 0.00 H new ATOM 0 HB3 TYR A 15 -32.637 -24.437 20.687 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -33.086 -24.007 18.217 1.00 0.00 H new ATOM 0 HD2 TYR A 15 -34.447 -27.566 20.224 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -34.568 -24.527 16.292 1.00 0.00 H new ATOM 0 HE2 TYR A 15 -35.916 -28.094 18.293 1.00 0.00 H new ATOM 0 HH TYR A 15 -36.618 -27.482 16.278 1.00 0.00 H new ATOM 236 N ASN A 16 -30.642 -25.348 22.434 1.00 0.00 N ATOM 237 CA ASN A 16 -29.791 -25.364 23.611 1.00 0.00 C ATOM 238 C ASN A 16 -28.427 -24.746 23.299 1.00 0.00 C ATOM 239 O ASN A 16 -28.344 -23.629 22.794 1.00 0.00 O ATOM 240 CB ASN A 16 -29.750 -26.803 24.164 1.00 0.00 C ATOM 241 CG ASN A 16 -31.052 -27.333 24.752 1.00 0.00 C ATOM 242 OD1 ASN A 16 -31.101 -28.509 25.101 1.00 0.00 O ATOM 243 ND2 ASN A 16 -32.091 -26.508 24.897 1.00 0.00 N ATOM 0 H ASN A 16 -31.537 -24.877 22.569 1.00 0.00 H new ATOM 0 HA ASN A 16 -30.194 -24.736 24.406 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -29.440 -27.471 23.360 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -28.980 -26.853 24.934 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -32.960 -26.849 25.309 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -32.016 -25.536 24.596 1.00 0.00 H new ATOM 250 N ASP A 17 -27.365 -25.488 23.592 1.00 0.00 N ATOM 251 CA ASP A 17 -25.981 -25.100 23.410 1.00 0.00 C ATOM 252 C ASP A 17 -25.650 -24.924 21.925 1.00 0.00 C ATOM 253 O ASP A 17 -24.740 -24.165 21.595 1.00 0.00 O ATOM 254 CB ASP A 17 -25.075 -26.145 24.068 1.00 0.00 C ATOM 255 CG ASP A 17 -25.543 -26.527 25.471 1.00 0.00 C ATOM 256 OD1 ASP A 17 -26.010 -27.649 25.661 1.00 0.00 O ATOM 257 OD2 ASP A 17 -25.437 -25.561 26.426 1.00 0.00 O ATOM 0 H ASP A 17 -27.457 -26.425 23.983 1.00 0.00 H new ATOM 0 HA ASP A 17 -25.811 -24.136 23.888 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -25.043 -27.038 23.444 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -24.058 -25.757 24.121 1.00 0.00 H new ATOM 263 N TRP A 18 -26.395 -25.592 21.028 1.00 0.00 N ATOM 264 CA TRP A 18 -26.231 -25.405 19.593 1.00 0.00 C ATOM 265 C TRP A 18 -26.471 -23.959 19.224 1.00 0.00 C ATOM 266 O TRP A 18 -25.806 -23.401 18.364 1.00 0.00 O ATOM 267 CB TRP A 18 -27.245 -26.222 18.789 1.00 0.00 C ATOM 268 CG TRP A 18 -27.200 -26.037 17.300 1.00 0.00 C ATOM 269 CD1 TRP A 18 -28.237 -25.699 16.500 1.00 0.00 C ATOM 270 CD2 TRP A 18 -26.031 -26.020 16.442 1.00 0.00 C ATOM 271 NE1 TRP A 18 -27.795 -25.521 15.203 1.00 0.00 N ATOM 272 CE2 TRP A 18 -26.426 -25.685 15.118 1.00 0.00 C ATOM 273 CE3 TRP A 18 -24.664 -26.217 16.679 1.00 0.00 C ATOM 274 CZ2 TRP A 18 -25.498 -25.567 14.072 1.00 0.00 C ATOM 275 CZ3 TRP A 18 -23.717 -26.092 15.646 1.00 0.00 C ATOM 276 CH2 TRP A 18 -24.134 -25.771 14.342 1.00 0.00 C ATOM 0 H TRP A 18 -27.117 -26.267 21.282 1.00 0.00 H new ATOM 0 HA TRP A 18 -25.216 -25.725 19.358 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -27.089 -27.278 19.010 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -28.246 -25.968 19.138 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -29.260 -25.585 16.827 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -28.400 -25.298 14.413 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -24.331 -26.470 17.675 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -25.828 -25.323 13.073 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -22.668 -26.243 15.855 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -23.407 -25.681 13.549 1.00 0.00 H new ATOM 287 N THR A 19 -27.482 -23.392 19.862 1.00 0.00 N ATOM 288 CA THR A 19 -27.895 -22.015 19.640 1.00 0.00 C ATOM 289 C THR A 19 -26.749 -21.052 19.934 1.00 0.00 C ATOM 290 O THR A 19 -26.500 -20.128 19.164 1.00 0.00 O ATOM 291 CB THR A 19 -29.088 -21.658 20.519 1.00 0.00 C ATOM 292 OG1 THR A 19 -29.990 -22.738 20.638 1.00 0.00 O ATOM 293 CG2 THR A 19 -29.827 -20.428 19.989 1.00 0.00 C ATOM 0 H THR A 19 -28.046 -23.881 20.557 1.00 0.00 H new ATOM 0 HA THR A 19 -28.182 -21.923 18.592 1.00 0.00 H new ATOM 0 HB THR A 19 -28.689 -21.428 21.507 1.00 0.00 H new ATOM 0 HG1 THR A 19 -29.731 -23.299 21.399 1.00 0.00 H new ATOM 0 HG21 THR A 19 -30.672 -20.202 20.640 1.00 0.00 H new ATOM 0 HG22 THR A 19 -29.147 -19.576 19.968 1.00 0.00 H new ATOM 0 HG23 THR A 19 -30.190 -20.628 18.981 1.00 0.00 H new ATOM 301 N LEU A 20 -26.054 -21.273 21.055 1.00 0.00 N ATOM 302 CA LEU A 20 -24.876 -20.485 21.381 1.00 0.00 C ATOM 303 C LEU A 20 -23.844 -20.657 20.287 1.00 0.00 C ATOM 304 O LEU A 20 -23.330 -19.667 19.792 1.00 0.00 O ATOM 305 CB LEU A 20 -24.219 -20.881 22.702 1.00 0.00 C ATOM 306 CG LEU A 20 -25.066 -20.677 23.958 1.00 0.00 C ATOM 307 CD1 LEU A 20 -24.072 -20.572 25.118 1.00 0.00 C ATOM 308 CD2 LEU A 20 -25.936 -19.414 23.929 1.00 0.00 C ATOM 0 H LEU A 20 -26.290 -21.988 21.743 1.00 0.00 H new ATOM 0 HA LEU A 20 -25.216 -19.454 21.474 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -23.937 -21.932 22.644 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -23.297 -20.310 22.812 1.00 0.00 H new ATOM 0 HG LEU A 20 -25.764 -21.509 24.049 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -24.616 -20.424 26.051 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -23.487 -21.490 25.180 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -23.404 -19.727 24.950 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -26.505 -19.343 24.856 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -25.299 -18.536 23.826 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -26.623 -19.465 23.084 1.00 0.00 H new ATOM 320 N GLU A 21 -23.553 -21.902 19.905 1.00 0.00 N ATOM 321 CA GLU A 21 -22.612 -22.193 18.836 1.00 0.00 C ATOM 322 C GLU A 21 -22.996 -21.486 17.542 1.00 0.00 C ATOM 323 O GLU A 21 -22.131 -21.026 16.803 1.00 0.00 O ATOM 324 CB GLU A 21 -22.557 -23.701 18.608 1.00 0.00 C ATOM 325 CG GLU A 21 -21.825 -24.425 19.734 1.00 0.00 C ATOM 326 CD GLU A 21 -21.826 -25.933 19.499 1.00 0.00 C ATOM 327 OE1 GLU A 21 -22.559 -26.655 20.175 1.00 0.00 O ATOM 328 OE2 GLU A 21 -20.993 -26.382 18.517 1.00 0.00 O ATOM 0 H GLU A 21 -23.966 -22.732 20.331 1.00 0.00 H new ATOM 0 HA GLU A 21 -21.631 -21.825 19.135 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -23.571 -24.092 18.525 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -22.058 -23.906 17.661 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -20.799 -24.063 19.799 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -22.303 -24.201 20.688 1.00 0.00 H new ATOM 336 N LEU A 22 -24.298 -21.394 17.279 1.00 0.00 N ATOM 337 CA LEU A 22 -24.842 -20.755 16.111 1.00 0.00 C ATOM 338 C LEU A 22 -24.638 -19.241 16.180 1.00 0.00 C ATOM 339 O LEU A 22 -24.329 -18.613 15.170 1.00 0.00 O ATOM 340 CB LEU A 22 -26.314 -21.186 16.008 1.00 0.00 C ATOM 341 CG LEU A 22 -26.885 -20.909 14.625 1.00 0.00 C ATOM 342 CD1 LEU A 22 -27.819 -22.044 14.188 1.00 0.00 C ATOM 343 CD2 LEU A 22 -27.640 -19.576 14.575 1.00 0.00 C ATOM 0 H LEU A 22 -25.013 -21.777 17.898 1.00 0.00 H new ATOM 0 HA LEU A 22 -24.328 -21.061 15.200 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -26.398 -22.250 16.230 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -26.902 -20.656 16.757 1.00 0.00 H new ATOM 0 HG LEU A 22 -26.041 -20.848 13.938 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -28.217 -21.827 13.197 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -27.264 -22.981 14.159 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -28.642 -22.132 14.898 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -28.031 -19.417 13.570 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -28.465 -19.598 15.287 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -26.961 -18.763 14.833 1.00 0.00 H new ATOM 355 N LEU A 23 -24.770 -18.668 17.380 1.00 0.00 N ATOM 356 CA LEU A 23 -24.549 -17.250 17.638 1.00 0.00 C ATOM 357 C LEU A 23 -23.054 -16.932 17.583 1.00 0.00 C ATOM 358 O LEU A 23 -22.658 -15.871 17.109 1.00 0.00 O ATOM 359 CB LEU A 23 -25.188 -16.882 18.984 1.00 0.00 C ATOM 360 CG LEU A 23 -25.061 -15.392 19.350 1.00 0.00 C ATOM 361 CD1 LEU A 23 -26.310 -14.942 20.117 1.00 0.00 C ATOM 362 CD2 LEU A 23 -23.832 -15.121 20.230 1.00 0.00 C ATOM 0 H LEU A 23 -25.039 -19.191 18.213 1.00 0.00 H new ATOM 0 HA LEU A 23 -25.024 -16.642 16.868 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -26.244 -17.151 18.959 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -24.726 -17.479 19.770 1.00 0.00 H new ATOM 0 HG LEU A 23 -24.953 -14.837 18.418 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -26.218 -13.887 20.375 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -27.192 -15.087 19.493 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -26.409 -15.531 21.029 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -23.780 -14.058 20.465 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -23.913 -15.693 21.154 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -22.930 -15.419 19.696 1.00 0.00 H new ATOM 374 N GLU A 24 -22.228 -17.866 18.058 1.00 0.00 N ATOM 375 CA GLU A 24 -20.782 -17.797 18.059 1.00 0.00 C ATOM 376 C GLU A 24 -20.269 -17.829 16.618 1.00 0.00 C ATOM 377 O GLU A 24 -19.365 -17.076 16.266 1.00 0.00 O ATOM 378 CB GLU A 24 -20.267 -18.965 18.900 1.00 0.00 C ATOM 379 CG GLU A 24 -20.424 -18.688 20.399 1.00 0.00 C ATOM 380 CD GLU A 24 -19.459 -17.634 20.944 1.00 0.00 C ATOM 381 OE1 GLU A 24 -18.504 -17.264 20.265 1.00 0.00 O ATOM 382 OE2 GLU A 24 -19.744 -17.164 22.192 1.00 0.00 O ATOM 0 H GLU A 24 -22.576 -18.731 18.471 1.00 0.00 H new ATOM 0 HA GLU A 24 -20.417 -16.868 18.497 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -20.811 -19.872 18.637 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -19.217 -19.146 18.670 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -21.446 -18.363 20.592 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -20.276 -19.619 20.947 1.00 0.00 H new ATOM 390 N GLU A 25 -20.872 -18.679 15.779 1.00 0.00 N ATOM 391 CA GLU A 25 -20.588 -18.760 14.355 1.00 0.00 C ATOM 392 C GLU A 25 -20.982 -17.448 13.670 1.00 0.00 C ATOM 393 O GLU A 25 -20.222 -16.929 12.855 1.00 0.00 O ATOM 394 CB GLU A 25 -21.326 -19.964 13.761 1.00 0.00 C ATOM 395 CG GLU A 25 -20.949 -20.215 12.303 1.00 0.00 C ATOM 396 CD GLU A 25 -21.733 -21.390 11.726 1.00 0.00 C ATOM 397 OE1 GLU A 25 -22.599 -21.182 10.879 1.00 0.00 O ATOM 398 OE2 GLU A 25 -21.405 -22.622 12.209 1.00 0.00 O ATOM 0 H GLU A 25 -21.585 -19.341 16.085 1.00 0.00 H new ATOM 0 HA GLU A 25 -19.520 -18.904 14.190 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -21.100 -20.853 14.350 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -22.401 -19.799 13.833 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -21.145 -19.319 11.714 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -19.880 -20.416 12.230 1.00 0.00 H new ATOM 406 N LEU A 26 -22.154 -16.901 14.021 1.00 0.00 N ATOM 407 CA LEU A 26 -22.631 -15.625 13.523 1.00 0.00 C ATOM 408 C LEU A 26 -21.613 -14.531 13.863 1.00 0.00 C ATOM 409 O LEU A 26 -21.246 -13.747 12.995 1.00 0.00 O ATOM 410 CB LEU A 26 -24.023 -15.338 14.117 1.00 0.00 C ATOM 411 CG LEU A 26 -24.959 -14.519 13.218 1.00 0.00 C ATOM 412 CD1 LEU A 26 -24.289 -13.240 12.723 1.00 0.00 C ATOM 413 CD2 LEU A 26 -25.489 -15.338 12.034 1.00 0.00 C ATOM 0 H LEU A 26 -22.800 -17.349 14.671 1.00 0.00 H new ATOM 0 HA LEU A 26 -22.733 -15.648 12.438 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -24.505 -16.288 14.347 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -23.896 -14.808 15.061 1.00 0.00 H new ATOM 0 HG LEU A 26 -25.812 -14.241 13.837 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -24.983 -12.687 12.090 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -24.007 -12.623 13.576 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -23.398 -13.495 12.149 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -26.147 -14.716 11.427 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -24.652 -15.682 11.426 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -26.045 -16.198 12.407 1.00 0.00 H new ATOM 425 N LYS A 27 -21.124 -14.500 15.109 1.00 0.00 N ATOM 426 CA LYS A 27 -20.116 -13.547 15.552 1.00 0.00 C ATOM 427 C LYS A 27 -18.818 -13.706 14.758 1.00 0.00 C ATOM 428 O LYS A 27 -18.254 -12.712 14.311 1.00 0.00 O ATOM 429 CB LYS A 27 -19.888 -13.700 17.063 1.00 0.00 C ATOM 430 CG LYS A 27 -18.754 -12.856 17.652 1.00 0.00 C ATOM 431 CD LYS A 27 -18.864 -11.367 17.340 1.00 0.00 C ATOM 432 CE LYS A 27 -20.104 -10.718 17.960 1.00 0.00 C ATOM 433 NZ LYS A 27 -20.140 -9.269 17.696 1.00 0.00 N ATOM 0 H LYS A 27 -21.424 -15.145 15.840 1.00 0.00 H new ATOM 0 HA LYS A 27 -20.475 -12.535 15.363 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -20.813 -13.443 17.579 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -19.684 -14.749 17.277 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -18.739 -12.990 18.734 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -17.803 -13.227 17.271 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -17.972 -10.858 17.706 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -18.890 -11.228 16.259 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -21.002 -11.186 17.556 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -20.109 -10.894 19.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -20.992 -8.858 18.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -19.294 -8.821 18.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -20.159 -9.104 16.669 1.00 0.00 H new ATOM 447 N ASN A 28 -18.351 -14.946 14.581 1.00 0.00 N ATOM 448 CA ASN A 28 -17.122 -15.264 13.863 1.00 0.00 C ATOM 449 C ASN A 28 -17.175 -14.693 12.450 1.00 0.00 C ATOM 450 O ASN A 28 -16.251 -14.026 11.991 1.00 0.00 O ATOM 451 CB ASN A 28 -16.952 -16.783 13.807 1.00 0.00 C ATOM 452 CG ASN A 28 -15.579 -17.238 13.352 1.00 0.00 C ATOM 453 OD1 ASN A 28 -14.686 -16.443 13.069 1.00 0.00 O ATOM 454 ND2 ASN A 28 -15.424 -18.557 13.290 1.00 0.00 N ATOM 0 H ASN A 28 -18.830 -15.771 14.942 1.00 0.00 H new ATOM 0 HA ASN A 28 -16.274 -14.820 14.384 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -17.150 -17.196 14.796 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -17.702 -17.197 13.132 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -14.531 -18.952 12.996 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -16.198 -19.174 13.536 1.00 0.00 H new ATOM 461 N GLU A 29 -18.294 -14.960 11.778 1.00 0.00 N ATOM 462 CA GLU A 29 -18.563 -14.481 10.433 1.00 0.00 C ATOM 463 C GLU A 29 -18.592 -12.961 10.414 1.00 0.00 C ATOM 464 O GLU A 29 -17.873 -12.334 9.644 1.00 0.00 O ATOM 465 CB GLU A 29 -19.900 -15.051 9.958 1.00 0.00 C ATOM 466 CG GLU A 29 -20.189 -14.699 8.494 1.00 0.00 C ATOM 467 CD GLU A 29 -21.492 -15.337 8.024 1.00 0.00 C ATOM 468 OE1 GLU A 29 -21.463 -16.206 7.157 1.00 0.00 O ATOM 469 OE2 GLU A 29 -22.629 -14.881 8.624 1.00 0.00 O ATOM 0 H GLU A 29 -19.049 -15.526 12.165 1.00 0.00 H new ATOM 0 HA GLU A 29 -17.772 -14.813 9.760 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -19.894 -16.135 10.076 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -20.702 -14.666 10.588 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -20.249 -13.616 8.382 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -19.366 -15.039 7.865 1.00 0.00 H new ATOM 477 N ALA A 30 -19.443 -12.391 11.267 1.00 0.00 N ATOM 478 CA ALA A 30 -19.705 -10.963 11.339 1.00 0.00 C ATOM 479 C ALA A 30 -18.431 -10.156 11.587 1.00 0.00 C ATOM 480 O ALA A 30 -18.249 -9.107 10.975 1.00 0.00 O ATOM 481 CB ALA A 30 -20.745 -10.679 12.426 1.00 0.00 C ATOM 0 H ALA A 30 -19.982 -12.930 11.944 1.00 0.00 H new ATOM 0 HA ALA A 30 -20.098 -10.647 10.373 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -20.937 -9.607 12.475 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -21.671 -11.203 12.189 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -20.369 -11.024 13.389 1.00 0.00 H new ATOM 487 N VAL A 31 -17.554 -10.634 12.480 1.00 0.00 N ATOM 488 CA VAL A 31 -16.340 -9.911 12.841 1.00 0.00 C ATOM 489 C VAL A 31 -15.304 -10.020 11.717 1.00 0.00 C ATOM 490 O VAL A 31 -14.614 -9.046 11.425 1.00 0.00 O ATOM 491 CB VAL A 31 -15.828 -10.345 14.229 1.00 0.00 C ATOM 492 CG1 VAL A 31 -15.091 -11.688 14.232 1.00 0.00 C ATOM 493 CG2 VAL A 31 -14.913 -9.272 14.827 1.00 0.00 C ATOM 0 H VAL A 31 -17.669 -11.524 12.965 1.00 0.00 H new ATOM 0 HA VAL A 31 -16.560 -8.848 12.942 1.00 0.00 H new ATOM 0 HB VAL A 31 -16.723 -10.471 14.838 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -14.763 -11.921 15.245 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -15.761 -12.472 13.878 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.224 -11.628 13.575 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -14.562 -9.597 15.806 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -14.058 -9.115 14.169 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -15.467 -8.339 14.932 1.00 0.00 H new ATOM 503 N ARG A 32 -15.227 -11.184 11.056 1.00 0.00 N ATOM 504 CA ARG A 32 -14.369 -11.396 9.896 1.00 0.00 C ATOM 505 C ARG A 32 -14.803 -10.465 8.756 1.00 0.00 C ATOM 506 O ARG A 32 -13.978 -9.823 8.114 1.00 0.00 O ATOM 507 CB ARG A 32 -14.444 -12.871 9.472 1.00 0.00 C ATOM 508 CG ARG A 32 -13.185 -13.398 8.776 1.00 0.00 C ATOM 509 CD ARG A 32 -12.779 -12.544 7.574 1.00 0.00 C ATOM 510 NE ARG A 32 -11.828 -13.248 6.703 1.00 0.00 N ATOM 511 CZ ARG A 32 -10.511 -13.385 6.935 1.00 0.00 C ATOM 512 NH1 ARG A 32 -9.946 -12.872 8.037 1.00 0.00 N ATOM 513 NH2 ARG A 32 -9.751 -14.045 6.050 1.00 0.00 N ATOM 0 H ARG A 32 -15.766 -12.009 11.319 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.334 -11.162 10.147 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -14.637 -13.480 10.355 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -15.295 -13.001 8.803 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -12.363 -13.426 9.492 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.357 -14.423 8.448 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -13.667 -12.276 7.002 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -12.332 -11.613 7.923 1.00 0.00 H new ATOM 0 HE ARG A 32 -12.198 -13.668 5.850 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -10.517 -12.368 8.716 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -8.945 -12.985 8.197 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -10.173 -14.438 5.209 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.751 -14.154 6.218 1.00 0.00 H new ATOM 527 N HIS A 33 -16.117 -10.397 8.530 1.00 0.00 N ATOM 528 CA HIS A 33 -16.791 -9.566 7.541 1.00 0.00 C ATOM 529 C HIS A 33 -16.680 -8.072 7.840 1.00 0.00 C ATOM 530 O HIS A 33 -16.907 -7.248 6.953 1.00 0.00 O ATOM 531 CB HIS A 33 -18.261 -9.963 7.539 1.00 0.00 C ATOM 532 CG HIS A 33 -19.101 -9.248 6.521 1.00 0.00 C ATOM 533 ND1 HIS A 33 -18.766 -9.193 5.168 1.00 0.00 N ATOM 534 CD2 HIS A 33 -20.246 -8.537 6.731 1.00 0.00 C ATOM 535 CE1 HIS A 33 -19.731 -8.452 4.616 1.00 0.00 C ATOM 536 NE2 HIS A 33 -20.644 -8.038 5.511 1.00 0.00 N ATOM 0 H HIS A 33 -16.777 -10.958 9.069 1.00 0.00 H new ATOM 0 HA HIS A 33 -16.315 -9.729 6.574 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -18.334 -11.036 7.361 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -18.676 -9.775 8.529 1.00 0.00 H new ATOM 0 HD1 HIS A 33 -17.965 -9.622 4.705 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -20.747 -8.393 7.677 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -19.773 -8.212 3.564 1.00 0.00 H new ATOM 544 N PHE A 34 -16.294 -7.715 9.073 1.00 0.00 N ATOM 545 CA PHE A 34 -16.227 -6.321 9.521 1.00 0.00 C ATOM 546 C PHE A 34 -15.301 -5.248 8.905 1.00 0.00 C ATOM 547 O PHE A 34 -15.646 -4.068 8.924 1.00 0.00 O ATOM 548 CB PHE A 34 -16.261 -6.245 11.052 1.00 0.00 C ATOM 549 CG PHE A 34 -16.727 -4.913 11.602 1.00 0.00 C ATOM 550 CD1 PHE A 34 -18.073 -4.530 11.452 1.00 0.00 C ATOM 551 CD2 PHE A 34 -15.812 -4.030 12.206 1.00 0.00 C ATOM 552 CE1 PHE A 34 -18.504 -3.273 11.909 1.00 0.00 C ATOM 553 CE2 PHE A 34 -16.245 -2.774 12.665 1.00 0.00 C ATOM 554 CZ PHE A 34 -17.590 -2.395 12.517 1.00 0.00 C ATOM 0 H PHE A 34 -16.019 -8.388 9.788 1.00 0.00 H new ATOM 0 HA PHE A 34 -17.129 -5.969 9.021 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -16.918 -7.029 11.428 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.263 -6.454 11.436 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -18.776 -5.204 10.985 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -14.777 -4.318 12.317 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -19.537 -2.982 11.793 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -15.543 -2.099 13.132 1.00 0.00 H new ATOM 0 HZ PHE A 34 -17.921 -1.430 12.870 1.00 0.00 H new ATOM 564 N PRO A 35 -14.159 -5.615 8.341 1.00 0.00 N ATOM 565 CA PRO A 35 -13.225 -4.783 7.624 1.00 0.00 C ATOM 566 C PRO A 35 -13.639 -4.666 6.144 1.00 0.00 C ATOM 567 O PRO A 35 -13.044 -3.875 5.414 1.00 0.00 O ATOM 568 CB PRO A 35 -11.904 -5.534 7.799 1.00 0.00 C ATOM 569 CG PRO A 35 -12.303 -7.010 7.854 1.00 0.00 C ATOM 570 CD PRO A 35 -13.758 -6.971 8.311 1.00 0.00 C ATOM 0 HA PRO A 35 -13.170 -3.756 7.985 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -11.224 -5.338 6.970 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -11.392 -5.228 8.711 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -12.201 -7.489 6.880 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -11.678 -7.569 8.551 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.389 -7.542 7.630 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -13.862 -7.423 9.297 1.00 