USER MOD reduce.3.24.130724 H: found=0, std=0, add=1252, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1247 hydrogens (0 hets) HEADER APOPTOSIS 01-NOV-00 1G5M TITLE HUMAN BCL-2, ISOFORM 1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN (APOPTOSIS REGULATOR BCL-2 WITH PUTATIVE COMPND 3 FLEXIBLE LOOP REPLACED WITH A PORTION OF APOPTOSIS COMPND 4 REGULATOR BCL-X PROTEIN); COMPND 5 CHAIN: A; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS APOPTOSIS EXPDTA SOLUTION NMR AUTHOR A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON,K.SWIFT, AUTHOR 2 E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK REVDAT 2 24-FEB-09 1G5M 1 VERSN REVDAT 1 21-MAR-01 1G5M 0 JRNL AUTH A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON, JRNL AUTH 2 K.SWIFT,E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK JRNL TITL SOLUTION STRUCTURE OF THE ANTIAPOPTOTIC PROTEIN JRNL TITL 2 BCL-2. JRNL REF PROC.NATL.ACAD.SCI.USA V. 98 3012 2001 JRNL REFN ISSN 0027-8424 JRNL PMID 11248023 JRNL DOI 10.1073/PNAS.041619798 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH Y.TSUJIMOTO,C.M.CROCE REMARK 1 TITL ANALYSIS OF THE STRUCTURE, TRANSCRIPTS, AND REMARK 1 TITL 2 PRODUCTS OF BCL-2, THE GENE INVOLVED IN HUMAN REMARK 1 TITL 3 FOLLICULAR LYMPHOMA REMARK 1 REF PROC.NATL.ACAD.SCI.USA V. 83 5214 1986 REMARK 1 REFN ISSN 0027-8424 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNX 2000 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1G5M COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-NOV-00. REMARK 100 THE RCSB ID CODE IS RCSB012262. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 7.8 REMARK 210 IONIC STRENGTH : 20 MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 15N-BCL-2(1); 15N,13C-BCL- REMARK 210 2(1); 15N,13C-BCL-2(1) REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ, 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 MET A 1 REMARK 465 ALA A 2 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 ALA A 4 -78.91 65.43 REMARK 500 ARG A 6 126.26 -179.88 REMARK 500 THR A 7 58.70 -177.52 REMARK 500 ASP A 10 62.91 63.13 REMARK 500 TYR A 28 106.11 -47.21 REMARK 500 TRP A 30 -66.27 -96.38 REMARK 500 ALA A 32 -58.70 75.77 REMARK 500 VAL A 36 107.83 178.95 REMARK 500 PRO A 44 82.04 -59.75 REMARK 500 SER A 49 38.10 -147.25 REMARK 500 TYR A 108 -70.05 -78.95 REMARK 500 PHE A 112 -84.95 68.54 REMARK 500 HIS A 120 -123.10 -67.38 REMARK 500 LEU A 121 98.07 179.06 REMARK 500 THR A 122 164.50 167.37 REMARK 500 THR A 125 -56.22 -128.17 REMARK 500 ASP A 140 76.38 -106.95 REMARK 500 ARG A 183 -73.51 -65.89 REMARK 500 PRO A 204 -158.80 -57.86 REMARK 500 SER A 205 79.10 -118.26 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1BXL RELATED DB: PDB REMARK 900 STRUCTURE OF BCL-XL/BAK PEPTIDE COMPLEX, NMR, MINIMIZED REMARK 900 AVERAGE STRUCTURE REMARK 900 RELATED ID: 1G5J RELATED DB: PDB REMARK 900 COMPLEX OF BCL-XL WITH PEPTIDE FROM BAD REMARK 900 RELATED ID: 1G5O RELATED DB: PDB REMARK 900 HUMAN BCL-2, ISOFORM 2 DBREF 1G5M A 1 34 UNP P10415 BCL2_HUMAN 1 34 DBREF 1G5M A 35 50 UNP Q07817 BCLX_HUMAN 29 44 DBREF 1G5M A 92 207 UNP P10415 BCL2_HUMAN 92 207 SEQADV 1G5M ALA A 96 UNP P10415 THR 96 ISOFORM SEQADV 1G5M GLY A 110 UNP P10415 ARG 110 ISOFORM SEQRES 1 A 166 MET ALA HIS ALA GLY ARG THR GLY TYR ASP ASN ARG GLU SEQRES 2 A 166 ILE VAL MET LYS TYR ILE HIS TYR LYS LEU SER GLN ARG SEQRES 3 A 166 GLY TYR GLU TRP ASP ALA GLY ASP ASP VAL GLU GLU ASN SEQRES 4 A 166 ARG THR GLU ALA PRO GLU GLY THR GLU SER GLU VAL VAL SEQRES 5 A 166 HIS LEU ALA LEU ARG GLN ALA GLY ASP ASP PHE SER ARG SEQRES 6 A 166 ARG TYR ARG GLY ASP PHE ALA GLU MET SER SER GLN LEU SEQRES 7 A 166 HIS LEU THR PRO PHE THR ALA ARG GLY ARG PHE ALA THR SEQRES 8 A 166 VAL VAL GLU GLU LEU PHE ARG ASP GLY VAL ASN TRP GLY SEQRES 9 A 166 ARG ILE VAL ALA PHE PHE GLU PHE GLY GLY VAL MET CYS SEQRES 10 A 166 VAL GLU SER VAL ASN ARG GLU MET SER PRO LEU VAL ASP SEQRES 11 A 166 ASN ILE ALA LEU TRP MET THR GLU TYR LEU ASN ARG HIS SEQRES 12 A 166 LEU HIS THR TRP ILE GLN ASP ASN GLY GLY TRP ASP ALA SEQRES 13 A 166 PHE VAL GLU LEU TYR GLY PRO SER MET ARG HELIX 1 1 ASP A 10 GLN A 25 1 16 HELIX 2 2 VAL A 92 ARG A 109 1 18 HELIX 3 3 ALA A 113 GLN A 118 5 6 HELIX 4 4 THR A 122 PHE A 138 1 17 HELIX 5 5 ASN A 143 ARG A 164 1 22 HELIX 6 6 MET A 166 HIS A 184 1 19 HELIX 7 7 HIS A 184 GLY A 193 1 10 HELIX 8 8 GLY A 194 GLY A 203 1 10 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 182 ASN : amide:sc= 0.148 K(o=-0.59,f=-2.9!) USER MOD Set 1.2: A 186 HIS : no HE2:sc= -0.817 K(o=-0.59,f=-3.1) USER MOD Set 1.3: A 190 GLN : amide:sc= 0.0802 X(o=-0.59,f=-0.76) USER MOD Set 2.1: A 122 THR OG1 : rot 49:sc= 0.0487 USER MOD Set 2.2: A 125 THR OG1 : rot 52:sc= 1.72 USER MOD Set 3.1: A 28 TYR OH : rot -110:sc= 0.23 USER MOD Set 3.2: A 167 SER OG : rot 102:sc= -0.66 USER MOD Single : A 3 HIS : no HD1:sc= -1.07 K(o=-1.1,f=-0.23) USER MOD Single : A 7 THR OG1 : rot -41:sc= 1.1 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -0.673 K(o=-0.67,f=-9.1!) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 30:sc= -1.63 USER MOD Single : A 20 HIS : no HD1:sc= -0.0918 X(o=-0.092,f=-0.006) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 154:sc= -2.1 (180deg=-2.59) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.3!) USER MOD Single : A 39 ASN : amide:sc= -0.49 X(o=-0.49,f=-0.033) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -51:sc= 1.07 USER MOD Single : A 49 SER OG : rot 180:sc= -0.0123 USER MOD Single : A 94 HIS : no HE2:sc= -7.78! C(o=-7.8!,f=-5.9!) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 SER OG : rot 114:sc= 1.28 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 MET CE :methyl -129:sc= -2.21 (180deg=-5.73!) USER MOD Single : A 116 SER OG : rot 98:sc= 0.00677 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.23 K(o=-0.23,f=-1.6!) USER MOD Single : A 120 HIS : no HD1:sc= -0.526 X(o=-0.53,f=-0.56) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0.0198 USER MOD Single : A 143 ASN : amide:sc= -0.288 K(o=-0.29,f=-3!) USER MOD Single : A 157 MET CE :methyl -158:sc= -3.08 (180deg=-4.62!) USER MOD Single : A 158 CYS SG : rot 170:sc= -1.23 USER MOD Single : A 161 SER OG : rot 89:sc= 1.04 USER MOD Single : A 163 ASN : amide:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 166 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 172 ASN : amide:sc= -0.349 K(o=-0.35,f=-1.4!) USER MOD Single : A 177 MET CE :methyl 170:sc= -1.12 (180deg=-1.24) USER MOD Single : A 178 THR OG1 : rot 180:sc= -0.0433 USER MOD Single : A 180 TYR OH : rot -26:sc= 0.437 USER MOD Single : A 184 HIS : no HD1:sc= -2.39 K(o=-2.4,f=-0.5) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 ASN : amide:sc= -5.9! C(o=-5.9!,f=-5.7!) USER MOD Single : A 202 TYR OH : rot 180:sc=-0.00212 USER MOD Single : A 205 SER OG : rot 180:sc= 0 USER MOD Single : A 206 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 3 -0.377 15.593 18.283 1.00 7.96 N ATOM 2 CA HIS A 3 -1.553 16.160 18.993 1.00 7.23 C ATOM 3 C HIS A 3 -2.790 15.291 18.791 1.00 6.42 C ATOM 4 O HIS A 3 -3.896 15.800 18.608 1.00 6.57 O ATOM 5 CB HIS A 3 -1.808 17.572 18.463 1.00 7.71 C ATOM 6 CG HIS A 3 -2.111 17.615 16.997 1.00 8.25 C ATOM 7 ND1 HIS A 3 -2.430 18.778 16.328 1.00 9.01 N ATOM 8 CD2 HIS A 3 -2.141 16.629 16.069 1.00 8.41 C ATOM 9 CE1 HIS A 3 -2.645 18.505 15.053 1.00 9.58 C ATOM 10 NE2 HIS A 3 -2.475 17.209 14.870 1.00 9.25 N ATOM 0 HA HIS A 3 -1.345 16.192 20.062 1.00 7.23 H new ATOM 0 HB2 HIS A 3 -2.641 18.012 19.011 1.00 7.71 H new ATOM 0 HB3 HIS A 3 -0.933 18.190 18.663 1.00 7.71 H new ATOM 0 HD2 HIS A 3 -1.940 15.582 16.240 1.00 8.41 H new ATOM 0 HE1 HIS A 3 -2.914 19.221 14.290 1.00 9.58 H new ATOM 0 HE2 HIS A 3 -2.575 16.718 13.982 1.00 9.25 H new ATOM 18 N ALA A 4 -2.596 13.976 18.826 1.00 5.87 N ATOM 19 CA ALA A 4 -3.695 13.036 18.647 1.00 5.31 C ATOM 20 C ALA A 4 -4.275 13.131 17.240 1.00 4.79 C ATOM 21 O ALA A 4 -3.977 12.304 16.378 1.00 5.11 O ATOM 22 CB ALA A 4 -4.779 13.288 19.684 1.00 5.62 C ATOM 0 H ALA A 4 -1.687 13.538 18.977 1.00 5.87 H new ATOM 0 HA ALA A 4 -3.304 12.028 18.783 1.00 5.31 H new ATOM 0 HB1 ALA A 4 -5.594 12.579 19.538 1.00 5.62 H new ATOM 0 HB2 ALA A 4 -4.363 13.162 20.683 1.00 5.62 H new ATOM 0 HB3 ALA A 4 -5.158 14.304 19.574 1.00 5.62 H new ATOM 28 N GLY A 5 -5.103 14.146 17.013 1.00 4.36 N ATOM 29 CA GLY A 5 -5.711 14.330 15.709 1.00 4.16 C ATOM 30 C GLY A 5 -6.327 13.053 15.173 1.00 3.56 C ATOM 31 O GLY A 5 -6.711 12.171 15.941 1.00 3.75 O ATOM 0 H GLY A 5 -5.363 14.844 17.709 1.00 4.36 H new ATOM 0 HA2 GLY A 5 -6.479 15.101 15.775 1.00 4.16 H new ATOM 0 HA3 GLY A 5 -4.958 14.689 15.008 1.00 4.16 H new ATOM 35 N ARG A 6 -6.423 12.954 13.851 1.00 3.33 N ATOM 36 CA ARG A 6 -6.998 11.775 13.214 1.00 3.16 C ATOM 37 C ARG A 6 -6.986 11.916 11.695 1.00 2.67 C ATOM 38 O ARG A 6 -7.488 12.899 11.149 1.00 3.16 O ATOM 39 CB ARG A 6 -8.429 11.549 13.705 1.00 3.87 C ATOM 40 CG ARG A 6 -8.786 10.083 13.884 1.00 4.39 C ATOM 41 CD ARG A 6 -8.656 9.652 15.335 1.00 5.13 C ATOM 42 NE ARG A 6 -9.256 8.341 15.572 1.00 5.96 N ATOM 43 CZ ARG A 6 -10.567 8.105 15.534 1.00 6.76 C ATOM 44 NH1 ARG A 6 -11.422 9.087 15.270 1.00 6.95 N ATOM 45 NH2 ARG A 6 -11.025 6.882 15.761 1.00 7.64 N ATOM 0 H ARG A 6 -6.110 13.675 13.201 1.00 3.33 H new ATOM 0 HA ARG A 6 -6.388 10.914 13.486 1.00 3.16 H new ATOM 0 HB2 ARG A 6 -8.564 12.066 14.655 1.00 3.87 H new ATOM 0 HB3 ARG A 6 -9.123 11.999 12.995 1.00 3.87 H new ATOM 0 HG2 ARG A 6 -9.807 9.912 13.542 1.00 4.39 H new ATOM 0 HG3 ARG A 6 -8.134 9.470 13.261 1.00 4.39 H new ATOM 0 HD2 ARG A 6 -7.602 9.624 15.612 1.00 5.13 H new ATOM 0 HD3 ARG A 6 -9.135 10.391 15.977 1.00 5.13 H new ATOM 0 HE ARG A 6 -8.634 7.560 15.779 1.00 5.96 H new ATOM 0 HH11 ARG A 6 -11.077 10.031 15.094 1.00 6.95 H new ATOM 0 HH12 ARG A 6 -12.424 8.897 15.243 1.00 6.95 H new ATOM 0 HH21 ARG A 6 -10.374 6.123 15.964 1.00 7.64 H new ATOM 0 HH22 ARG A 6 -12.028 6.700 15.732 1.00 7.64 H new ATOM 59 N THR A 7 -6.411 10.927 11.019 1.00 2.23 N ATOM 60 CA THR A 7 -6.334 10.939 9.563 1.00 1.93 C ATOM 61 C THR A 7 -5.682 9.662 9.042 1.00 1.81 C ATOM 62 O THR A 7 -4.660 9.711 8.358 1.00 2.30 O ATOM 63 CB THR A 7 -5.547 12.159 9.083 1.00 2.21 C ATOM 64 OG1 THR A 7 -5.521 12.214 7.667 1.00 3.07 O ATOM 65 CG2 THR A 7 -4.114 12.176 9.570 1.00 2.74 C ATOM 0 H THR A 7 -5.991 10.107 11.457 1.00 2.23 H new ATOM 0 HA THR A 7 -7.350 10.993 9.171 1.00 1.93 H new ATOM 0 HB THR A 7 -6.066 13.021 9.502 1.00 2.21 H new ATOM 0 HG1 THR A 7 -5.376 11.314 7.307 1.00 3.07 H new ATOM 0 HG21 THR A 7 -3.612 13.068 9.194 1.00 2.74 H new ATOM 0 HG22 THR A 7 -4.100 12.185 10.660 1.00 2.74 H new ATOM 0 HG23 THR A 7 -3.596 11.288 9.208 1.00 2.74 H new ATOM 73 N GLY A 8 -6.280 8.521 9.371 1.00 