0.00 H new ATOM 578 N ARG A 36 -14.646 -5.441 5.701 1.00 0.00 N ATOM 579 CA ARG A 36 -15.158 -5.464 4.340 1.00 0.00 C ATOM 580 C ARG A 36 -16.447 -4.646 4.276 1.00 0.00 C ATOM 581 O ARG A 36 -16.457 -3.607 3.618 1.00 0.00 O ATOM 582 CB ARG A 36 -15.371 -6.922 3.895 1.00 0.00 C ATOM 583 CG ARG A 36 -16.080 -7.106 2.548 1.00 0.00 C ATOM 584 CD ARG A 36 -15.315 -6.481 1.385 1.00 0.00 C ATOM 585 NE ARG A 36 -15.609 -5.048 1.236 1.00 0.00 N ATOM 586 CZ ARG A 36 -15.151 -4.256 0.253 1.00 0.00 C ATOM 587 NH1 ARG A 36 -14.378 -4.752 -0.723 1.00 0.00 N ATOM 588 NH2 ARG A 36 -15.475 -2.956 0.255 1.00 0.00 N ATOM 0 H ARG A 36 -15.137 -6.090 6.315 1.00 0.00 H new ATOM 0 HA ARG A 36 -14.442 -5.014 3.652 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -14.399 -7.413 3.844 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -15.949 -7.437 4.663 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -16.216 -8.170 2.357 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -17.074 -6.663 2.603 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -14.245 -6.617 1.541 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -15.571 -7.001 0.462 1.00 0.00 H new ATOM 0 HE ARG A 36 -16.212 -4.619 1.939 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -14.131 -5.742 -0.725 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -14.037 -4.140 -1.464 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -16.063 -2.578 0.998 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -15.133 -2.344 -0.486 1.00 0.00 H new ATOM 602 N ILE A 37 -17.511 -5.151 4.924 1.00 0.00 N ATOM 603 CA ILE A 37 -18.881 -4.663 4.954 1.00 0.00 C ATOM 604 C ILE A 37 -19.125 -3.383 4.180 1.00 0.00 C ATOM 605 O ILE A 37 -18.926 -2.254 4.624 1.00 0.00 O ATOM 606 CB ILE A 37 -19.482 -4.638 6.344 1.00 0.00 C ATOM 607 CG1 ILE A 37 -20.913 -4.094 6.302 1.00 0.00 C ATOM 608 CG2 ILE A 37 -18.617 -3.916 7.379 1.00 0.00 C ATOM 609 CD1 ILE A 37 -21.851 -4.925 7.167 1.00 0.00 C ATOM 0 H ILE A 37 -17.412 -5.993 5.492 1.00 0.00 H new ATOM 0 HA ILE A 37 -19.434 -5.420 4.398 1.00 0.00 H new ATOM 0 HB ILE A 37 -19.517 -5.672 6.687 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -20.920 -3.060 6.645 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -21.272 -4.091 5.273 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -19.114 -3.940 8.349 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -17.650 -4.412 7.454 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -18.471 -2.880 7.072 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -22.858 -4.511 7.114 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -21.862 -5.954 6.807 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -21.505 -4.906 8.201 1.00 0.00 H new ATOM 621 N TRP A 38 -19.613 -3.676 2.991 1.00 0.00 N ATOM 622 CA TRP A 38 -20.077 -2.758 1.981 1.00 0.00 C ATOM 623 C TRP A 38 -21.219 -3.398 1.202 1.00 0.00 C ATOM 624 O TRP A 38 -22.373 -3.101 1.489 1.00 0.00 O ATOM 625 CB TRP A 38 -18.908 -2.380 1.082 1.00 0.00 C ATOM 626 CG TRP A 38 -19.159 -1.200 0.205 1.00 0.00 C ATOM 627 CD1 TRP A 38 -19.481 0.053 0.588 1.00 0.00 C ATOM 628 CD2 TRP A 38 -19.186 -1.185 -1.237 1.00 0.00 C ATOM 629 NE1 TRP A 38 -19.665 0.852 -0.527 1.00 0.00 N ATOM 630 CE2 TRP A 38 -19.498 0.125 -1.691 1.00 0.00 C ATOM 631 CE3 TRP A 38 -18.991 -2.185 -2.196 1.00 0.00 C ATOM 632 CZ2 TRP A 38 -19.591 0.430 -3.058 1.00 0.00 C ATOM 633 CZ3 TRP A 38 -19.087 -1.901 -3.570 1.00 0.00 C ATOM 634 CH2 TRP A 38 -19.382 -0.592 -4.001 1.00 0.00 C ATOM 0 H TRP A 38 -19.700 -4.645 2.685 1.00 0.00 H new ATOM 0 HA TRP A 38 -20.461 -1.844 2.434 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -18.038 -2.175 1.706 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -18.656 -3.236 0.455 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -19.580 0.383 1.612 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -19.894 1.846 -0.494 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -18.763 -3.191 -1.876 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -19.820 1.435 -3.381 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -18.935 -2.687 -4.295 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -19.448 -0.374 -5.057 1.00 0.00 H new ATOM 645 N LEU A 39 -20.884 -4.288 0.255 1.00 0.00 N ATOM 646 CA LEU A 39 -21.779 -5.044 -0.617 1.00 0.00 C ATOM 647 C LEU A 39 -23.047 -5.515 0.099 1.00 0.00 C ATOM 648 O LEU A 39 -24.143 -5.414 -0.449 1.00 0.00 O ATOM 649 CB LEU A 39 -21.020 -6.196 -1.300 1.00 0.00 C ATOM 650 CG LEU A 39 -20.539 -7.362 -0.411 1.00 0.00 C ATOM 651 CD1 LEU A 39 -19.951 -8.449 -1.319 1.00 0.00 C ATOM 652 CD2 LEU A 39 -19.466 -6.959 0.612 1.00 0.00 C ATOM 0 H LEU A 39 -19.906 -4.510 0.070 1.00 0.00 H new ATOM 0 HA LEU A 39 -22.127 -4.368 -1.397 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -21.664 -6.609 -2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -20.149 -5.774 -1.801 1.00 0.00 H new ATOM 0 HG LEU A 39 -21.404 -7.709 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -19.604 -9.284 -0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -20.717 -8.798 -2.011 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -19.113 -8.038 -1.882 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -19.178 -7.831 1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -18.593 -6.569 0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -19.865 -6.191 1.274 1.00 0.00 H new ATOM 664 N HIS A 40 -22.870 -5.988 1.337 1.00 0.00 N ATOM 665 CA HIS A 40 -23.902 -6.387 2.279 1.00 0.00 C ATOM 666 C HIS A 40 -25.076 -5.402 2.283 1.00 0.00 C ATOM 667 O HIS A 40 -26.216 -5.785 2.028 1.00 0.00 O ATOM 668 CB HIS A 40 -23.235 -6.454 3.656 1.00 0.00 C ATOM 669 CG HIS A 40 -24.181 -6.775 4.781 1.00 0.00 C ATOM 670 ND1 HIS A 40 -24.833 -5.763 5.486 1.00 0.00 N ATOM 671 CD2 HIS A 40 -24.553 -7.989 5.295 1.00 0.00 C ATOM 672 CE1 HIS A 40 -25.578 -6.405 6.390 1.00 0.00 C ATOM 673 NE2 HIS A 40 -25.445 -7.740 6.318 1.00 0.00 N ATOM 0 H HIS A 40 -21.935 -6.107 1.727 1.00 0.00 H new ATOM 0 HA HIS A 40 -24.322 -7.353 1.999 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -22.448 -7.208 3.631 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -22.754 -5.498 3.862 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -24.212 -8.958 4.962 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -26.218 -5.905 7.102 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -25.911 -8.433 6.904 1.00 0.00 H new ATOM 681 N SER A 41 -24.779 -4.134 2.584 1.00 0.00 N ATOM 682 CA SER A 41 -25.740 -3.062 2.741 1.00 0.00 C ATOM 683 C SER A 41 -25.956 -2.303 1.432 1.00 0.00 C ATOM 684 O SER A 41 -27.064 -1.843 1.180 1.00 0.00 O ATOM 685 CB SER A 41 -25.244 -2.132 3.847 1.00 0.00 C ATOM 686 OG SER A 41 -25.248 -2.804 5.092 1.00 0.00 O ATOM 0 H SER A 41 -23.818 -3.824 2.729 1.00 0.00 H new ATOM 0 HA SER A 41 -26.708 -3.479 3.016 1.00 0.00 H new ATOM 0 HB2 SER A 41 -24.236 -1.786 3.616 1.00 0.00 H new ATOM 0 HB3 SER A 41 -25.880 -1.248 3.901 1.00 0.00 H new ATOM 0 HG SER A 41 -25.108 -3.763 4.947 1.00 0.00 H new ATOM 692 N LEU A 42 -24.915 -2.165 0.604 1.00 0.00 N ATOM 693 CA LEU A 42 -24.936 -1.498 -0.681 1.00 0.00 C ATOM 694 C LEU A 42 -25.996 -2.120 -1.589 1.00 0.00 C ATOM 695 O LEU A 42 -26.841 -1.420 -2.142 1.00 0.00 O ATOM 696 CB LEU A 42 -23.523 -1.660 -1.246 1.00 0.00 C ATOM 697 CG LEU A 42 -23.080 -0.717 -2.354 1.00 0.00 C ATOM 698 CD1 LEU A 42 -23.782 -0.960 -3.692 1.00 0.00 C ATOM 699 CD2 LEU A 42 -23.134 0.756 -1.941 1.00 0.00 C ATOM 0 H LEU A 42 -23.994 -2.538 0.833 1.00 0.00 H new ATOM 0 HA LEU A 42 -25.200 -0.444 -0.599 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -22.820 -1.556 -0.420 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -23.428 -2.680 -1.619 1.00 0.00 H new ATOM 0 HG LEU A 42 -22.031 -0.962 -2.520 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -23.413 -0.249 -4.431 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -23.577 -1.975 -4.031 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -24.857 -0.829 -3.568 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -22.806 1.379 -2.773 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -24.156 1.021 -1.670 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -22.478 0.918 -1.086 1.00 0.00 H new ATOM 711 N GLY A 43 -25.951 -3.448 -1.709 1.00 0.00 N ATOM 712 CA GLY A 43 -26.887 -4.230 -2.500 1.00 0.00 C ATOM 713 C GLY A 43 -28.319 -4.025 -2.017 1.00 0.00 C ATOM 714 O GLY A 43 -29.204 -3.693 -2.803 1.00 0.00 O ATOM 0 H GLY A 43 -25.243 -4.018 -1.245 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -26.809 -3.944 -3.549 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -26.627 -5.287 -2.438 1.00 0.00 H new ATOM 718 N GLN A 44 -28.524 -4.204 -0.710 1.00 0.00 N ATOM 719 CA GLN A 44 -29.810 -4.028 -0.050 1.00 0.00 C ATOM 720 C GLN A 44 -30.374 -2.629 -0.301 1.00 0.00 C ATOM 721 O GLN A 44 -31.554 -2.480 -0.608 1.00 0.00 O ATOM 722 CB GLN A 44 -29.642 -4.313 1.449 1.00 0.00 C ATOM 723 CG GLN A 44 -30.973 -4.233 2.206 1.00 0.00 C ATOM 724 CD GLN A 44 -30.794 -4.603 3.677 1.00 0.00 C ATOM 725 OE1 GLN A 44 -31.320 -5.615 4.134 1.00 0.00 O ATOM 726 NE2 GLN A 44 -30.052 -3.783 4.423 1.00 0.00 N ATOM 0 H GLN A 44 -27.780 -4.482 -0.070 1.00 0.00 H new ATOM 0 HA GLN A 44 -30.531 -4.732 -0.465 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -29.209 -5.304 1.582 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -28.939 -3.598 1.877 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -31.378 -3.224 2.129 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -31.698 -4.904 1.745 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -29.633 -2.953 4.005 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -29.904 -3.986 5.411 1.00 0.00 H new ATOM 735 N HIS A 45 -29.520 -1.611 -0.173 1.00 0.00 N ATOM 736 CA HIS A 45 -29.875 -0.210 -0.326 1.00 0.00 C ATOM 737 C HIS A 45 -30.392 0.057 -1.728 1.00 0.00 C ATOM 738 O HIS A 45 -31.490 0.574 -1.904 1.00 0.00 O ATOM 739 CB HIS A 45 -28.652 0.679 -0.077 1.00 0.00 C ATOM 740 CG HIS A 45 -28.964 2.145 -0.188 1.00 0.00 C ATOM 741 ND1 HIS A 45 -30.004 2.740 0.525 1.00 0.00 N ATOM 742 CD2 HIS A 45 -28.364 3.088 -0.973 1.00 0.00 C ATOM 743 CE1 HIS A 45 -29.998 4.016 0.129 1.00 0.00 C ATOM 744 NE2 HIS A 45 -29.041 4.274 -0.778 1.00 0.00 N ATOM 0 H HIS A 45 -28.534 -1.750 0.047 1.00 0.00 H new ATOM 0 HA HIS A 45 -30.653 0.021 0.401 1.00 0.00 H new ATOM 0 HB2 HIS A 45 -28.254 0.471 0.916 1.00 0.00 H new ATOM 0 HB3 HIS A 45 -27.871 0.423 -0.793 1.00 0.00 H new ATOM 0 HD2 HIS A 45 -27.517 2.934 -1.625 1.00 0.00 H new ATOM 0 HE1 HIS A 45 -30.688 4.760 0.498 1.00 0.00 H new ATOM 0 HE2 HIS A 45 -28.853 5.168 -1.232 1.00 0.00 H new ATOM 752 N ILE A 46 -29.564 -0.287 -2.716 1.00 0.00 N ATOM 753 CA ILE A 46 -29.828 -0.009 -4.117 1.00 0.00 C ATOM 754 C ILE A 46 -31.136 -0.660 -4.551 1.00 0.00 C ATOM 755 O ILE A 46 -32.005 -0.036 -5.156 1.00 0.00 O ATOM 756 CB ILE A 46 -28.611 -0.409 -4.991 1.00 0.00 C ATOM 757 CG1 ILE A 46 -28.401 0.692 -6.023 1.00 0.00 C ATOM 758 CG2 ILE A 46 -28.726 -1.745 -5.737 1.00 0.00 C ATOM 759 CD1 ILE A 46 -27.050 0.646 -6.743 1.00 0.00 C ATOM 0 H ILE A 46 -28.681 -0.773 -2.557 1.00 0.00 H new ATOM 0 HA ILE A 46 -29.961 1.064 -4.259 1.00 0.00 H new ATOM 0 HB ILE A 46 -27.778 -0.536 -4.299 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -29.196 0.631 -6.766 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -28.501 1.658 -5.529 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -27.818 -1.919 -6.314 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -28.859 -2.553 -5.018 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -29.583 -1.713 -6.410 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -26.991 1.467 -7.458 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -26.246 0.741 -6.014 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -26.951 -0.303 -7.271 1.00 0.00 H new ATOM 771 N TYR A 47 -31.252 -1.929 -4.176 1.00 0.00 N ATOM 772 CA TYR A 47 -32.427 -2.762 -4.369 1.00 0.00 C ATOM 773 C TYR A 47 -33.683 -2.075 -3.840 1.00 0.00 C ATOM 774 O TYR A 47 -34.674 -1.950 -4.556 1.00 0.00 O ATOM 775 CB TYR A 47 -32.198 -4.131 -3.715 1.00 0.00 C ATOM 776 CG TYR A 47 -33.406 -5.047 -3.702 1.00 0.00 C ATOM 777 CD1 TYR A 47 -33.949 -5.516 -4.913 1.00 0.00 C ATOM 778 CD2 TYR A 47 -33.976 -5.449 -2.479 1.00 0.00 C ATOM 779 CE1 TYR A 47 -35.054 -6.385 -4.901 1.00 0.00 C ATOM 780 CE2 TYR A 47 -35.071 -6.329 -2.467 1.00 0.00 C ATOM 781 CZ TYR A 47 -35.614 -6.793 -3.677 1.00 0.00 C ATOM 782 OH TYR A 47 -36.688 -7.634 -3.661 1.00 0.00 O ATOM 0 H TYR A 47 -30.493 -2.425 -3.708 1.00 0.00 H new ATOM 0 HA TYR A 47 -32.586 -2.917 -5.436 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -31.385 -4.635 -4.238 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -31.868 -3.975 -2.688 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -33.516 -5.208 -5.853 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -33.571 -5.080 -1.548 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -35.473 -6.739 -5.831 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -35.496 -6.649 -1.527 1.00 0.00 H new ATOM 0 HH TYR A 47 -36.948 -7.815 -2.734 1.00 0.00 H new ATOM 792 N GLU A 48 -33.625 -1.631 -2.585 1.00 0.00 N ATOM 793 CA GLU A 48 -34.702 -1.040 -1.852 1.00 0.00 C ATOM 794 C GLU A 48 -35.040 0.341 -2.420 1.00 0.00 C ATOM 795 O GLU A 48 -36.061 0.504 -3.086 1.00 0.00 O ATOM 796 CB GLU A 48 -34.234 -1.044 -0.392 1.00 0.00 C ATOM 797 CG GLU A 48 -35.325 -0.483 0.482 1.00 0.00 C ATOM 798 CD GLU A 48 -34.984 -0.573 1.966 1.00 0.00 C ATOM 799 OE1 GLU A 48 -34.791 0.457 2.606 1.00 0.00 O ATOM 800 OE2 GLU A 48 -34.918 -1.831 2.488 1.00 0.00 O ATOM 0 H GLU A 48 -32.767 -1.686 -2.036 1.00 0.00 H new ATOM 0 HA GLU A 48 -35.642 -1.586 -1.929 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -33.988 -2.059 -0.080 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -33.326 -0.449 -0.287 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -35.501 0.559 0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -36.253 -1.022 0.292 1.00 0.00 H new ATOM 808 N THR A 49 -34.178 1.323 -2.151 1.00 0.00 N ATOM 809 CA THR A 49 -34.283 2.692 -2.622 1.00 0.00 C ATOM 810 C THR A 49 -32.882 3.235 -2.901 1.00 0.00 C ATOM 811 O THR A 49 -32.151 3.597 -1.982 1.00 0.00 O ATOM 812 CB THR A 49 -35.019 3.582 -1.609 1.00 0.00 C ATOM 813 OG1 THR A 49 -34.422 3.516 -0.331 1.00 0.00 O ATOM 814 CG2 THR A 49 -36.508 3.256 -1.457 1.00 0.00 C ATOM 0 H THR A 49 -33.352 1.172 -1.572 1.00 0.00 H new ATOM 0 HA THR A 49 -34.868 2.702 -3.542 1.00 0.00 H new ATOM 0 HB THR A 49 -34.935 4.587 -2.022 1.00 0.00 H new ATOM 0 HG1 THR A 49 -34.577 4.358 0.146 1.00 0.00 H new ATOM 0 HG21 THR A 49 -36.955 3.928 -0.724 1.00 0.00 H new ATOM 0 HG22 THR A 49 -37.008 3.382 -2.417 1.00 0.00 H new ATOM 0 HG23 THR A 49 -36.622 2.225 -1.121 1.00 0.00 H new ATOM 822 N TYR A 50 -32.513 3.305 -4.183 1.00 0.00 N ATOM 823 CA TYR A 50 -31.192 3.750 -4.592 1.00 0.00 C ATOM 824 C TYR A 50 -31.083 5.273 -4.593 1.00 0.00 C ATOM 825 O TYR A 50 -30.190 5.827 -3.955 1.00 0.00 O ATOM 826 CB TYR A 50 -30.795 3.116 -5.928 1.00 0.00 C ATOM 827 CG TYR A 50 -31.567 3.456 -7.181 1.00 0.00 C ATOM 828 CD1 TYR A 50 -32.603 2.595 -7.586 1.00 0.00 C ATOM 829 CD2 TYR A 50 -30.966 4.307 -8.128 1.00 0.00 C ATOM 830 CE1 TYR A 50 -33.026 2.575 -8.925 1.00 0.00 C ATOM 831 CE2 TYR A 50 -31.383 4.283 -9.468 1.00 0.00 C ATOM 832 CZ TYR A 50 -32.429 3.431 -9.865 1.00 0.00 C ATOM 833 OH TYR A 50 -32.854 3.424 -11.161 1.00 0.00 O ATOM 0 H TYR A 50 -33.125 3.054 -4.959 1.00 0.00 H new ATOM 0 HA TYR A 50 -30.469 3.404 -3.853 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -29.751 3.370 -6.111 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -30.842 2.034 -5.801 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -33.076 1.946 -6.864 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -30.180 4.982 -7.822 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -33.811 1.900 -9.232 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -30.900 4.919 -10.195 1.00 0.00 H new ATOM 0 HH TYR A 50 -32.337 4.076 -11.678 1.00 0.00 H new ATOM 843 N GLY A 51 -32.003 5.943 -5.294 1.00 0.00 N ATOM 844 CA GLY A 51 -32.067 7.399 -5.348 1.00 0.00 C ATOM 845 C GLY A 51 -32.973 7.959 -4.251 1.00 0.00 C ATOM 846 O GLY A 51 -32.802 9.097 -3.820 1.00 0.00 O ATOM 0 H GLY A 51 -32.729 5.482 -5.843 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -31.064 7.813 -5.240 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -32.438 7.712 -6.324 1.00 0.00 H new ATOM 850 N ASP A 52 -33.955 7.152 -3.832 1.00 0.00 N ATOM 851 CA ASP A 52 -34.995 7.467 -2.861 1.00 0.00 C ATOM 852 C ASP A 52 -35.814 8.702 -3.257 1.00 0.00 C ATOM 853 O ASP A 52 -36.413 9.344 -2.398 1.00 0.00 O ATOM 854 CB ASP A 52 -34.373 7.562 -1.456 1.00 0.00 C ATOM 855 CG ASP A 52 -35.371 7.282 -0.330 1.00 0.00 C ATOM 856 OD1 ASP A 52 -35.420 6.155 0.159 1.00 0.00 O ATOM 857 OD2 ASP A 52 -36.138 8.330 0.085 1.00 0.00 O ATOM 0 H ASP A 52 -34.045 6.201 -4.189 1.00 0.00 H new ATOM 0 HA ASP A 52 -35.723 6.656 -2.846 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -33.547 6.855 -1.384 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -33.952 8.558 -1.319 1.00 0.00 H new ATOM 863 N THR A 53 -35.864 9.021 -4.558 1.00 0.00 N ATOM 864 CA THR A 53 -36.554 10.180 -5.082 1.00 0.00 C ATOM 865 C THR A 53 -37.049 9.852 -6.489 1.00 0.00 C ATOM 866 O THR A 53 -36.376 10.165 -7.468 1.00 0.00 O ATOM 867 CB THR A 53 -35.591 11.378 -5.053 1.00 0.00 C ATOM 868 OG1 THR A 53 -35.130 11.614 -3.739 1.00 0.00 O ATOM 869 CG2 THR A 53 -36.275 12.645 -5.550 1.00 0.00 C ATOM 0 H THR A 53 -35.412 8.460 -5.281 1.00 0.00 H new ATOM 0 HA THR A 53 -37.423 10.444 -4.479 1.00 0.00 H new ATOM 0 HB THR A 53 -34.754 11.133 -5.707 1.00 0.00 H new ATOM 0 HG1 THR A 53 -34.517 12.379 -3.740 1.00 0.00 H new ATOM 0 HG21 THR A 53 -35.570 13.476 -5.518 1.00 0.00 H new ATOM 0 HG22 THR A 53 -36.615 12.497 -6.575 1.00 0.00 H new ATOM 0 HG23 THR A 53 -37.130 12.871 -4.913 1.00 0.00 H new ATOM 877 N TRP A 54 -38.213 9.188 -6.567 1.00 0.00 N ATOM 878 CA TRP A 54 -38.837 8.669 -7.790 1.00 0.00 C ATOM 879 C TRP A 54 -37.833 8.051 -8.762 1.00 0.00 C ATOM 880 O TRP A 54 -37.905 8.176 -9.982 1.00 0.00 O ATOM 881 CB TRP A 54 -39.731 9.716 -8.420 1.00 0.00 C ATOM 882 CG TRP A 54 -39.114 11.050 -8.683 1.00 0.00 C ATOM 883 CD1 TRP A 54 -38.287 11.344 -9.707 1.00 0.00 C ATOM 884 CD2 TRP A 54 -39.206 12.263 -7.882 1.00 0.00 C ATOM 885 NE1 TRP A 54 -37.890 12.663 -9.627 1.00 0.00 N ATOM 886 CE2 TRP A 54 -38.429 13.278 -8.513 1.00 0.00 C ATOM 887 CE3 TRP A 54 -39.851 12.600 -6.673 1.00 0.00 C ATOM 888 CZ2 TRP A 54 -38.316 14.571 -7.981 1.00 0.00 C ATOM 889 CZ3 TRP A 54 -39.745 13.895 -6.132 1.00 0.00 C ATOM 890 CH2 TRP A 54 -38.983 14.880 -6.785 1.00 0.00 C ATOM 0 H TRP A 54 -38.771 8.990 -5.736 1.00 0.00 H new ATOM 0 HA TRP A 54 -39.478 7.834 -7.505 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -40.105 9.321 -9.365 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -40.595 9.862 -7.771 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -37.981 10.650 -10.476 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -37.279 13.124 -10.301 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -40.435 11.853 -6.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -37.723 15.320 -8.485 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -40.252 14.134 -5.209 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -38.911 15.873 -6.367 1.00 0.00 H new ATOM 901 N THR A 55 -36.912 7.342 -8.133 1.00 0.00 N ATOM 902 CA THR A 55 -35.754 6.675 -8.676 1.00 0.00 C ATOM 903 C THR A 55 -35.563 5.419 -7.841 1.00 0.00 C ATOM 904 O THR A 55 -35.576 4.308 -8.367 1.00 0.00 O ATOM 905 CB THR A 55 -34.559 7.637 -8.641 1.00 0.00 C ATOM 906 OG1 THR A 55 -34.776 8.686 -9.560 1.00 0.00 O ATOM 907 CG2 THR A 55 -33.265 6.920 -9.006 1.00 0.00 C ATOM 0 H THR A 55 -36.969 7.209 -7.123 1.00 0.00 H new ATOM 0 HA THR A 55 -35.866 6.385 -9.721 1.00 0.00 H new ATOM 0 HB THR A 55 -34.467 8.030 -7.628 1.00 0.00 H new ATOM 0 HG1 THR A 55 -35.304 9.392 -9.132 1.00 0.00 H new ATOM 0 HG21 THR A 55 -32.436 7.627 -8.973 1.00 0.00 H new ATOM 0 HG22 THR A 55 -33.083 6.113 -8.296 1.00 0.00 H new ATOM 0 HG23 THR A 55 -33.349 6.506 -10.011 1.00 0.00 H new ATOM 915 N GLY A 56 -35.417 5.605 -6.528 1.00 0.00 N ATOM 916 CA GLY A 56 -35.363 4.480 -5.609 1.00 0.00 C ATOM 917 C GLY A 56 -36.783 4.163 -5.171 1.00 0.00 C ATOM 918 O GLY A 56 -37.094 3.012 -4.901 1.00 0.00 O ATOM 0 H GLY A 56 -35.335 6.520 -6.085 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -34.911 3.614 -6.093 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -34.743 4.722 -4.746 1.00 0.00 H new ATOM 922 N VAL A 57 -37.645 5.186 -5.091 1.00 0.00 N ATOM 923 CA VAL A 57 -39.058 5.002 -4.793 1.00 0.00 C ATOM 924 C VAL A 57 -39.661 4.116 -5.882 1.00 0.00 C ATOM 925 O VAL A 57 -40.476 3.247 -5.591 1.00 0.00 O ATOM 926 CB VAL A 57 -39.758 6.362 -4.650 1.00 0.00 C ATOM 927 CG1 VAL A 57 -41.279 6.224 -4.506 1.00 0.00 C ATOM 928 CG2 VAL A 57 -39.211 7.122 -3.436 1.00 0.00 C ATOM 0 H VAL A 57 -37.376 6.160 -5.232 1.00 0.00 H new ATOM 0 HA VAL A 57 -39.198 4.500 -3.835 1.00 0.00 H new ATOM 0 HB VAL A 57 -39.551 6.916 -5.566 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -41.726 7.213 -4.408 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -41.684 5.728 -5.388 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -41.508 5.633 -3.620 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -39.718 8.083 -3.350 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -39.385 