1.89 N ATOM 74 CA GLY A 8 -5.743 7.248 8.927 1.00 2.15 C ATOM 75 C GLY A 8 -5.425 7.240 7.445 1.00 1.61 C ATOM 76 O GLY A 8 -6.021 7.992 6.673 1.00 2.30 O ATOM 0 H GLY A 8 -7.126 8.456 9.937 1.00 1.89 H new ATOM 0 HA2 GLY A 8 -4.838 7.022 9.491 1.00 2.15 H new ATOM 0 HA3 GLY A 8 -6.461 6.458 9.146 1.00 2.15 H new ATOM 80 N TYR A 9 -4.483 6.393 7.045 1.00 1.09 N ATOM 81 CA TYR A 9 -4.090 6.298 5.644 1.00 0.60 C ATOM 82 C TYR A 9 -4.487 4.951 5.042 1.00 0.75 C ATOM 83 O TYR A 9 -3.906 4.514 4.049 1.00 1.74 O ATOM 84 CB TYR A 9 -2.581 6.501 5.504 1.00 0.71 C ATOM 85 CG TYR A 9 -2.140 7.940 5.653 1.00 0.65 C ATOM 86 CD1 TYR A 9 -2.508 8.690 6.763 1.00 1.37 C ATOM 87 CD2 TYR A 9 -1.353 8.547 4.683 1.00 1.07 C ATOM 88 CE1 TYR A 9 -2.105 10.005 6.902 1.00 1.41 C ATOM 89 CE2 TYR A 9 -0.945 9.861 4.815 1.00 1.13 C ATOM 90 CZ TYR A 9 -1.324 10.585 5.925 1.00 0.80 C ATOM 91 OH TYR A 9 -0.920 11.894 6.060 1.00 0.96 O ATOM 0 H TYR A 9 -3.978 5.764 7.669 1.00 1.09 H new ATOM 0 HA TYR A 9 -4.615 7.082 5.099 1.00 0.60 H new ATOM 0 HB2 TYR A 9 -2.072 5.896 6.254 1.00 0.71 H new ATOM 0 HB3 TYR A 9 -2.264 6.133 4.528 1.00 0.71 H new ATOM 0 HD1 TYR A 9 -3.119 8.238 7.530 1.00 1.37 H new ATOM 0 HD2 TYR A 9 -1.055 7.983 3.811 1.00 1.07 H new ATOM 0 HE1 TYR A 9 -2.400 10.575 7.771 1.00 1.41 H new ATOM 0 HE2 TYR A 9 -0.332 10.318 4.052 1.00 1.13 H new ATOM 0 HH TYR A 9 -0.375 12.150 5.287 1.00 0.96 H new ATOM 101 N ASP A 10 -5.474 4.293 5.644 1.00 0.59 N ATOM 102 CA ASP A 10 -5.932 2.998 5.155 1.00 0.73 C ATOM 103 C ASP A 10 -4.820 1.958 5.250 1.00 0.69 C ATOM 104 O ASP A 10 -4.369 1.422 4.238 1.00 0.95 O ATOM 105 CB ASP A 10 -6.413 3.117 3.708 1.00 1.04 C ATOM 106 CG ASP A 10 -7.279 4.341 3.484 1.00 1.65 C ATOM 107 OD1 ASP A 10 -8.422 4.359 3.986 1.00 2.20 O ATOM 108 OD2 ASP A 10 -6.813 5.282 2.807 1.00 2.17 O ATOM 0 H ASP A 10 -5.970 4.634 6.468 1.00 0.59 H new ATOM 0 HA ASP A 10 -6.763 2.674 5.781 1.00 0.73 H new ATOM 0 HB2 ASP A 10 -5.550 3.160 3.044 1.00 1.04 H new ATOM 0 HB3 ASP A 10 -6.977 2.223 3.441 1.00 1.04 H new ATOM 113 N ASN A 11 -4.382 1.678 6.474 1.00 0.53 N ATOM 114 CA ASN A 11 -3.322 0.702 6.704 1.00 0.50 C ATOM 115 C ASN A 11 -3.611 -0.601 5.964 1.00 0.47 C ATOM 116 O ASN A 11 -2.712 -1.210 5.384 1.00 0.46 O ATOM 117 CB ASN A 11 -3.165 0.428 8.201 1.00 0.57 C ATOM 118 CG ASN A 11 -4.498 0.315 8.915 1.00 1.49 C ATOM 119 OD1 ASN A 11 -5.427 -0.325 8.423 1.00 2.39 O ATOM 120 ND2 ASN A 11 -4.598 0.939 10.083 1.00 2.06 N ATOM 0 H ASN A 11 -4.745 2.113 7.322 1.00 0.53 H new ATOM 0 HA ASN A 11 -2.391 1.119 6.319 1.00 0.50 H new ATOM 0 HB2 ASN A 11 -2.603 -0.495 8.341 1.00 0.57 H new ATOM 0 HB3 ASN A 11 -2.581 1.229 8.654 1.00 0.57 H new ATOM 0 HD21 ASN A 11 -5.471 0.899 10.610 1.00 2.06 H new ATOM 0 HD22 ASN A 11 -3.802 1.458 10.454 1.00 2.06 H new ATOM 127 N ARG A 12 -4.872 -1.022 5.989 1.00 0.46 N ATOM 128 CA ARG A 12 -5.279 -2.252 5.319 1.00 0.45 C ATOM 129 C ARG A 12 -5.234 -2.085 3.805 1.00 0.42 C ATOM 130 O ARG A 12 -4.957 -3.035 3.073 1.00 0.42 O ATOM 131 CB ARG A 12 -6.688 -2.655 5.759 1.00 0.49 C ATOM 132 CG ARG A 12 -7.184 -3.937 5.112 1.00 1.06 C ATOM 133 CD ARG A 12 -8.051 -4.743 6.066 1.00 1.26 C ATOM 134 NE ARG A 12 -9.149 -3.949 6.611 1.00 1.42 N ATOM 135 CZ ARG A 12 -10.211 -3.565 5.906 1.00 1.72 C ATOM 136 NH1 ARG A 12 -10.327 -3.899 4.625 1.00 2.23 N ATOM 137 NH2 ARG A 12 -11.163 -2.845 6.484 1.00 2.27 N ATOM 0 H ARG A 12 -5.628 -0.530 6.465 1.00 0.46 H new ATOM 0 HA ARG A 12 -4.580 -3.039 5.601 1.00 0.45 H new ATOM 0 HB2 ARG A 12 -6.701 -2.776 6.842 1.00 0.49 H new ATOM 0 HB3 ARG A 12 -7.379 -1.847 5.521 1.00 0.49 H new ATOM 0 HG2 ARG A 12 -7.755 -3.696 4.215 1.00 1.06 H new ATOM 0 HG3 ARG A 12 -6.332 -4.539 4.796 1.00 1.06 H new ATOM 0 HD2 ARG A 12 -8.455 -5.610 5.544 1.00 1.26 H new ATOM 0 HD3 ARG A 12 -7.436 -5.121 6.883 1.00 1.26 H new ATOM 0 HE ARG A 12 -9.099 -3.672 7.591 1.00 1.42 H new ATOM 0 HH11 ARG A 12 -9.599 -4.454 4.175 1.00 2.23 H new ATOM 0 HH12 ARG A 12 -11.144 -3.601 4.092 1.00 2.23 H new ATOM 0 HH21 ARG A 12 -11.081 -2.586 7.467 1.00 2.27 H new ATOM 0 HH22 ARG A 12 -11.977 -2.550 5.945 1.00 2.27 H new ATOM 151 N GLU A 13 -5.507 -0.870 3.342 1.00 0.42 N ATOM 152 CA GLU A 13 -5.495 -0.574 1.914 1.00 0.43 C ATOM 153 C GLU A 13 -4.069 -0.374 1.412 1.00 0.40 C ATOM 154 O GLU A 13 -3.763 -0.656 0.254 1.00 0.42 O ATOM 155 CB GLU A 13 -6.330 0.674 1.623 1.00 0.47 C ATOM 156 CG GLU A 13 -6.757 0.795 0.169 1.00 0.50 C ATOM 157 CD GLU A 13 -8.095 1.490 0.010 1.00 1.35 C ATOM 158 OE1 GLU A 13 -8.936 1.376 0.926 1.00 2.04 O ATOM 159 OE2 GLU A 13 -8.301 2.149 -1.031 1.00 2.12 O ATOM 0 H GLU A 13 -5.739 -0.074 3.935 1.00 0.42 H new ATOM 0 HA GLU A 13 -5.930 -1.424 1.389 1.00 0.43 H new ATOM 0 HB2 GLU A 13 -7.219 0.662 2.254 1.00 0.47 H new ATOM 0 HB3 GLU A 13 -5.755 1.558 1.899 1.00 0.47 H new ATOM 0 HG2 GLU A 13 -5.997 1.347 -0.384 1.00 0.50 H new ATOM 0 HG3 GLU A 13 -6.814 -0.200 -0.273 1.00 0.50 H new ATOM 166 N ILE A 14 -3.199 0.115 2.291 1.00 0.38 N ATOM 167 CA ILE A 14 -1.806 0.352 1.936 1.00 0.38 C ATOM 168 C ILE A 14 -1.075 -0.959 1.672 1.00 0.35 C ATOM 169 O ILE A 14 -0.334 -1.084 0.697 1.00 0.39 O ATOM 170 CB ILE A 14 -1.068 1.125 3.045 1.00 0.41 C ATOM 171 CG1 ILE A 14 -1.238 2.632 2.845 1.00 0.53 C ATOM 172 CG2 ILE A 14 0.406 0.749 3.062 1.00 0.46 C ATOM 173 CD1 ILE A 14 -0.916 3.446 4.077 1.00 0.75 C ATOM 0 H ILE A 