6.538 -2.532 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -38.141 7.286 -3.562 1.00 0.00 H new ATOM 938 N GLU A 58 -39.220 4.301 -7.130 1.00 0.00 N ATOM 939 CA GLU A 58 -39.581 3.494 -8.253 1.00 0.00 C ATOM 940 C GLU A 58 -39.073 2.066 -8.083 1.00 0.00 C ATOM 941 O GLU A 58 -39.781 1.121 -8.420 1.00 0.00 O ATOM 942 CB GLU A 58 -38.987 4.176 -9.461 1.00 0.00 C ATOM 943 CG GLU A 58 -39.768 5.425 -9.868 1.00 0.00 C ATOM 944 CD GLU A 58 -41.205 5.132 -10.292 1.00 0.00 C ATOM 945 OE1 GLU A 58 -42.132 5.558 -9.606 1.00 0.00 O ATOM 946 OE2 GLU A 58 -41.356 4.396 -11.430 1.00 0.00 O ATOM 0 H GLU A 58 -38.576 5.054 -7.374 1.00 0.00 H new ATOM 0 HA GLU A 58 -40.662 3.405 -8.360 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -37.954 4.450 -9.248 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -38.966 3.476 -10.296 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -39.779 6.125 -9.033 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -39.248 5.918 -10.690 1.00 0.00 H new ATOM 954 N ALA A 59 -37.860 1.915 -7.539 1.00 0.00 N ATOM 955 CA ALA A 59 -37.298 0.601 -7.245 1.00 0.00 C ATOM 956 C ALA A 59 -38.143 -0.124 -6.198 1.00 0.00 C ATOM 957 O ALA A 59 -38.474 -1.296 -6.366 1.00 0.00 O ATOM 958 CB ALA A 59 -35.834 0.716 -6.812 1.00 0.00 C ATOM 0 H ALA A 59 -37.249 2.694 -7.294 1.00 0.00 H new ATOM 0 HA ALA A 59 -37.320 0.004 -8.157 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -35.439 -0.277 -6.599 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -35.253 1.174 -7.612 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -35.767 1.333 -5.916 1.00 0.00 H new ATOM 964 N LEU A 60 -38.525 0.598 -5.140 1.00 0.00 N ATOM 965 CA LEU A 60 -39.374 0.086 -4.072 1.00 0.00 C ATOM 966 C LEU A 60 -40.738 -0.344 -4.617 1.00 0.00 C ATOM 967 O LEU A 60 -41.240 -1.415 -4.280 1.00 0.00 O ATOM 968 CB LEU A 60 -39.500 1.143 -2.965 1.00 0.00 C ATOM 969 CG LEU A 60 -40.314 0.681 -1.745 1.00 0.00 C ATOM 970 CD1 LEU A 60 -39.676 -0.530 -1.052 1.00 0.00 C ATOM 971 CD2 LEU A 60 -40.411 1.841 -0.748 1.00 0.00 C ATOM 0 H LEU A 60 -38.246 1.570 -5.004 1.00 0.00 H new ATOM 0 HA LEU A 60 -38.916 -0.804 -3.640 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -38.501 1.429 -2.635 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -39.965 2.036 -3.382 1.00 0.00 H new ATOM 0 HG LEU A 60 -41.303 0.381 -2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -40.285 -0.822 -0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -39.616 -1.361 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -38.674 -0.269 -0.712 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -40.986 1.526 0.122 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -39.410 2.135 -0.434 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -40.906 2.688 -1.223 1.00 0.00 H new ATOM 983 N ILE A 61 -41.323 0.484 -5.485 1.00 0.00 N ATOM 984 CA ILE A 61 -42.567 0.176 -6.179 1.00 0.00 C ATOM 985 C ILE A 61 -42.398 -1.074 -7.045 1.00 0.00 C ATOM 986 O ILE A 61 -43.328 -1.869 -7.147 1.00 0.00 O ATOM 987 CB ILE A 61 -43.054 1.404 -6.974 1.00 0.00 C ATOM 988 CG1 ILE A 61 -43.565 2.521 -6.049 1.00 0.00 C ATOM 989 CG2 ILE A 61 -44.100 1.047 -8.041 1.00 0.00 C ATOM 990 CD1 ILE A 61 -44.968 2.267 -5.504 1.00 0.00 C ATOM 0 H ILE A 61 -40.938 1.397 -5.726 1.00 0.00 H new ATOM 0 HA ILE A 61 -43.346 -0.053 -5.452 1.00 0.00 H new ATOM 0 HB ILE A 61 -42.180 1.783 -7.504 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -42.874 2.634 -5.213 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -43.561 3.464 -6.595 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -44.405 1.951 -8.568 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -43.669 0.341 -8.751 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -44.969 0.595 -7.562 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -45.263 3.095 -4.860 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -45.671 2.184 -6.333 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -44.973 1.341 -4.930 1.00 0.00 H new ATOM 1002 N ARG A 62 -41.216 -1.274 -7.638 1.00 0.00 N ATOM 1003 CA ARG A 62 -40.917 -2.468 -8.419 1.00 0.00 C ATOM 1004 C ARG A 62 -40.960 -3.725 -7.545 1.00 0.00 C ATOM 1005 O ARG A 62 -41.472 -4.759 -7.966 1.00 0.00 O ATOM 1006 CB ARG A 62 -39.577 -2.339 -9.158 1.00 0.00 C ATOM 1007 CG ARG A 62 -39.656 -2.796 -10.623 1.00 0.00 C ATOM 1008 CD ARG A 62 -40.119 -4.250 -10.769 1.00 0.00 C ATOM 1009 NE ARG A 62 -40.134 -4.677 -12.173 1.00 0.00 N ATOM 1010 CZ ARG A 62 -40.773 -5.769 -12.628 1.00 0.00 C ATOM 1011 NH1 ARG A 62 -41.417 -6.591 -11.784 1.00 0.00 N ATOM 1012 NH2 ARG A 62 -40.769 -6.039 -13.940 1.00 0.00 N ATOM 0 H ARG A 62 -40.443 -0.610 -7.587 1.00 0.00 H new ATOM 0 HA ARG A 62 -41.693 -2.568 -9.178 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -39.247 -1.301 -9.124 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -38.823 -2.930 -8.638 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -40.342 -2.145 -11.165 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -38.676 -2.683 -11.087 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -39.458 -4.901 -10.198 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -41.117 -4.358 -10.345 1.00 0.00 H new ATOM 0 HE ARG A 62 -39.626 -4.107 -12.849 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -41.426 -6.390 -10.784 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -41.898 -7.416 -12.143 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -40.283 -5.418 -14.587 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -41.252 -6.866 -14.292 1.00 0.00 H new ATOM 1026 N ILE A 63 -40.442 -3.636 -6.317 1.00 0.00 N ATOM 1027 CA ILE A 63 -40.521 -4.734 -5.355 1.00 0.00 C ATOM 1028 C ILE A 63 -41.983 -5.050 -5.041 1.00 0.00 C ATOM 1029 O ILE A 63 -42.370 -6.213 -4.974 1.00 0.00 O ATOM 1030 CB ILE A 63 -39.701 -4.432 -4.086 1.00 0.00 C ATOM 1031 CG1 ILE A 63 -38.217 -4.307 -4.464 1.00 0.00 C ATOM 1032 CG2 ILE A 63 -39.895 -5.543 -3.039 1.00 0.00 C ATOM 1033 CD1 ILE A 63 -37.343 -3.829 -3.303 1.00 0.00 C ATOM 0 H ILE A 63 -39.961 -2.808 -5.966 1.00 0.00 H new ATOM 0 HA ILE A 63 -40.076 -5.624 -5.801 1.00 0.00 H new ATOM 0 HB ILE A 63 -40.046 -3.494 -3.650 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -37.853 -5.274 -4.811 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -38.117 -3.611 -5.297 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -39.308 -5.312 -2.150 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -40.949 -5.610 -2.770 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -39.565 -6.496 -3.454 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -36.306 -3.761 -3.632 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -37.684 -2.848 -2.971 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -37.416 -4.537 -2.477 1.00 0.00 H new ATOM 1045 N LEU A 64 -42.799 -4.010 -4.877 1.00 0.00 N ATOM 1046 CA LEU A 64 -44.233 -4.163 -4.676 1.00 0.00 C ATOM 1047 C LEU A 64 -44.887 -4.831 -5.890 1.00 0.00 C ATOM 1048 O LEU A 64 -45.737 -5.704 -5.742 1.00 0.00 O ATOM 1049 CB LEU A 64 -44.856 -2.800 -4.345 1.00 0.00 C ATOM 1050 CG LEU A 64 -45.987 -2.851 -3.304 1.00 0.00 C ATOM 1051 CD1 LEU A 64 -46.488 -1.424 -3.052 1.00 0.00 C ATOM 1052 CD2 LEU A 64 -47.165 -3.731 -3.739 1.00 0.00 C ATOM 0 H LEU A 64 -42.482 -3.040 -4.880 1.00 0.00 H new ATOM 0 HA LEU A 64 -44.413 -4.824 -3.828 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -44.073 -2.136 -3.979 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -45.244 -2.360 -5.263 1.00 0.00 H new ATOM 0 HG LEU A 64 -45.577 -3.295 -2.397 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -47.291 -1.445 -2.315 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -45.668 -0.811 -2.678 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -46.862 -1.000 -3.984 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -47.930 -3.726 -2.962 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -47.587 -3.342 -4.666 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -46.817 -4.752 -3.899 1.00 0.00 H new ATOM 1064 N GLN A 65 -44.465 -4.438 -7.094 1.00 0.00 N ATOM 1065 CA GLN A 65 -45.005 -4.921 -8.357 1.00 0.00 C ATOM 1066 C GLN A 65 -44.738 -6.403 -8.551 1.00 0.00 C ATOM 1067 O GLN A 65 -45.595 -7.158 -8.997 1.00 0.00 O ATOM 1068 CB GLN A 65 -44.379 -4.117 -9.492 1.00 0.00 C ATOM 1069 CG GLN A 65 -45.000 -4.484 -10.831 1.00 0.00 C ATOM 1070 CD GLN A 65 -44.391 -3.671 -11.967 1.00 0.00 C ATOM 1071 OE1 GLN A 65 -43.514 -4.154 -12.679 1.00 0.00 O ATOM 1072 NE2 GLN A 65 -44.849 -2.431 -12.136 1.00 0.00 N ATOM 0 H GLN A 65 -43.717 -3.755 -7.215 1.00 0.00 H new ATOM 0 HA GLN A 65 -46.087 -4.788 -8.352 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -44.514 -3.052 -9.305 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -43.305 -4.301 -9.523 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -44.853 -5.547 -11.023 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -46.076 -4.312 -10.794 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -45.579 -2.069 -11.522 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -44.470 -1.844 -12.879 1.00 0.00 H new ATOM 1081 N GLN A 66 -43.513 -6.784 -8.224 1.00 0.00 N ATOM 1082 CA GLN A 66 -43.037 -8.156 -8.214 1.00 0.00 C ATOM 1083 C GLN A 66 -43.950 -9.001 -7.336 1.00 0.00 C ATOM 1084 O GLN A 66 -44.397 -10.077 -7.723 1.00 0.00 O ATOM 1085 CB GLN A 66 -41.613 -8.131 -7.666 1.00 0.00 C ATOM 1086 CG GLN A 66 -40.916 -9.490 -7.594 1.00 0.00 C ATOM 1087 CD GLN A 66 -41.320 -10.301 -6.363 1.00 0.00 C ATOM 1088 OE1 GLN A 66 -41.228 -9.814 -5.239 1.00 0.00 O ATOM 1089 NE2 GLN A 66 -41.759 -11.543 -6.565 1.00 0.00 N ATOM 0 H GLN A 66 -42.794 -6.116 -7.947 1.00 0.00 H new ATOM 0 HA GLN A 66 -43.043 -8.593 -9.213 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -41.014 -7.466 -8.288 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -41.634 -7.699 -6.666 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -41.151 -10.061 -8.492 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -39.837 -9.339 -7.585 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -41.822 -11.914 -7.513 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -42.032 -12.123 -5.771 1.00 0.00 H new ATOM 1098 N LEU A 67 -44.216 -8.472 -6.145 1.00 0.00 N ATOM 1099 CA LEU A 67 -45.031 -9.119 -5.130 1.00 0.00 C ATOM 1100 C LEU A 67 -46.447 -9.350 -5.645 1.00 0.00 C ATOM 1101 O LEU A 67 -46.973 -10.460 -5.607 1.00 0.00 O ATOM 1102 CB LEU A 67 -45.055 -8.232 -3.877 1.00 0.00 C ATOM 1103 CG LEU A 67 -44.810 -9.014 -2.579 1.00 0.00 C ATOM 1104 CD1 LEU A 67 -43.341 -9.440 -2.457 1.00 0.00 C ATOM 1105 CD2 LEU A 67 -45.185 -8.139 -1.378 1.00 0.00 C ATOM 0 H LEU A 67 -43.861 -7.561 -5.856 1.00 0.00 H new ATOM 0 HA LEU A 67 -44.603 -10.091 -4.885 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -44.296 -7.455 -3.975 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -46.020 -7.729 -3.814 1.00 0.00 H new ATOM 0 HG LEU A 67 -45.428 -9.911 -2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -43.198 -9.992 -1.528 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -43.075 -10.076 -3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -42.705 -8.555 -2.455 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -45.011 -8.693 -0.456 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -44.573 -7.237 -1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -46.238 -7.864 -1.443 1.00 0.00 H new ATOM 1117 N LEU A 68 -47.044 -8.267 -6.135 1.00 0.00 N ATOM 1118 CA LEU A 68 -48.372 -8.204 -6.691 1.00 0.00 C ATOM 1119 C LEU A 68 -48.522 -9.207 -7.821 1.00 0.00 C ATOM 1120 O LEU A 68 -49.488 -9.961 -7.858 1.00 0.00 O ATOM 1121 CB LEU A 68 -48.520 -6.768 -7.171 1.00 0.00 C ATOM 1122 CG LEU A 68 -49.904 -6.302 -7.594 1.00 0.00 C ATOM 1123 CD1 LEU A 68 -50.325 -6.834 -8.966 1.00 0.00 C ATOM 1124 CD2 LEU A 68 -50.983 -6.560 -6.537 1.00 0.00 C ATOM 0 H LEU A 68 -46.576 -7.361 -6.151 1.00 0.00 H new ATOM 0 HA LEU A 68 -49.148 -8.460 -5.970 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -48.174 -6.111 -6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -47.846 -6.626 -8.016 1.00 0.00 H new ATOM 0 HG LEU A 68 -49.813 -5.220 -7.688 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -51.321 -6.465 -9.209 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -49.617 -6.492 -9.721 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -50.336 -7.924 -8.946 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -51.945 -6.203 -6.905 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -51.046 -7.629 -6.335 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -50.727 -6.031 -5.619 1.00 0.00 H new ATOM 1136 N PHE A 69 -47.539 -9.213 -8.722 1.00 0.00 N ATOM 1137 CA PHE A 69 -47.465 -10.141 -9.840 1.00 0.00 C ATOM 1138 C PHE A 69 -47.539 -11.588 -9.351 1.00 0.00 C ATOM 1139 O PHE A 69 -48.284 -12.381 -9.922 1.00 0.00 O ATOM 1140 CB PHE A 69 -46.198 -9.890 -10.667 1.00 0.00 C ATOM 1141 CG PHE A 69 -45.924 -10.971 -11.695 1.00 0.00 C ATOM 1142 CD1 PHE A 69 -46.727 -11.061 -12.846 1.00 0.00 C ATOM 1143 CD2 PHE A 69 -44.976 -11.976 -11.424 1.00 0.00 C ATOM 1144 CE1 PHE A 69 -46.564 -12.136 -13.737 1.00 0.00 C ATOM 1145 CE2 PHE A 69 -44.814 -13.052 -12.314 1.00 0.00 C ATOM 1146 CZ PHE A 69 -45.605 -13.129 -13.473 1.00 0.00 C ATOM 0 H PHE A 69 -46.758 -8.558 -8.690 1.00 0.00 H new ATOM 0 HA PHE A 69 -48.324 -9.970 -10.489 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -46.290 -8.930 -11.176 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -45.344 -9.814 -9.995 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -47.470 -10.303 -13.046 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -44.372 -11.920 -10.530 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -47.176 -12.199 -14.625 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -44.082 -13.819 -12.107 1.00 0.00 H new ATOM 0 HZ PHE A 69 -45.476 -13.951 -14.161 1.00 0.00 H new ATOM 1156 N ILE A 70 -46.791 -11.937 -8.296 1.00 0.00 N ATOM 1157 CA ILE A 70 -46.834 -13.285 -7.745 1.00 0.00 C ATOM 1158 C ILE A 70 -48.235 -13.621 -7.239 1.00 0.00 C ATOM 1159 O ILE A 70 -48.768 -14.682 -7.561 1.00 0.00 O ATOM 1160 CB ILE A 70 -45.746 -13.466 -6.683 1.00 0.00 C ATOM 1161 CG1 ILE A 70 -44.362 -13.424 -7.346 1.00 0.00 C ATOM 1162 CG2 ILE A 70 -45.924 -14.750 -5.862 1.00 0.00 C ATOM 1163 CD1 ILE A 70 -43.951 -14.644 -8.176 1.00 0.00 C ATOM 0 H ILE A 70 -46.154 -11.303 -7.814 1.00 0.00 H new ATOM 0 HA ILE A 70 -46.617 -14.003 -8.536 1.00 0.00 H new ATOM 0 HB ILE A 70 -45.836 -12.640 -5.977 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -44.322 -12.546 -7.991 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -43.616 -13.279 -6.564 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -45.124 -14.825 -5.125 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -46.887 -14.725 -5.351 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -45.888 -15.614 -6.526 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -42.954 -14.485 -8.587 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -43.945 -15.530 -7.542 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -44.661 -14.786 -8.991 1.00 0.00 H new ATOM 1175 N HIS A 71 -48.837 -12.710 -6.473 1.00 0.00 N ATOM 1176 CA HIS A 71 -50.168 -12.903 -5.905 1.00 0.00 C ATOM 1177 C HIS A 71 -51.216 -13.080 -7.005 1.00 0.00 C ATOM 1178 O HIS A 71 -52.090 -13.938 -6.906 1.00 0.00 O ATOM 1179 CB HIS A 71 -50.536 -11.726 -4.992 1.00 0.00 C ATOM 1180 CG HIS A 71 -49.512 -11.391 -3.943 1.00 0.00 C ATOM 1181 ND1 HIS A 71 -48.688 -12.367 -3.387 1.00 0.00 N ATOM 1182 CD2 HIS A 71 -49.215 -10.178 -3.379 1.00 0.00 C ATOM 1183 CE1 HIS A 71 -47.917 -11.702 -2.526 1.00 0.00 C ATOM 1184 NE2 HIS A 71 -48.192 -10.388 -2.479 1.00 0.00 N ATOM 0 H HIS A 71 -48.412 -11.815 -6.229 1.00 0.00 H new ATOM 0 HA HIS A 71 -50.153 -13.815 -5.308 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -50.702 -10.844 -5.611 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -51.481 -11.951 -4.497 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -49.693 -9.235 -3.598 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -47.150 -12.172 -1.928 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -47.736 -9.687 -1.895 1.00 0.00 H new ATOM 1192 N PHE A 72 -51.099 -12.273 -8.063 1.00 0.00 N ATOM 1193 CA PHE A 72 -51.944 -12.319 -9.244 1.00 0.00 C ATOM 1194 C PHE A 72 -51.860 -13.687 -9.901 1.00 0.00 C ATOM 1195 O PHE A 72 -52.879 -14.289 -10.227 1.00 0.00 O ATOM 1196 CB PHE A 72 -51.513 -11.236 -10.227 1.00 0.00 C ATOM 1197 CG PHE A 72 -52.472 -11.037 -11.383 1.00 0.00 C ATOM 1198 CD1 PHE A 72 -53.590 -10.197 -11.234 1.00 0.00 C ATOM 1199 CD2 PHE A 72 -52.287 -11.750 -12.583 1.00 0.00 C ATOM 1200 CE1 PHE A 72 -54.518 -10.067 -12.282 1.00 0.00 C ATOM 1201 CE2 PHE A 72 -53.217 -11.622 -13.629 1.00 0.00 C ATOM 1202 CZ PHE A 72 -54.333 -10.780 -13.479 1.00 0.00 C ATOM 0 H PHE A 72 -50.385 -11.546 -8.116 1.00 0.00 H new ATOM 0 HA PHE A 72 -52.978 -12.141 -8.947 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -51.407 -10.293 -9.690 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -50.530 -11.490 -10.623 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -53.736 -9.651 -10.314 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -51.429 -12.396 -12.700 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -55.374 -9.419 -12.167 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -53.074 -12.171 -14.548 1.00 0.00 H new ATOM 0 HZ PHE A 72 -55.047 -10.681 -14.283 1.00 0.00 H new ATOM 1212 N ARG A 73 -50.626 -14.158 -10.090 1.00 0.00 N ATOM 1213 CA ARG A 73 -50.336 -15.443 -10.708 1.00 0.00 C ATOM 1214 C ARG A 73 -51.017 -16.578 -9.948 1.00 0.00 C ATOM 1215 O ARG A 73 -51.654 -17.437 -10.551 1.00 0.00 O ATOM 1216 CB ARG A 73 -48.823 -15.675 -10.763 1.00 0.00 C ATOM 1217 CG ARG A 73 -48.453 -16.645 -11.893 1.00 0.00 C ATOM 1218 CD ARG A 73 -46.931 -16.733 -12.081 1.00 0.00 C ATOM 1219 NE ARG A 73 -46.212 -16.769 -10.800 1.00 0.00 N ATOM 1220 CZ ARG A 73 -46.410 -17.686 -9.839 1.00 0.00 C ATOM 1221 NH1 ARG A 73 -47.092 -18.810 -10.091 1.00 0.00 N ATOM 1222 NH2 ARG A 73 -45.951 -17.452 -8.607 1.00 0.00 N ATOM 0 H ARG A 73 -49.790 -13.645 -9.812 1.00 0.00 H new ATOM 0 HA ARG A 73 -50.729 -15.429 -11.725 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -48.312 -14.724 -10.914 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -48.478 -16.075 -9.809 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -48.851 -17.635 -11.670 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -48.918 -16.317 -12.823 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -46.689 -17.627 -12.656 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -46.589 -15.877 -12.663 1.00 0.00 H new ATOM 0 HE ARG A 73 -45.513 -16.046 -10.629 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -47.469 -18.979 -11.023 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -47.234 -19.497 -9.351 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -45.456 -16.584 -8.404 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -46.096 -18.141 -7.869 1.00 0.00 H new ATOM 1236 N ILE A 74 -50.871 -16.566 -8.621 1.00 0.00 N ATOM 1237 CA ILE A 74 -51.470 -17.549 -7.727 1.00 0.00 C ATOM 1238 C ILE A 74 -52.997 -17.507 -7.833 1.00 0.00 C ATOM 1239 O ILE A 74 -53.643 -18.547 -7.947 1.00 0.00 O ATOM 1240 CB ILE A 74 -50.950 -17.332 -6.294 1.00 0.00 C ATOM 1241 CG1 ILE A 74 -49.447 -17.594 -6.236 1.00 0.00 C ATOM 1242 CG2 ILE A 74 -51.708 -18.203 -5.281 1.00 0.00 C ATOM 1243 CD1 ILE A 74 -48.772 -17.097 -4.954 1.00 0.00 C ATOM 0 H ILE A 74 -50.322 -15.858 -8.133 1.00 0.00 H new ATOM 0 HA ILE A 74 -51.173 -18.555 -8.023 1.00 0.00 H new ATOM 0 HB ILE A 74 -51.131 -16.293 -6.019 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -49.272 -18.666 -6.333 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -48.973 -17.115 -7.092 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -51.314 -18.024 -4.281 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -52.768 -17.950 -5.305 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -51.580 -19.255 -5.538 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -47.706 -17.322 -4.993 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -48.912 -16.020 -4.863 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -49.217 -17.595 -4.092 1.00 0.00 H new ATOM 1255 N GLY A 75 -53.565 -16.299 -7.825 1.00 0.00 N ATOM 1256 CA GLY A 75 -54.992 -16.074 -8.003 1.00 0.00 C ATOM 1257 C GLY A 75 -55.495 -16.665 -9.321 1.00 0.00 C ATOM 1258 O GLY A 75 -56.509 -17.359 -9.341 1.00 0.00 O ATOM 0 H GLY A 75 -53.033 -15.439 -7.692 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -55.538 -16.520 -7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -55.198 -15.004 -7.981 1.00 0.00 H new ATOM 1262 N CYS A 76 -54.778 -16.394 -10.418 1.00 0.00 N ATOM 1263 CA CYS A 76 -55.128 -16.851 -11.755 1.00 0.00 C ATOM 1264 C CYS A 76 -55.030 -18.369 -11.858 1.00 0.00 C ATOM 1265 O CYS A 76 -55.905 -19.011 -12.439 1.00 0.00 O ATOM 1266 CB CYS A 76 -54.251 -16.136 -12.786 1.00 0.00 C ATOM 1267 SG CYS A 76 -54.775 -16.570 -14.464 1.00 0.00 S ATOM 0 H CYS A 76 -53.922 -15.839 -10.393 1.00 0.00 H new ATOM 0 HA CYS A 76 -56.167 -16.597 -11.965 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -54.317 -15.057 -12.644 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -53.207 -16.413 -12.640 1.00 0.00 H new ATOM 0 HG CYS A 76 -54.023 -15.954 -15.327 1.00 0.00 H new ATOM 1273 N ARG A 77 -53.978 -18.941 -11.266 1.00 0.00 N ATOM 1274 CA ARG A 77 -53.807 -20.380 -11.176 1.00 0.00 C ATOM 1275 C ARG A 77 -55.051 -20.999 -10.549 1.00 0.00 C ATOM 1276 O ARG A 77 -55.577 -21.980 -11.065 1.00 0.00 O ATOM 1277 CB ARG A 77 -52.535 -20.732 -10.411 1.00 0.00 C ATOM 1278 CG ARG A 77 -52.410 -22.222 -10.138 1.00 0.00 C ATOM 1279 CD ARG A 77 -51.085 -22.569 -9.453 1.00 0.00 C ATOM 1280 NE ARG A 77 -51.065 -23.974 -9.020 1.00 0.00 N ATOM 1281 CZ ARG A 77 -50.896 -25.038 -9.823 1.00 0.00 C ATOM 1282 NH1 ARG A 77 -50.707 -24.884 -11.142 1.00 0.00 N ATOM 1283 NH2 ARG A 77 -50.916 -26.270 -9.299 1.00 0.00 N ATOM 0 H ARG A 77 -53.221 -18.410 -10.836 1.00 0.00 H new ATOM 0 HA ARG A 77 -53.689 -20.797 -12.176 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -51.668 -20.397 -10.981 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -52.523 -20.191 -9.465 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -53.239 -22.547 -9.509 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -52.488 -22.771 -11.077 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -50.258 -22.385 -10.139 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -50.936 -21.918 -8.592 1.00 0.00 H new ATOM 0 HE ARG A 77 -51.190 -24.157 -8.024 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -50.690 -23.949 -11.549 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -50.580 -25.702 -11.738 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -51.059 -26.396 -8.297 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -50.788 -27.083 -9.902 1.00 0.00 H new ATOM 1297 N HIS A 78 -55.532 -20.392 -9.462 1.00 0.00 N ATOM 1298 CA HIS A 78 -56.693 -20.837 -8.716 1.00 0.00 C ATOM 1299 C HIS A 78 -57.960 -20.168 -9.249 1.00 0.00 C ATOM 1300 O HIS A 78 -58.728 -19.563 -8.502 1.00 0.00 O ATOM 1301 CB HIS A 78 -56.449 -20.543 -7.235 1.00 0.00 C ATOM 1302 CG HIS A 78 -55.206 -21.189 -6.673 1.00 0.00 C ATOM 1303 ND1 HIS A 78 -54.753 -22.432 -7.118 1.00 0.00 N ATOM 1304 CD2 HIS A 78 -54.350 -20.726 -5.710 1.00 0.00 C ATOM 1305 CE1 HIS A 78 -53.639 -22.661 -6.418 1.00 0.00 C ATOM 1306 NE2 HIS A 78 -53.353 -21.668 -5.561 1.00 0.00 N ATOM 0 H HIS A 78 -55.105 -19.552 -9.071 1.00 0.00 H new ATOM 0 HA HIS A 78 -56.844 -21.910 -8.836 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -56.378 -19.464 -7.097 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -57.312 -20.882 -6.662 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -54.439 -19.796 -5.168 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -53.034 -23.549 -6.529 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -52.557 -21.620 -4.926 1.00 0.00 H new ATOM 1314 N SER A 79 -58.173 -20.305 -10.559 1.00 0.00 N ATOM 1315 CA SER A 79 -59.308 -19.741 -11.275 1.00 0.00 C ATOM 1316 C SER A 79 -59.478 -20.469 -12.608 1.00 0.00 C ATOM 1317 O SER A 79 -60.528 -21.053 -12.869 1.00 0.00 O ATOM 1318 CB SER A 79 -59.106 -18.231 -11.469 1.00 0.00 C ATOM 1319 OG SER A 79 -60.233 -17.656 -12.092 1.00 0.00 O ATOM 0 H SER A 79 -57.540 -20.827 -11.164 1.00 0.00 H new ATOM 0 HA SER A 79 -60.222 -19.877 -10.696 1.00 0.00 H new ATOM 0 HB2 SER A 79 -58.935 -17.754 -10.504 1.00 0.00 H new ATOM 0 HB3 SER A 79 -58.218 -18.052 -12.075 1.00 0.00 H new ATOM 0 HG SER A 79 -60.088 -16.694 -12.206 1.00 0.00 H new ATOM 1325 N ARG A 80 -58.430 -20.448 -13.442 1.00 0.00 N ATOM 1326 CA ARG A 80 -58.451 -21.045 -14.773 1.00 0.00 C ATOM 1327 C ARG A 80 -58.568 -22.574 -14.739 1.00 0.00 C ATOM 1328 O ARG A 80 -58.964 -23.173 -15.736 1.00 0.00 O ATOM 1329 CB ARG A 80 -57.221 -20.605 -15.574 1.00 0.00 C ATOM 1330 CG ARG A 80 -57.060 -19.082 -15.682 1.00 0.00 C ATOM 1331 CD ARG A 80 -58.244 -18.376 -16.355 1.00 0.00 C ATOM 1332 NE ARG A 80 -58.002 -16.930 -16.454 1.00 0.00 N ATOM 1333 CZ ARG A 80 -57.210 -16.328 -17.358 1.00 0.00 C ATOM 1334 NH1 ARG A 80 -56.573 -17.039 -18.299 1.00 0.00 N ATOM 1335 NH2 ARG A 80 -57.055 -14.998 -17.316 1.00 0.00 N ATOM 0 H ARG A 80 -57.539 -20.011 -13.205 1.00 0.00 H new ATOM 0 HA ARG A 80 -59.349 -20.681 -15.272 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -56.328 -21.023 -15.108 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -57.284 -21.026 -16.578 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -56.925 -18.669 -14.682 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -56.152 -18.862 -16.243 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -58.403 -18.792 -17.350 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -59.154 -18.559 -15.784 1.00 0.00 H new ATOM 0 HE ARG A 80 -58.476 -16.331 -15.778 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -56.686 -18.052 -18.336 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -55.976 -16.567 -18.978 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -57.536 -14.451 -16.602 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -56.456 -14.533 -17.998 1.00 0.00 H new ATOM 1349 N ILE A 81 -58.259 -23.206 -13.599 1.00 0.00 N ATOM 1350 CA ILE A 81 -58.427 -24.639 -13.396 1.00 0.00 C ATOM 1351 C ILE A 81 -59.902 -25.029 -13.221 1.00 0.00 C ATOM 1352 O ILE A 81 -60.210 -26.217 -13.156 1.00 0.00 O ATOM 1353 CB ILE A 81 -57.597 -25.092 -12.179 1.00 0.00 C ATOM 1354 CG1 ILE A 81 -57.990 -24.306 -10.916 1.00 0.00 C ATOM 1355 CG2 ILE A 81 -56.099 -24.978 -12.495 1.00 0.00 C ATOM 1356 CD1 ILE A 81 -57.453 -24.936 -9.628 1.00 0.00 C ATOM 0 H ILE A 81 -57.880 -22.723 -12.784 1.00 0.00 H new ATOM 0 HA ILE A 81 -58.068 -25.149 -14.290 1.00 0.00 H new ATOM 0 HB ILE A 81 -57.814 -26.140 -11.971 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -57.615 -23.286 -10.998 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -59.077 -24.243 -10.857 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -55.519 -25.300 -11.630 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -55.858 -25.611 -13.349 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -55.855 -23.942 -12.730 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -57.763 -24.336 -8.773 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -57.848 -25.947 -9.525 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -56.364 -24.975 -9.668 1.00 0.00 H new ATOM 1368 N GLY A 82 -60.811 -24.049 -13.121 1.00 0.00 N ATOM 1369 CA GLY A 82 -62.213 -24.291 -12.847 1.00 0.00 C ATOM 1370 C GLY A 82 -63.014 -23.039 -13.178 1.00 0.00 C ATOM 1371 O GLY A 82 -63.693 -22.484 -12.320 1.00 0.00 O ATOM 0 H GLY A 82 -60.580 -23.062 -13.231 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -62.571 -25.133 -13.440 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -62.350 -24.558 -11.799 1.00 0.00 H new ATOM 1375 N ILE A 83 -62.928 -22.606 -14.438 1.00 0.00 N ATOM 1376 CA ILE A 83 -63.645 -21.449 -14.968 1.00 0.00 C ATOM 1377 C ILE A 83 -65.149 -21.573 -14.675 1.00 0.00 C ATOM 1378 O ILE A 83 -65.788 -20.635 -14.197 1.00 0.00 O ATOM 1379 CB ILE A 83 -63.330 -21.287 -16.467 1.00 0.00 C ATOM 1380 CG1 ILE A 83 -61.816 -21.111 -16.690 1.00 0.00 C ATOM 1381 CG2 ILE A 83 -64.068 -20.095 -17.094 1.00 0.00 C ATOM 1382 CD1 ILE A 83 -61.423 -21.033 -18.168 1.00 0.00 C ATOM 0 H ILE A 83 -62.341 -23.065 -15.135 1.00 0.00 H new ATOM 0 HA ILE A 83 -63.310 -20.539 -14.470 1.00 0.00 H new ATOM 0 HB ILE A 83 -63.676 -22.198 -16.955 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -61.485 -20.203 -16.186 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -61.289 -21.944 -16.225 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -63.812 -20.024 -18.151 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -65.144 -20.237 -16.990 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -63.773 -19.177 -16.587 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -60.343 -20.909 -18.251 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -61.723 -21.951 -18.673 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -61.923 -20.183 -18.633 1.00 0.00 H new ATOM 1394 N ILE A 84 -65.697 -22.760 -14.950 1.00 0.00 N ATOM 1395 CA ILE A 84 -67.093 -23.119 -14.787 1.00 0.00 C ATOM 1396 C ILE A 84 -67.208 -24.050 -13.569 1.00 0.00 C ATOM 1397 O ILE A 84 -67.926 -25.047 -13.620 1.00 0.00 O ATOM 1398 CB ILE A 84 -67.643 -23.753 -16.085 1.00 0.00 C ATOM 1399 CG1 ILE A 84 -67.055 -23.062 -17.332 1.00 0.00 C ATOM 1400 CG2 ILE A 84 -69.178 -23.650 -16.090 1.00 0.00 C ATOM 1401 CD1 ILE A 84 -67.709 -23.500 -18.646 1.00 0.00 C ATOM 0 H ILE A 84 -65.140 -23.534 -15.312 1.00 0.00 H new ATOM 0 HA ILE A 84 -67.704 -22.236 -14.603 1.00 0.00 H new ATOM 0 HB ILE A 84 -67.348 -24.802 -16.117 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -67.165 -21.983 -17.224 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -65.986 -23.270 -17.382 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -69.570 -24.096 -17.004 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -69.581 -24.179 -15.226 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -69.472 -22.602 -16.043 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -67.243 -22.972 -19.478 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -67.576 -24.574 -18.778 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -68.773 -23.267 -18.618 1.00 0.00 H new ATOM 1413 N GLN A 85 -66.490 -23.738 -12.475 1.00 0.00 N ATOM 1414 CA GLN A 85 -66.568 -24.448 -11.200 1.00 0.00 C ATOM 1415 C GLN A 85 -67.850 -24.009 -10.504 1.00 0.00 C ATOM 1416 O GLN A 85 -67.861 -23.301 -9.503 1.00 0.00 O ATOM 1417 CB GLN A 85 -65.253 -24.428 -10.414 1.00 0.00 C ATOM 1418 CG GLN A 85 -65.178 -25.494 -9.313 1.00 0.00 C ATOM 1419 CD GLN A 85 -66.100 -25.219 -8.128 1.00 0.00 C ATOM 1420 OE1 GLN A 85 -67.134 -25.867 -7.977 1.00 0.00 O ATOM 1421 NE2 GLN A 85 -65.728 -24.262 -7.277 1.00 0.00 N ATOM 0 H GLN A 85 -65.825 -22.965 -12.460 1.00 0.00 H new ATOM 0 HA GLN A 85 -66.664 -25.526 -11.333 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -64.424 -24.574 -11.106 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -65.123 -23.444 -9.964 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -65.431 -26.464 -9.741 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -64.151 -25.562 -8.955 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -64.863 -23.746 -7.436 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -66.309 -24.046 -6.467 1.00 0.00 H new ATOM 1430 N GLN A 86 -68.949 -24.463 -11.111 1.00 0.00 N ATOM 1431 CA GLN A 86 -70.323 -24.146 -10.829 1.00 0.00 C ATOM 1432 C GLN A 86 -70.448 -22.632 -10.963 1.00 0.00 C ATOM 1433 O GLN A 86 -70.879 -21.869 -10.101 1.00 0.00 O ATOM 1434 CB GLN A 86 -70.689 -24.640 -9.489 1.00 0.00 C ATOM 1435 CG GLN A 86 -70.453 -26.136 -9.265 1.00 0.00 C ATOM 1436 CD GLN A 86 -70.798 -26.530 -7.834 1.00 0.00 C ATOM 1437 OE1 GLN A 86 -71.908 -26.978 -7.558 1.00 0.00 O ATOM 1438 NE2 GLN A 86 -69.842 -26.366 -6.918 1.00 0.00 N ATOM 0 H GLN A 86 -68.876 -25.124 -11.884 1.00 0.00 H new ATOM 0 HA GLN A 86 -71.014 -24.629 -11.520 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -70.121 -24.082 -8.745 