14 -3.435 0.354 3.254 1.00 0.38 H new ATOM 0 HA ILE A 14 -1.809 0.952 1.026 1.00 0.38 H new ATOM 0 HB ILE A 14 -1.502 0.854 4.008 1.00 0.41 H new ATOM 0 HG12 ILE A 14 -0.595 2.956 2.027 1.00 0.53 H new ATOM 0 HG13 ILE A 14 -2.265 2.836 2.543 1.00 0.53 H new ATOM 0 HG21 ILE A 14 0.914 1.304 3.851 1.00 0.46 H new ATOM 0 HG22 ILE A 14 0.507 -0.320 3.248 1.00 0.46 H new ATOM 0 HG23 ILE A 14 0.855 0.994 2.100 1.00 0.46 H new ATOM 0 HD11 ILE A 14 -1.059 4.505 3.861 1.00 0.75 H new ATOM 0 HD12 ILE A 14 -1.577 3.150 4.892 1.00 0.75 H new ATOM 0 HD13 ILE A 14 0.120 3.271 4.368 1.00 0.75 H new ATOM 185 N VAL A 15 -1.290 -1.936 2.547 1.00 0.33 N ATOM 186 CA VAL A 15 -0.653 -3.240 2.407 1.00 0.31 C ATOM 187 C VAL A 15 -1.250 -4.019 1.240 1.00 0.30 C ATOM 188 O VAL A 15 -0.526 -4.617 0.445 1.00 0.29 O ATOM 189 CB VAL A 15 -0.792 -4.074 3.695 1.00 0.32 C ATOM 190 CG1 VAL A 15 -1.068 -5.533 3.366 1.00 0.32 C ATOM 191 CG2 VAL A 15 0.456 -3.942 4.554 1.00 0.34 C ATOM 0 H VAL A 15 -1.900 -1.849 3.360 1.00 0.33 H new ATOM 0 HA VAL A 15 0.404 -3.058 2.215 1.00 0.31 H new ATOM 0 HB VAL A 15 -1.640 -3.689 4.262 1.00 0.32 H new ATOM 0 HG11 VAL A 15 -1.162 -6.103 4.290 1.00 0.32 H new ATOM 0 HG12 VAL A 15 -1.995 -5.609 2.797 1.00 0.32 H new ATOM 0 HG13 VAL A 15 -0.245 -5.935 2.775 1.00 0.32 H new ATOM 0 HG21 VAL A 15 0.339 -4.538 5.459 1.00 0.34 H new ATOM 0 HG22 VAL A 15 1.322 -4.297 3.995 1.00 0.34 H new ATOM 0 HG23 VAL A 15 0.603 -2.896 4.824 1.00 0.34 H new ATOM 201 N MET A 16 -2.575 -4.007 1.143 1.00 0.32 N ATOM 202 CA MET A 16 -3.269 -4.712 0.072 1.00 0.33 C ATOM 203 C MET A 16 -2.939 -4.099 -1.285 1.00 0.34 C ATOM 204 O MET A 16 -2.767 -4.811 -2.274 1.00 0.36 O ATOM 205 CB MET A 16 -4.780 -4.682 0.306 1.00 0.35 C ATOM 206 CG MET A 16 -5.331 -5.976 0.883 1.00 0.57 C ATOM 207 SD MET A 16 -6.527 -5.695 2.202 1.00 0.85 S ATOM 208 CE MET A 16 -6.578 -7.315 2.963 1.00 0.57 C ATOM 0 H MET A 16 -3.190 -3.517 1.793 1.00 0.32 H new ATOM 0 HA MET A 16 -2.931 -5.748 0.074 1.00 0.33 H new ATOM 0 HB2 MET A 16 -5.018 -3.861 0.983 1.00 0.35 H new ATOM 0 HB3 MET A 16 -5.282 -4.472 -0.639 1.00 0.35 H new ATOM 0 HG2 MET A 16 -5.803 -6.552 0.087 1.00 0.57 H new ATOM 0 HG3 MET A 16 -4.507 -6.578 1.267 1.00 0.57 H new ATOM 0 HE1 MET A 16 -7.277 -7.302 3.799 1.00 0.57 H new ATOM 0 HE2 MET A 16 -6.904 -8.052 2.229 1.00 0.57 H new ATOM 0 HE3 MET A 16 -5.584 -7.578 3.325 1.00 0.57 H new ATOM 218 N LYS A 17 -2.850 -2.773 -1.323 1.00 0.34 N ATOM 219 CA LYS A 17 -2.538 -2.063 -2.558 1.00 0.36 C ATOM 220 C LYS A 17 -1.173 -2.481 -3.094 1.00 0.33 C ATOM 221 O LYS A 17 -1.026 -2.786 -4.278 1.00 0.34 O ATOM 222 CB LYS A 17 -2.566 -0.552 -2.323 1.00 0.40 C ATOM 223 CG LYS A 17 -3.950 0.059 -2.464 1.00 1.11 C ATOM 224 CD LYS A 17 -3.946 1.536 -2.106 1.00 1.07 C ATOM 225 CE LYS A 17 -3.208 2.359 -3.149 1.00 1.25 C ATOM 226 NZ LYS A 17 -4.138 2.956 -4.146 1.00 2.06 N ATOM 0 H LYS A 17 -2.990 -2.169 -0.513 1.00 0.34 H new ATOM 0 HA LYS A 17 -3.295 -2.322 -3.299 1.00 0.36 H new ATOM 0 HB2 LYS A 17 -2.185 -0.341 -1.324 1.00 0.40 H new ATOM 0 HB3 LYS A 17 -1.891 -0.070 -3.030 1.00 0.40 H new ATOM 0 HG2 LYS A 17 -4.302 -0.067 -3.488 1.00 1.11 H new ATOM 0 HG3 LYS A 17 -4.650 -0.471 -1.818 1.00 1.11 H new ATOM 0 HD2 LYS A 17 -4.972 1.893 -2.018 1.00 1.07 H new ATOM 0 HD3 LYS A 17 -3.476 1.674 -1.132 1.00 1.07 H new ATOM 0 HE2 LYS A 17 -2.648 3.153 -2.655 1.00 1.25 H new ATOM 0 HE3 LYS A 17 -2.482 1.728 -3.662 1.00 1.25 H new ATOM 0 HZ1 LYS A 17 -3.595 3.509 -4.839 1.00 2.06 H new ATOM 0 HZ2 LYS A 17 -4.655 2.198 -4.636 1.00 2.06 H new ATOM 0 HZ3 LYS A 17 -4.815 3.578 -3.660 1.00 2.06 H new ATOM 240 N TYR A 18 -0.177 -2.493 -2.215 1.00 0.32 N ATOM 241 CA TYR A 18 1.178 -2.873 -2.599 1.00 0.33 C ATOM 242 C TYR A 18 1.192 -4.250 -3.255 1.00 0.30 C ATOM 243 O TYR A 18 1.717 -4.419 -4.355 1.00 0.34 O ATOM 244 CB TYR A 18 2.097 -2.868 -1.377 1.00 0.36 C ATOM 245 CG TYR A 18 3.544 -3.155 -1.707 1.00 0.38 C ATOM 246 CD1 TYR A 18 4.412 -2.130 -2.062 1.00 0.82 C ATOM 247 CD2 TYR A 18 4.043 -4.451 -1.663 1.00 0.68 C ATOM 248 CE1 TYR A 18 5.735 -2.389 -2.365 1.00 0.88 C ATOM 249 CE2 TYR A 18 5.365 -4.718 -1.964 1.00 0.73 C ATOM 250 CZ TYR A 18 6.207 -3.683 -2.314 1.00 0.57 C ATOM 251 OH TYR A 18 7.524 -3.944 -2.615 1.00 0.70 O ATOM 0 H TYR A 18 -0.282 -2.244 -1.231 1.00 0.32 H new ATOM 0 HA TYR A 18 1.542 -2.143 -3.322 1.00 0.33 H new ATOM 0 HB2 TYR A 18 2.031 -1.897 -0.887 1.00 0.36 H new ATOM 0 HB3 TYR A 18 1.742 -3.611 -0.663 1.00 0.36 H new ATOM 0 HD1 TYR A 18 4.047 -1.114 -2.102 1.00 0.82 H new ATOM 0 HD2 TYR A 18 3.386 -5.264 -1.389 1.00 0.68 H new ATOM 0 HE1 TYR A 18 6.396 -1.581 -2.641 1.00 0.88 H new ATOM 0 HE2 TYR A 18 5.737 -5.731 -1.925 1.00 0.73 H new ATOM 0 HH TYR A 18 8.074 -3.168 -2.378 1.00 0.70 H new ATOM 261 N ILE A 19 0.612 -5.232 -2.572 1.00 0.31 N ATOM 262 CA ILE A 19 0.559 -6.594 -3.090 1.00 0.32 C ATOM 263 C ILE A 19 -0.252 -6.660 -4.379 1.00 0.34 C ATOM 264 O ILE A 19 0.099 -7.388 -5.308 1.00 0.39 O ATOM 265 CB ILE A 19 -0.050 -7.564 -2.060 1.00 0.34 C ATOM 266 CG1 ILE A 19 1.008 -7.982 -1.037 1.00 0.41 C ATOM 267 CG2 ILE A 19 -0.631 -8.784 -2.759 1.00 0.37 C ATOM 268 CD1 ILE A 19 0.493 -8.949 0.007 1.00 0.70 C ATOM 0 H ILE A 19 0.173 -5.110 -1.660 1.00 0.31 H new ATOM 0 HA ILE A 19 1.586 -6.895 -3.296 1.00 0.32 H new ATOM 0 HB ILE A 19 -0.857 -7.054 -1.534 1.00 0.34 H new ATOM 0 HG12 ILE A 19 1.847 -8.439 -1.561 1.00 0.41 H new ATOM 0 HG13 ILE A 19 1.391 -7.092 -0.538 1.00 0.41 H new ATOM 0 HG21 ILE A 19 -1.057 -9.460 -2.017 1.00 0.37 H new ATOM 0 HG22 ILE A 19 -1.410 -8.469 -3.453 1.00 0.37 H new ATOM 0 HG23 ILE A 19 0.158 -9.299 -3.308 1.00 0.37 H new ATOM 0 HD11 ILE A 19 1.298 -9.201 0.698 1.00 0.70 H new ATOM 0 HD12 ILE A 19 -0.327 -8.488 0.557 1.00 0.70 H new ATOM 0 HD13 ILE A 19 0.137 -9.856 -0.481 1.00 0.70 H new ATOM 280 N HIS A 20 -1.339 -5.897 -4.430 1.00 0.36 N ATOM 281 CA HIS A 20 -2.200 -5.869 -5.607 1.00 0.41 C ATOM 282 C HIS A 20 -1.406 -5.481 -6.850 1.00 0.43 C ATOM 283 O HIS A 20 -1.639 -6.010 -7.938 1.00 0.50 O ATOM 284 CB HIS A 20 -3.355 -4.888 -5.397 1.00 0.47 C ATOM 285 CG HIS A 20 -4.578 -5.224 -6.193 1.00 0.75 C ATOM 286 ND1 HIS A 20 -5.331 -4.275 -6.852 1.00 1.41 N ATOM 287 CD2 HIS A 20 -5.179 -6.413 -6.436 1.00 0.91 C ATOM 288 CE1 HIS A 20 -6.343 -4.865 -7.463 1.00 1.81 C ATOM 289 NE2 HIS A 20 -6.273 -6.162 -7.227 1.00 1.47 N ATOM 0 H HIS A 20 -1.645 -5.290 -3.670 1.00 0.36 H new ATOM 0 HA HIS A 20 -2.606 -6.870 -5.755 1.00 0.41 H new ATOM 0 HB2 HIS A 20 -3.615 -4.867 -4.339 1.00 0.47 H new ATOM 0 HB3 HIS A 20 -3.022 -3.885 -5.664 1.00 0.47 H new ATOM 0 HD2 HIS A 20 -4.858 -7.379 -6.075 1.00 0.91 H new ATOM 0 HE1 HIS A 20 -7.099 -4.370 -8.055 1.00 1.81 H new ATOM 0 HE2 HIS A 20 -6.926 -6.864 -7.576 1.00 1.47 H new ATOM 297 N TYR A 21 -0.467 -4.555 -6.682 1.00 0.43 N ATOM 298 CA TYR A 21 0.362 -4.098 -7.790 1.00 0.47 C ATOM 299 C TYR A 21 1.477 -5.097 -8.081 1.00 0.51 C ATOM 300 O TYR A 21 1.615 -5.578 -9.206 1.00 0.62 O ATOM 301 CB TYR A 21 0.961 -2.726 -7.475 1.00 0.45 C ATOM 302 CG TYR A 21 2.338 -2.516 -8.064 1.00 0.46 C ATOM 303 CD1 TYR A 21 2.558 -2.647 -9.429 1.00 1.19 C ATOM 304 CD2 TYR A 21 3.418 -2.187 -7.253 1.00 1.12 C ATOM 305 CE1 TYR A 21 3.816 -2.456 -9.970 1.00 1.23 C ATOM 306 CE2 TYR A 21 4.678 -1.994 -7.787 1.00 1.13 C ATOM 307 CZ TYR A 21 4.871 -2.130 -9.146 1.00 0.56 C ATOM 308 OH TYR A 21 6.124 -1.939 -9.681 1.00 0.64 O ATOM 0 H TYR A 21 -0.262 -4.107 -5.789 1.00 0.43 H new ATOM 0 HA TYR A 21 -0.270 -4.016 -8.674 1.00 0.47 H new ATOM 0 HB2 TYR A 21 0.292 -1.952 -7.851 1.00 0.45 H new ATOM 0 HB3 TYR A 21 1.015 -2.602 -6.393 1.00 0.45 H new ATOM 0 HD1 TYR A 21 1.733 -2.902 -10.078 1.00 1.19 H new ATOM 0 HD2 TYR A 21 3.270 -2.081 -6.188 1.00 1.12 H new ATOM 0 HE1 TYR A 21 3.971 -2.562 -11.034 1.00 1.23 H new ATOM 0 HE2 TYR A 21 5.507 -1.738 -7.144 1.00 1.13 H new ATOM 0 HH TYR A 21 6.754 -1.714 -8.965 1.00 0.64 H new ATOM 318 N LYS A 22 2.269 -5.406 -7.060 1.00 0.49 N ATOM 319 CA LYS A 22 3.371 -6.349 -7.206 1.00 0.63 C ATOM 320 C LYS A 22 2.890 -7.654 -7.831 1.00 0.72 C ATOM 321 O LYS A 22 3.636 -8.325 -8.544 1.00 0.83 O ATOM 322 CB LYS A 22 4.014 -6.627 -5.846 1.00 0.66 C ATOM 323 CG LYS A 22 5.038 -7.750 -5.876 1.00 1.10 C ATOM 324 CD LYS A 22 6.071 -7.534 -6.970 1.00 1.30 C ATOM 325 CE LYS A 22 6.962 -6.340 -6.669 1.00 1.29 C ATOM 326 NZ LYS A 22 8.064 -6.691 -5.732 1.00 1.94 N ATOM 0 H LYS A 22 2.168 -5.017 -6.122 1.00 0.49 H new ATOM 0 HA LYS A 22 4.114 -5.903 -7.867 1.00 0.63 H new ATOM 0 HB2 LYS A 22 4.495 -5.717 -5.488 1.00 0.66 H new ATOM 0 HB3 LYS A 22 3.233 -6.878 -5.128 1.00 0.66 H new ATOM 0 HG2 LYS A 22 5.538 -7.813 -4.910 1.00 1.10 H new ATOM 0 HG3 LYS A 22 4.531 -8.702 -6.036 1.00 1.10 H new ATOM 0 HD2 LYS A 22 6.684 -8.429 -7.074 1.00 1.30 H new ATOM 0 HD3 LYS A 22 5.566 -7.381 -7.924 1.00 1.30 H new ATOM 0 HE2 LYS A 22 7.384 -5.959 -7.599 1.00 1.29 H new ATOM 0 HE3 LYS A 22 6.362 -5.538 -6.239 1.00 1.29 H new ATOM 0 HZ1 LYS A 22 8.866 -6.046 -5.882 1.00 1.94 H new ATOM 0 HZ2 LYS A 22 7.728 -6.603 -4.752 1.00 1.94 H new ATOM 0 HZ3 LYS A 22 8.369 -7.670 -5.906 1.00 1.94 H new ATOM 340 N LEU A 23 1.637 -8.007 -7.562 1.00 0.69 N ATOM 341 CA LEU A 23 1.058 -9.231 -8.103 1.00 0.81 C ATOM 342 C LEU A 23 0.524 -8.999 -9.512 1.00 0.83 C ATOM 343 O LEU A 23 0.688 -9.840 -10.395 1.00 0.89 O ATOM 344 CB LEU A 23 -0.064 -9.738 -7.197 1.00 0.86 C ATOM 345 CG LEU A 23 -1.016 -10.739 -7.850 1.00 0.74 C ATOM 346 CD1 LEU A 23 -0.243 -11.927 -8.400 1.00 1.23 C ATOM 347 CD2 LEU A 23 -2.068 -11.200 -6.853 1.00 1.00 C ATOM 0 H LEU A 23 1.005 -7.464 -6.974 1.00 0.69 H new ATOM 0 HA LEU A 23 1.843 -9.985 -8.148 1.00 0.81 H new ATOM 0 HB2 LEU A 23 0.381 -10.203 -6.317 1.00 0.86 H new ATOM 0 HB3 LEU A 23 -0.643 -8.883 -6.847 1.00 0.86 H new ATOM 0 HG LEU A 23 -1.522 -10.245 -8.680 1.00 0.74 H new ATOM 0 HD11 LEU A 23 -0.936 -12.630 -8.862 1.00 1.23 H new ATOM 0 HD12 LEU A 23 0.473 -11.581 -9.145 1.00 1.23 H new ATOM 0 HD13 LEU A 23 0.289 -12.422 -7.588 1.00 1.23 H new ATOM 0 HD21 LEU A 23 -2.738 -11.913 -7.334 1.00 1.00 H new ATOM 0 HD22 LEU A 23 -1.580 -11.678 -6.004 1.00 1.00 H new ATOM 0 HD23 LEU A 23 -2.641 -10.341 -6.506 1.00 1.00 H new ATOM 359 N SER A 24 -0.112 -7.849 -9.716 1.00 0.81 N ATOM 360 CA SER A 24 -0.666 -7.501 -11.021 1.00 0.85 C ATOM 361 C SER A 24 0.363 -7.711 -12.130 1.00 0.88 C ATOM 362 O SER A 24 0.006 -7.968 -13.279 1.00 0.93 O ATOM 363 CB SER A 24 -1.146 -6.048 -11.022 1.00 0.85 C ATOM 364 OG SER A 24 -1.821 -5.735 -12.228 1.00 1.30 O ATOM 0 H SER A 24 -0.257 -7.142 -8.995 1.00 0.81 H new ATOM 0 HA SER A 24 -1.514 -8.159 -11.213 1.00 0.85 H new ATOM 0 HB2 SER A 24 -1.812 -5.881 -10.175 1.00 0.85 H new ATOM 0 HB3 SER A 24 -0.294 -5.380 -10.894 1.00 0.85 H new ATOM 0 