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -71.743 -24.423 -9.313 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -71.060 -26.713 -9.962 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -69.411 -26.380 -9.473 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -68.934 -25.990 -7.190 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -70.019 -26.616 -5.945 1.00 0.00 H new ATOM 1447 N ARG A 87 -69.934 -22.301 -12.127 1.00 0.00 N ATOM 1448 CA ARG A 87 -69.651 -21.053 -12.774 1.00 0.00 C ATOM 1449 C ARG A 87 -68.978 -20.082 -11.803 1.00 0.00 C ATOM 1450 O ARG A 87 -69.345 -18.925 -11.621 1.00 0.00 O ATOM 1451 CB ARG A 87 -70.783 -20.675 -13.709 1.00 0.00 C ATOM 1452 CG ARG A 87 -71.854 -19.898 -12.986 1.00 0.00 C ATOM 1453 CD ARG A 87 -73.097 -19.532 -13.796 1.00 0.00 C ATOM 1454 NE ARG A 87 -73.734 -20.718 -14.368 1.00 0.00 N ATOM 1455 CZ ARG A 87 -73.395 -21.283 -15.536 1.00 0.00 C ATOM 1456 NH1 ARG A 87 -72.530 -20.684 -16.369 1.00 0.00 N ATOM 1457 NH2 ARG A 87 -73.911 -22.477 -15.841 1.00 0.00 N ATOM 0 H ARG A 87 -69.656 -23.058 -12.751 1.00 0.00 H new ATOM 0 HA ARG A 87 -68.854 -21.075 -13.517 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -70.393 -20.079 -14.534 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -71.215 -21.576 -14.143 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -72.170 -20.479 -12.120 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -71.410 -18.977 -12.608 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -73.808 -19.009 -13.156 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -72.822 -18.844 -14.596 1.00 0.00 H new ATOM 0 HE ARG A 87 -74.493 -21.147 -13.839 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -72.119 -19.785 -16.118 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -72.283 -21.128 -17.254 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -74.548 -22.938 -15.191 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -73.668 -22.927 -16.724 1.00 0.00 H new ATOM 1471 N ARG A 88 -67.903 -20.632 -11.223 1.00 0.00 N ATOM 1472 CA ARG A 88 -66.978 -20.022 -10.293 1.00 0.00 C ATOM 1473 C ARG A 88 -66.544 -18.630 -10.740 1.00 0.00 C ATOM 1474 O ARG A 88 -66.625 -17.682 -9.961 1.00 0.00 O ATOM 1475 CB ARG A 88 -65.795 -20.980 -10.098 1.00 0.00 C ATOM 1476 CG ARG A 88 -64.614 -20.338 -9.371 1.00 0.00 C ATOM 1477 CD ARG A 88 -63.495 -21.330 -9.034 1.00 0.00 C ATOM 1478 NE ARG A 88 -62.323 -20.651 -8.462 1.00 0.00 N ATOM 1479 CZ ARG A 88 -62.216 -20.205 -7.198 1.00 0.00 C ATOM 1480 NH1 ARG A 88 -63.230 -20.342 -6.331 1.00 0.00 N ATOM 1481 NH2 ARG A 88 -61.082 -19.616 -6.798 1.00 0.00 N ATOM 0 H ARG A 88 -67.647 -21.600 -11.418 1.00 0.00 H new ATOM 0 HA ARG A 88 -67.471 -19.864 -9.334 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -66.130 -21.851 -9.535 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -65.462 -21.339 -11.072 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -64.207 -19.539 -9.990 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -64.971 -19.877 -8.450 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -63.867 -22.072 -8.328 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -63.201 -21.867 -9.936 1.00 0.00 H new ATOM 0 HE ARG A 88 -61.522 -20.506 -9.077 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -64.097 -20.790 -6.627 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -63.134 -19.999 -5.375 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -60.306 -19.508 -7.451 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -60.994 -19.275 -5.841 1.00 0.00 H new ATOM 1495 N THR A 89 -66.071 -18.530 -11.983 1.00 0.00 N ATOM 1496 CA THR A 89 -65.505 -17.323 -12.553 1.00 0.00 C ATOM 1497 C THR A 89 -66.518 -16.614 -13.456 1.00 0.00 C ATOM 1498 O THR A 89 -66.665 -15.396 -13.378 1.00 0.00 O ATOM 1499 CB THR A 89 -64.188 -17.669 -13.266 1.00 0.00 C ATOM 1500 OG1 THR A 89 -64.412 -18.213 -14.546 1.00 0.00 O ATOM 1501 CG2 THR A 89 -63.339 -18.653 -12.445 1.00 0.00 C ATOM 0 H THR A 89 -66.075 -19.315 -12.635 1.00 0.00 H new ATOM 0 HA THR A 89 -65.271 -16.611 -11.762 1.00 0.00 H new ATOM 0 HB THR A 89 -63.645 -16.730 -13.371 1.00 0.00 H new ATOM 0 HG1 THR A 89 -64.933 -19.039 -14.464 1.00 0.00 H new ATOM 0 HG21 THR A 89 -62.416 -18.873 -12.982 1.00 0.00 H new ATOM 0 HG22 THR A 89 -63.099 -18.209 -11.479 1.00 0.00 H new ATOM 0 HG23 THR A 89 -63.898 -19.576 -12.291 1.00 0.00 H new ATOM 1509 N ARG A 90 -67.223 -17.370 -14.310 1.00 0.00 N ATOM 1510 CA ARG A 90 -68.271 -16.852 -15.173 1.00 0.00 C ATOM 1511 C ARG A 90 -69.555 -16.681 -14.368 1.00 0.00 C ATOM 1512 O ARG A 90 -70.512 -17.429 -14.559 1.00 0.00 O ATOM 1513 CB ARG A 90 -68.459 -17.778 -16.378 1.00 0.00 C ATOM 1514 CG ARG A 90 -67.309 -17.628 -17.366 1.00 0.00 C ATOM 1515 CD ARG A 90 -67.410 -18.756 -18.398 1.00 0.00 C ATOM 1516 NE ARG A 90 -66.562 -18.489 -19.561 1.00 0.00 N ATOM 1517 CZ ARG A 90 -66.865 -17.594 -20.514 1.00 0.00 C ATOM 1518 NH1 ARG A 90 -68.010 -16.897 -20.455 1.00 0.00 N ATOM 1519 NH2 ARG A 90 -66.008 -17.399 -21.521 1.00 0.00 N ATOM 0 H ARG A 90 -67.071 -18.373 -14.415 1.00 0.00 H new ATOM 0 HA ARG A 90 -67.990 -15.872 -15.559 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -68.520 -18.813 -16.040 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -69.402 -17.548 -16.874 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -67.356 -16.657 -17.859 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -66.353 -17.675 -16.845 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -67.115 -19.700 -17.939 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -68.446 -18.867 -18.718 1.00 0.00 H new ATOM 0 HE ARG A 90 -65.692 -19.013 -19.652 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -68.658 -17.045 -19.681 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -68.232 -16.219 -21.184 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -65.136 -17.927 -21.558 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -66.226 -16.722 -22.252 1.00 0.00 H new ATOM 1533 N ASN A 91 -69.571 -15.678 -13.481 1.00 0.00 N ATOM 1534 CA ASN A 91 -70.663 -15.400 -12.562 1.00 0.00 C ATOM 1535 C ASN A 91 -71.794 -14.641 -13.260 1.00 0.00 C ATOM 1536 O ASN A 91 -72.182 -13.555 -12.836 1.00 0.00 O ATOM 1537 CB ASN A 91 -70.109 -14.613 -11.365 1.00 0.00 C ATOM 1538 CG ASN A 91 -68.966 -15.339 -10.659 1.00 0.00 C ATOM 1539 OD1 ASN A 91 -67.826 -14.883 -10.692 1.00 0.00 O ATOM 1540 ND2 ASN A 91 -69.261 -16.469 -10.017 1.00 0.00 N ATOM 0 H ASN A 91 -68.796 -15.021 -13.387 1.00 0.00 H new ATOM 0 HA ASN A 91 -71.091 -16.338 -12.208 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -69.759 -13.639 -11.707 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -70.913 -14.431 -10.652 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -68.528 -16.986 -9.531 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -70.220 -16.817 -10.011 1.00 0.00 H new ATOM 1547 N GLY A 92 -72.333 -15.242 -14.325 1.00 0.00 N ATOM 1548 CA GLY A 92 -73.484 -14.732 -15.054 1.00 0.00 C ATOM 1549 C GLY A 92 -74.756 -15.079 -14.283 1.00 0.00 C ATOM 1550 O GLY A 92 -75.088 -14.407 -13.307 1.00 0.00 O ATOM 0 H GLY A 92 -71.969 -16.115 -14.707 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -73.402 -13.652 -15.179 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -73.519 -15.166 -16.053 1.00 0.00 H new ATOM 1554 N ALA A 93 -75.447 -16.147 -14.703 1.00 0.00 N ATOM 1555 CA ALA A 93 -76.618 -16.678 -14.013 1.00 0.00 C ATOM 1556 C ALA A 93 -76.133 -17.507 -12.822 1.00 0.00 C ATOM 1557 O ALA A 93 -76.260 -18.730 -12.815 1.00 0.00 O ATOM 1558 CB ALA A 93 -77.455 -17.506 -14.995 1.00 0.00 C ATOM 0 H ALA A 93 -75.201 -16.670 -15.544 1.00 0.00 H new ATOM 0 HA ALA A 93 -77.257 -15.878 -13.640 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -78.330 -17.904 -14.482 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -77.776 -16.874 -15.823 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -76.855 -18.330 -15.380 1.00 0.00 H new ATOM 1564 N SER A 94 -75.558 -16.809 -11.834 1.00 0.00 N ATOM 1565 CA SER A 94 -74.907 -17.336 -10.644 1.00 0.00 C ATOM 1566 C SER A 94 -75.802 -18.268 -9.824 1.00 0.00 C ATOM 1567 O SER A 94 -76.461 -17.840 -8.878 1.00 0.00 O ATOM 1568 CB SER A 94 -74.388 -16.162 -9.805 1.00 0.00 C ATOM 1569 OG SER A 94 -73.489 -15.382 -10.569 1.00 0.00 O ATOM 0 H SER A 94 -75.538 -15.789 -11.854 1.00 0.00 H new ATOM 0 HA SER A 94 -74.072 -17.960 -10.963 1.00 0.00 H new ATOM 0 HB2 SER A 94 -75.223 -15.546 -9.470 1.00 0.00 H new ATOM 0 HB3 SER A 94 -73.889 -16.536 -8.911 1.00 0.00 H new ATOM 0 HG SER A 94 -73.163 -14.633 -10.027 1.00 0.00 H new ATOM 1575 N LYS A 95 -75.788 -19.553 -10.192 1.00 0.00 N ATOM 1576 CA LYS A 95 -76.462 -20.647 -9.512 1.00 0.00 C ATOM 1577 C LYS A 95 -75.524 -21.850 -9.559 1.00 0.00 C ATOM 1578 O LYS A 95 -75.040 -22.314 -8.528 1.00 0.00 O ATOM 1579 CB LYS A 95 -77.811 -20.961 -10.180 1.00 0.00 C ATOM 1580 CG LYS A 95 -78.823 -19.819 -10.015 1.00 0.00 C ATOM 1581 CD LYS A 95 -80.171 -20.131 -10.679 1.00 0.00 C ATOM 1582 CE LYS A 95 -80.914 -21.288 -10.000 1.00 0.00 C ATOM 1583 NZ LYS A 95 -82.260 -21.471 -10.569 1.00 0.00 N ATOM 0 H LYS A 95 -75.277 -19.867 -11.017 1.00 0.00 H new ATOM 0 HA LYS A 95 -76.685 -20.381 -8.479 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -77.652 -21.152 -11.241 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -78.223 -21.874 -9.750 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -78.980 -19.627 -8.954 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -78.411 -18.907 -10.447 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -80.797 -19.239 -10.655 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -80.006 -20.377 -11.728 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -80.341 -22.208 -10.115 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -80.993 -21.094 -8.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -82.736 -22.261 -10.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -82.814 -20.601 -10.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -82.182 -21.681 -11.585 1.00 0.00 H new ATOM 1597 N SER A 96 -75.260 -22.322 -10.779 1.00 0.00 N ATOM 1598 CA SER A 96 -74.320 -23.383 -11.095 1.00 0.00 C ATOM 1599 C SER A 96 -74.048 -23.333 -12.597 1.00 0.00 C ATOM 1600 O SER A 96 -75.026 -23.112 -13.347 1.00 0.00 O ATOM 1601 CB SER A 96 -74.878 -24.747 -10.668 1.00 0.00 C ATOM 1602 OG SER A 96 -73.914 -25.757 -10.883 1.00 0.00 O ATOM 1603 OXT SER A 96 -72.867 -23.474 -12.980 1.00 0.00 O ATOM 0 H SER A 96 -75.722 -21.952 -11.610 1.00 0.00 H new ATOM 0 HA SER A 96 -73.387 -23.242 -10.549 1.00 0.00 H new ATOM 0 HB2 SER A 96 -75.158 -24.720 -9.615 1.00 0.00 H new ATOM 0 HB3 SER A 96 -75.783 -24.971 -11.233 1.00 0.00 H new ATOM 0 HG SER A 96 -74.280 -26.623 -10.606 1.00 0.00 H new TER 1609 SER A 96 END