HG SER A 24 -2.119 -4.802 -12.203 1.00 1.30 H new ATOM 370 N GLN A 25 1.643 -7.608 -11.777 1.00 0.88 N ATOM 371 CA GLN A 25 2.717 -7.795 -12.743 1.00 0.93 C ATOM 372 C GLN A 25 2.523 -9.093 -13.523 1.00 0.91 C ATOM 373 O GLN A 25 2.932 -9.200 -14.679 1.00 0.95 O ATOM 374 CB GLN A 25 4.073 -7.808 -12.035 1.00 1.00 C ATOM 375 CG GLN A 25 4.849 -6.511 -12.185 1.00 1.24 C ATOM 376 CD GLN A 25 5.992 -6.626 -13.175 1.00 2.05 C ATOM 377 OE1 GLN A 25 6.606 -7.684 -13.312 1.00 2.76 O ATOM 378 NE2 GLN A 25 6.284 -5.534 -13.871 1.00 2.65 N ATOM 0 H GLN A 25 1.958 -7.396 -10.830 1.00 0.88 H new ATOM 0 HA GLN A 25 2.692 -6.962 -13.445 1.00 0.93 H new ATOM 0 HB2 GLN A 25 3.918 -8.009 -10.975 1.00 1.00 H new ATOM 0 HB3 GLN A 25 4.672 -8.628 -12.430 1.00 1.00 H new ATOM 0 HG2 GLN A 25 4.171 -5.722 -12.509 1.00 1.24 H new ATOM 0 HG3 GLN A 25 5.243 -6.214 -11.213 1.00 1.24 H new ATOM 0 HE21 GLN A 25 5.749 -4.678 -13.725 1.00 2.65 H new ATOM 0 HE22 GLN A 25 7.044 -5.551 -14.551 1.00 2.65 H new ATOM 387 N ARG A 26 1.896 -10.079 -12.884 1.00 0.89 N ATOM 388 CA ARG A 26 1.648 -11.369 -13.520 1.00 0.92 C ATOM 389 C ARG A 26 0.273 -11.399 -14.181 1.00 0.86 C ATOM 390 O ARG A 26 0.094 -12.008 -15.236 1.00 1.06 O ATOM 391 CB ARG A 26 1.751 -12.497 -12.491 1.00 1.01 C ATOM 392 CG ARG A 26 3.170 -12.765 -12.020 1.00 1.26 C ATOM 393 CD ARG A 26 3.203 -13.147 -10.549 1.00 1.31 C ATOM 394 NE ARG A 26 4.298 -14.066 -10.247 1.00 1.98 N ATOM 395 CZ ARG A 26 5.586 -13.729 -10.294 1.00 2.73 C ATOM 396 NH1 ARG A 26 5.950 -12.496 -10.625 1.00 3.19 N ATOM 397 NH2 ARG A 26 6.516 -14.631 -10.006 1.00 3.49 N ATOM 0 H ARG A 26 1.551 -10.008 -11.927 1.00 0.89 H new ATOM 0 HA ARG A 26 2.406 -11.514 -14.290 1.00 0.92 H new ATOM 0 HB2 ARG A 26 1.132 -12.248 -11.629 1.00 1.01 H new ATOM 0 HB3 ARG A 26 1.342 -13.410 -12.924 1.00 1.01 H new ATOM 0 HG2 ARG A 26 3.607 -13.566 -12.616 1.00 1.26 H new ATOM 0 HG3 ARG A 26 3.782 -11.878 -12.181 1.00 1.26 H new ATOM 0 HD2 ARG A 26 3.307 -12.247 -9.943 1.00 1.31 H new ATOM 0 HD3 ARG A 26 2.255 -13.609 -10.273 1.00 1.31 H new ATOM 0 HE ARG A 26 4.062 -15.023 -9.984 1.00 1.98 H new ATOM 0 HH11 ARG A 26 5.241 -11.797 -10.846 1.00 3.19 H new ATOM 0 HH12 ARG A 26 6.939 -12.248 -10.658 1.00 3.19 H new ATOM 0 HH21 ARG A 26 6.244 -15.580 -9.749 1.00 3.49 H new ATOM 0 HH22 ARG A 26 7.503 -14.375 -10.041 1.00 3.49 H new ATOM 411 N GLY A 27 -0.695 -10.738 -13.553 1.00 0.95 N ATOM 412 CA GLY A 27 -2.041 -10.703 -14.096 1.00 1.00 C ATOM 413 C GLY A 27 -3.036 -11.486 -13.257 1.00 1.03 C ATOM 414 O GLY A 27 -4.235 -11.209 -13.292 1.00 1.86 O ATOM 0 H GLY A 27 -0.572 -10.227 -12.679 1.00 0.95 H new ATOM 0 HA2 GLY A 27 -2.371 -9.667 -14.170 1.00 1.00 H new ATOM 0 HA3 GLY A 27 -2.030 -11.107 -15.108 1.00 1.00 H new ATOM 418 N TYR A 28 -2.539 -12.466 -12.505 1.00 0.78 N ATOM 419 CA TYR A 28 -3.395 -13.291 -11.657 1.00 0.70 C ATOM 420 C TYR A 28 -4.357 -12.426 -10.846 1.00 0.61 C ATOM 421 O TYR A 28 -3.958 -11.768 -9.885 1.00 0.98 O ATOM 422 CB TYR A 28 -2.539 -14.151 -10.723 1.00 0.86 C ATOM 423 CG TYR A 28 -3.230 -14.539 -9.433 1.00 0.67 C ATOM 424 CD1 TYR A 28 -4.524 -15.048 -9.434 1.00 1.17 C ATOM 425 CD2 TYR A 28 -2.584 -14.397 -8.213 1.00 1.13 C ATOM 426 CE1 TYR A 28 -5.152 -15.401 -8.255 1.00 1.16 C ATOM 427 CE2 TYR A 28 -3.203 -14.748 -7.030 1.00 1.16 C ATOM 428 CZ TYR A 28 -4.487 -15.249 -7.056 1.00 0.68 C ATOM 429 OH TYR A 28 -5.109 -15.600 -5.879 1.00 0.86 O ATOM 0 H TYR A 28 -1.549 -12.708 -12.466 1.00 0.78 H new ATOM 0 HA TYR A 28 -3.986 -13.944 -12.299 1.00 0.70 H new ATOM 0 HB2 TYR A 28 -2.243 -15.058 -11.251 1.00 0.86 H new ATOM 0 HB3 TYR A 28 -1.624 -13.609 -10.484 1.00 0.86 H new ATOM 0 HD1 TYR A 28 -5.047 -15.169 -10.371 1.00 1.17 H new ATOM 0 HD2 TYR A 28 -1.578 -14.005 -8.189 1.00 1.13 H new ATOM 0 HE1 TYR A 28 -6.158 -15.794 -8.272 1.00 1.16 H new ATOM 0 HE2 TYR A 28 -2.684 -14.631 -6.090 1.00 1.16 H new ATOM 0 HH TYR A 28 -5.319 -14.792 -5.366 1.00 0.86 H new ATOM 439 N GLU A 29 -5.627 -12.434 -11.242 1.00 0.79 N ATOM 440 CA GLU A 29 -6.650 -11.654 -10.554 1.00 0.76 C ATOM 441 C GLU A 29 -6.851 -12.159 -9.129 1.00 0.72 C ATOM 442 O GLU A 29 -7.361 -13.258 -8.916 1.00 0.72 O ATOM 443 CB GLU A 29 -7.972 -11.718 -11.320 1.00 0.80 C ATOM 444 CG GLU A 29 -7.857 -11.275 -12.769 1.00 1.32 C ATOM 445 CD GLU A 29 -9.196 -10.892 -13.369 1.00 1.82 C ATOM 446 OE1 GLU A 29 -10.195 -10.860 -12.620 1.00 2.29 O ATOM 447 OE2 GLU A 29 -9.245 -10.624 -14.588 1.00 2.45 O ATOM 0 H GLU A 29 -5.972 -12.973 -12.037 1.00 0.79 H new ATOM 0 HA GLU A 29 -6.313 -10.618 -10.510 1.00 0.76 H new ATOM 0 HB2 GLU A 29 -8.351 -12.740 -11.290 1.00 0.80 H new ATOM 0 HB3 GLU A 29 -8.706 -11.091 -10.814 1.00 0.80 H new ATOM 0 HG2 GLU A 29 -7.178 -10.425 -12.832 1.00 1.32 H new ATOM 0 HG3 GLU A 29 -7.416 -12.080 -13.357 1.00 1.32 H new ATOM 454 N TRP A 30 -6.441 -11.351 -8.157 1.00 0.71 N ATOM 455 CA TRP A 30 -6.569 -11.716 -6.751 1.00 0.69 C ATOM 456 C TRP A 30 -7.831 -11.115 -6.138 1.00 0.78 C ATOM 457 O TRP A 30 -8.753 -11.838 -5.759 1.00 1.17 O ATOM 458 CB TRP A 30 -5.336 -11.246 -5.978 1.00 0.66 C ATOM 459 CG TRP A 30 -5.395 -11.551 -4.514 1.00 0.64 C ATOM 460 CD1 TRP A 30 -5.987 -12.631 -3.925 1.00 0.66 C ATOM 461 CD2 TRP A 30 -4.840 -10.767 -3.452 1.00 0.64 C ATOM 462 NE1 TRP A 30 -5.833 -12.566 -2.562 1.00 0.66 N ATOM 463 CE2 TRP A 30 -5.133 -11.431 -2.246 1.00 0.64 C ATOM 464 CE3 TRP A 30 -4.124 -9.568 -3.404 1.00 0.66 C ATOM 465 CZ2 TRP A 30 -4.734 -10.936 -1.007 1.00 0.66 C ATOM 466 CZ3 TRP A 30 -3.728 -9.077 -2.174 1.00 0.69 C ATOM 467 CH2 TRP A 30 -4.034 -9.760 -0.990 1.00 0.69 C ATOM 0 H TRP A 30 -6.017 -10.438 -8.318 1.00 0.71 H new ATOM 0 HA TRP A 30 -6.646 -12.801 -6.686 1.00 0.69 H new ATOM 0 HB2 TRP A 30 -4.450 -11.717 -6.403 1.00 0.66 H new ATOM 0 HB3 TRP A 30 -5.221 -10.170 -6.112 1.00 0.66 H new ATOM 0 HD1 TRP A 30 -6.501 -13.420 -4.453 1.00 0.66 H new ATOM 0 HE1 TRP A 30 -6.183 -13.252 -1.893 1.00 0.66 H new ATOM 0 HE3 TRP A 30 -3.884 -9.034 -4.312 1.00 0.66 H new ATOM 0 HZ2 TRP A 30 -4.968 -11.461 -0.093 1.00 0.66 H new ATOM 0 HZ3 TRP A 30 -3.174 -8.151 -2.125 1.00 0.69 H new ATOM 0 HH2 TRP A 30 -3.711 -9.350 -0.044 1.00 0.69 H new ATOM 478 N ASP A 31 -7.863 -9.791 -6.041 1.00 0.77 N ATOM 479 CA ASP A 31 -9.011 -9.092 -5.470 1.00 0.85 C ATOM 480 C ASP A 31 -9.074 -9.277 -3.954 1.00 0.78 C ATOM 481 O ASP A 31 -10.145 -9.174 -3.355 1.00 0.80 O ATOM 482 CB ASP A 31 -10.307 -9.595 -6.110 1.00 0.94 C ATOM 483 CG ASP A 31 -11.172 -8.463 -6.629 1.00 1.58 C ATOM 484 OD1 ASP A 31 -10.610 -7.423 -7.030 1.00 2.08 O ATOM 485 OD2 ASP A 31 -12.411 -8.618 -6.634 1.00 2.38 O ATOM 0 H ASP A 31 -7.108 -9.179 -6.350 1.00 0.77 H new ATOM 0 HA ASP A 31 -8.894 -8.029 -5.679 1.00 0.85 H new ATOM 0 HB2 ASP A 31 -10.066 -10.270 -6.931 1.00 0.94 H new ATOM 0 HB3 ASP A 31 -10.870 -10.173 -5.377 1.00 0.94 H new ATOM 490 N ALA A 32 -7.924 -9.552 -3.339 1.00 0.78 N ATOM 491 CA ALA A 32 -7.849 -9.751 -1.893 1.00 0.88 C ATOM 492 C ALA A 32 -8.394 -11.121 -1.484 1.00 0.90 C ATOM 493 O ALA A 32 -7.684 -11.923 -0.878 1.00 1.28 O ATOM 494 CB ALA A 32 -8.601 -8.645 -1.166 1.00 1.04 C ATOM 0 H ALA A 32 -7.030 -9.642 -3.822 1.00 0.78 H new ATOM 0 HA ALA A 32 -6.798 -9.713 -1.608 1.00 0.88 H new ATOM 0 HB1 ALA A 32 -8.536 -8.807 -0.090 1.00 1.04 H new ATOM 0 HB2 ALA A 32 -8.159 -7.680 -1.415 1.00 1.04 H new ATOM 0 HB3 ALA A 32 -9.647 -8.655 -1.472 1.00 1.04 H new ATOM 500 N GLY A 33 -9.656 -11.382 -1.814 1.00 0.80 N ATOM 501 CA GLY A 33 -10.263 -12.654 -1.468 1.00 0.92 C ATOM 502 C GLY A 33 -11.689 -12.504 -0.974 1.00 1.21 C ATOM 503 O GLY A 33 -11.971 -12.730 0.203 1.00 1.87 O ATOM 0 H GLY A 33 -10.267 -10.736 -2.314 1.00 0.80 H new ATOM 0 HA2 GLY A 33 -10.251 -13.307 -2.340 1.00 0.92 H new ATOM 0 HA3 GLY A 33 -9.665 -13.140 -0.698 1.00 0.92 H new ATOM 507 N ASP A 34 -12.588 -12.124 -1.875 1.00 1.69 N ATOM 508 CA ASP A 34 -13.993 -11.945 -1.526 1.00 2.13 C ATOM 509 C ASP A 34 -14.138 -11.112 -0.256 1.00 2.25 C ATOM 510 O ASP A 34 -15.083 -11.293 0.512 1.00 2.69 O ATOM 511 CB ASP A 34 -14.669 -13.305 -1.337 1.00 2.93 C ATOM 512 CG ASP A 34 -16.182 -13.205 -1.342 1.00 3.35 C ATOM 513 OD1 ASP A 34 -16.775 -13.240 -2.440 1.00 3.65 O ATOM 514 OD2 ASP A 34 -16.773 -13.091 -0.248 1.00 3.91 O ATOM 0 H ASP A 34 -12.369 -11.934 -2.853 1.00 1.69 H new ATOM 0 HA ASP A 34 -14.480 -11.414 -2.344 1.00 2.13 H new ATOM 0 HB2 ASP A 34 -14.350 -13.980 -2.131 1.00 2.93 H new ATOM 0 HB3 ASP A 34 -14.340 -13.743 -0.395 1.00 2.93 H new ATOM 519 N ASP A 35 -13.195 -10.200 -0.041 1.00 2.37 N ATOM 520 CA ASP A 35 -13.219 -9.339 1.136 1.00 2.84 C ATOM 521 C ASP A 35 -13.630 -7.919 0.763 1.00 3.10 C ATOM 522 O ASP A 35 -13.192 -6.951 1.385 1.00 3.71 O ATOM 523 CB ASP A 35 -11.847 -9.325 1.811 1.00 3.09 C ATOM 524 CG ASP A 35 -11.930 -8.981 3.285 1.00 3.86 C ATOM 525 OD1 ASP A 35 -12.282 -9.874 4.085 1.00 4.32 O ATOM 526 OD2 ASP A 35 -11.643 -7.818 3.641 1.00 4.47 O ATOM 0 H ASP A 35 -12.405 -10.038 -0.666 1.00 2.37 H new ATOM 0 HA ASP A 35 -13.955 -9.739 1.833 1.00 2.84 H new ATOM 0 HB2 ASP A 35 -11.378 -10.302 1.695 1.00 3.09 H new ATOM 0 HB3 ASP A 35 -11.205 -8.602 1.308 1.00 3.09 H new ATOM 531 N VAL A 36 -14.476 -7.802 -0.256 1.00 3.12 N ATOM 532 CA VAL A 36 -14.947 -6.500 -0.713 1.00 3.71 C ATOM 533 C VAL A 36 -15.884 -6.643 -1.907 1.00 3.85 C ATOM 534 O VAL A 36 -15.449 -6.958 -3.015 1.00 4.28 O ATOM 535 CB VAL A 36 -13.773 -5.583 -1.104 1.00 4.34 C ATOM 536 CG1 VAL A 36 -12.599 -6.404 -1.613 1.00 4.51 C ATOM 537 CG2 VAL A 36 -14.214 -4.566 -2.146 1.00 4.85 C ATOM 0 H VAL A 36 -14.849 -8.593 -0.781 1.00 3.12 H new ATOM 0 HA VAL A 36 -15.488 -6.050 0.119 1.00 3.71 H new ATOM 0 HB VAL A 36 -13.448 -5.041 -0.216 1.00 4.34 H new ATOM 0 HG11 VAL A 36 -11.780 -5.738 -1.884 1.00 4.51 H new ATOM 0 HG12 VAL A 36 -12.267 -7.088 -0.832 1.00 4.51 H new ATOM 0 HG13 VAL A 36 -12.907 -6.975 -2.489 1.00 4.51 H new ATOM 0 HG21 VAL A 36 -13.371 -3.927 -2.410 1.00 4.85 H new ATOM 0 HG22 VAL A 36 -14.567 -5.087 -3.036 1.00 4.85 H new ATOM 0 HG23 VAL A 36 -15.020 -3.955 -1.740 1.00 4.85 H new ATOM 547 N GLU A 37 -17.171 -6.409 -1.675 1.00 3.92 N ATOM 548 CA GLU A 37 -18.170 -6.512 -2.732 1.00 4.45 C ATOM 549 C GLU A 37 -17.791 -5.640 -3.925 1.00 4.85 C ATOM 550 O GLU A 37 -17.649 -6.130 -5.045 1.00 5.41 O ATOM 551 CB GLU A 37 -19.546 -6.103 -2.205 1.00 4.91 C ATOM 552 CG GLU A 37 -19.936 -6.805 -0.914 1.00 5.38 C ATOM 553 CD GLU A 37 -20.446 -5.843 0.142 1.00 6.27 C ATOM 554 OE1 GLU A 37 -21.635 -5.466 0.076 1.00 6.73 O ATOM 555 OE2 GLU A 37 -19.656 -5.467 1.033 1.00 6.72 O ATOM 0 H GLU A 37 -17.547 -6.147 -0.764 1.00 3.92 H new ATOM 0 HA GLU A 37 -18.209 -7.551 -3.060 1.00 4.45 H new ATOM 0 HB2 GLU A 37 -19.557 -5.026 -2.041 1.00 4.91 H new ATOM 0 HB3 GLU A 37 -20.296 -6.317 -2.966 1.00 4.91 H new ATOM 0 HG2 GLU A 37 -20.706 -7.547 -1.126 1.00 5.38 H new ATOM 0 HG3 GLU A 37 -19.073 -7.344 -0.523 1.00 5.38 H new ATOM 562 N GLU A 38 -17.629 -4.344 -3.677 1.00 4.94 N ATOM 563 CA GLU A 38 -17.266 -3.403 -4.730 1.00 5.56 C ATOM 564 C GLU A 38 -16.318 -2.332 -4.200 1.00 5.32 C ATOM 565 O GLU A 38 -15.961 -2.333 -3.022 1.00 5.51 O ATOM 566 CB GLU A 38 -18.521 -2.748 -5.310 1.00 6.28 C ATOM 567 CG GLU A 38 -19.088 -1.640 -4.438 1.00 6.69 C ATOM 568 CD GLU A 38 -20.589 -1.751 -4.257 1.00 7.53 C ATOM 569 OE1 GLU A 38 -21.108 -2.887 -4.282 1.00 8.22 O ATOM 570 OE2 GLU A 38 -21.246 -0.702 -4.090 1.00 7.73 O ATOM 0 H GLU A 38 -17.744 -3.922 -2.756 1.00 4.94 H new ATOM 0 HA GLU A 38 -16.755 -3.956 -5.518 1.00 5.56 H new ATOM 0 HB2 GLU A 38 -18.287 -2.341 -6.294 1.00 6.28 H new ATOM 0 HB3 GLU A 38 -19.285 -3.512 -5.455 1.00 6.28 H new ATOM 0 HG2 GLU A 38 -18.605 -1.668 -3.461 1.00 6.69 H new ATOM 0 HG3 GLU A 38 -18.850 -0.674 -4.884 1.00 6.69 H new ATOM 577 N ASN A 39 -15.914 -1.420 -5.079 1.00 5.31 N ATOM 578 CA ASN A 39 -15.008 -0.342 -4.700 1.00 5.45 C ATOM 579 C ASN A 39 -15.569 1.012 -5.121 1.00 5.56 C ATOM 580 O ASN A 39 -14.886 1.805 -5.769 1.00 6.13 O ATOM 581 CB ASN A 39 -13.632 -0.558 -5.333 1.00 6.05 C ATOM 582 CG ASN A 39 -13.717 -1.267 -6.671 1.00 6.37 C ATOM 583 OD1 ASN A 39 -13.114 -2.322 -6.866 1.00 6.63 O ATOM 584 ND2 ASN A 39 -14.467 -0.688 -7.601 1.00 6.70 N ATOM 0 H ASN A 39 -16.200 -1.406 -6.058 1.00 5.31 H new ATOM 0 HA ASN A 39 -14.905 -0.351 -3.615 1.00 5.45 H new ATOM 0 HB2 ASN A 39 -13.141 0.406 -5.466 1.00 6.05 H new ATOM 0 HB3 ASN A 39 -13.010 -1.142 -4.654 1.00 6.05 H new ATOM 0 HD21 ASN A 39 -14.561 -1.118 -8.521 1.00 6.70 H new ATOM 0 HD22 ASN A 39 -14.949 0.187 -7.395 1.00 6.70 H new ATOM 591 N ARG A 40 -16.819 1.270 -4.748 1.00 5.33 N ATOM 592 CA ARG A 40 -17.474 2.528 -5.087 1.00 5.69 C ATOM 593 C ARG A 40 -17.680 3.393 -3.846 1.00 5.38 C ATOM 594 O ARG A 40 -17.709 4.620 -3.934 1.00 5.53 O ATOM 595 CB ARG A 40 -18.820 2.258 -5.763 1.00 6.50 C ATOM 596 CG ARG A 40 -19.854 1.640 -4.835 1.00 6.82 C ATOM 597 CD ARG A 40 -20.759 2.697 -4.225 1.00 7.59 C ATOM 598 NE ARG A 40 -20.987 2.467 -2.801 1.00 8.20 N ATOM 599 CZ ARG A 40 -21.806 3.201 -2.050 1.00 8.93 C ATOM 600 NH1 ARG A 40 -22.480 4.216 -2.581 1.00 9.19 N ATOM 601 NH2 ARG A 40 -21.954 2.920 -0.763 1.00 9.63 N ATOM 0 H ARG A 40 -17.398 0.624 -4.211 1.00 5.33 H new ATOM 0 HA ARG A 40 -16.827 3.069 -5.778 1.00 5.69 H new ATOM 0 HB2 ARG A 40 -19.213 3.195 -6.159 1.00 6.50 H new ATOM 0 HB3 ARG A 40 -18.664 1.594 -6.613 1.00 6.50 H new ATOM 0 HG2 ARG A 40 -20.456 0.920 -5.388 1.00 6.82 H new ATOM 0 HG3 ARG A 40 -19.349 1.090 -4.041 1.00 6.82 H new ATOM 0 HD2 ARG A 40 -20.313 3.681 -4.366 1.00 7.59 H new ATOM 0 HD3 ARG A 40 -21.715 2.702 -4.749 1.00 7.59 H new ATOM 0 HE ARG A 40 -20.489 1.697 -2.354 1.00 8.20 H new ATOM 0 HH11 ARG A 40 -22.372 4.438 -3.571 1.00 9.19 H new ATOM 0 HH12 ARG A 40 -23.105 4.773 -1.999 1.00 9.19 H new ATOM 0 HH21 ARG A 40 -21.441 2.142 -0.349 1.00 9.63 H new ATOM 0 HH22 ARG A 40 -22.581 3.482 -0.187 1.00 9.63 H new ATOM 615 N THR A 41 -17.823 2.746 -2.692 1.00 5.30 N ATOM 616 CA THR A 41 -18.027 3.458 -1.435 1.00 5.36 C ATOM 617 C THR A 41 -17.021 4.596 -1.282 1.00 4.97 C ATOM 618 O THR A 41 -17.364 5.681 -0.813 1.00 5.23 O ATOM 619 CB THR A 41 -17.908 2.494 -0.254 1.00 5.68 C ATOM 620 OG1 THR A 41 -19.042 2.592 0.589 1.00 6.21 O ATOM 621 CG2 THR A 41 -16.681 2.739 0.598 1.00 6.06 C ATOM 0 H THR A 41 -17.801 1.730 -2.602 1.00 5.30 H new ATOM 0 HA THR A 41 -19.030 3.885 -1.448 1.00 5.36 H new ATOM 0 HB THR A 41 -17.830 1.502 -0.698 1.00 5.68 H new ATOM 0 HG1 THR A 41 -18.948 1.967 1.338 1.00 6.21 H new ATOM 0 HG21 THR A 41 -16.658 2.021 1.418 1.00 6.06 H new ATOM 0 HG22 THR A 41 -15.785 2.622 -0.012 1.00 6.06 H new ATOM 0 HG23 THR A 41 -16.715 3.751 1.003 1.00 6.06 H new ATOM 629 N GLU A 42 -15.780 4.340 -1.683 1.00 4.77 N ATOM 630 CA GLU A 42 -14.726 5.345 -1.592 1.00 4.74 C ATOM 631 C GLU A 42 -15.121 6.613 -2.342 1.00 4.19 C ATOM 632 O GLU A 42 -15.490 6.561 -3.515 1.00 4.37 O ATOM 633 CB GLU A 42 -13.416 4.792 -2.156 1.00 5.34 C ATOM 634 CG GLU A 42 -13.435 4.602 -3.663 1.00 6.08 C ATOM 635 CD GLU A 42 -12.813 3.288 -4.094 1.00 6.94 C ATOM 636 OE1 GLU A 42 -12.924 2.302 -3.334 1.00 7.39 O ATOM 637 OE2 GLU A 42 -12.217 3.244 -5.190 1.00 7.43 O ATOM 0 H GLU A 42 -15.479 3.447 -2.074 1.00 4.77 H new ATOM 0 HA GLU A 42 -14.584 5.594 -0.541 1.00 4.74 H new ATOM 0 HB2 GLU A 42 -12.603 5.469 -1.894 1.00 5.34 H new ATOM 0 HB3 GLU A 42 -13.200 3.835 -1.680 1.00 5.34 H new ATOM 0 HG2 GLU A 42 -14.465 4.646 -4.018 1.00 6.08 H new ATOM 0 HG3 GLU A 42 -12.900 5.425 -4.136 1.00 6.08 H new ATOM 644 N ALA A 43 -15.043 7.750 -1.658 1.00 4.01 N ATOM 645 CA ALA A 43 -15.395 9.028 -2.264 1.00 3.97 C ATOM 646 C ALA A 43 -14.149 9.770 -2.745 1.00 3.66 C ATOM 647 O ALA A 43 -13.115 9.749 -2.078 1.00 3.42 O ATOM 648 CB ALA A 43 -16.170 9.884 -1.273 1.00 4.54 C ATOM 0 H ALA A 43 -14.740 7.812 -0.686 1.00 4.01 H new ATOM 0 HA ALA A 43 -16.026 8.831 -3.131 1.00 3.97 H new ATOM 0 HB1 ALA A 43 -16.427 10.836 -1.738 1.00 4.54 H new ATOM 0 HB2 ALA A 43 -17.083 9.365 -0.980 1.00 4.54 H new ATOM 0 HB3 ALA A 43 -15.556 10.065 -0.391 1.00 4.54 H new ATOM 654 N PRO A 44 -14.225 10.441 -3.913 1.00 4.17 N ATOM 655 CA PRO A 44 -13.089 11.188 -4.467 1.00 4.41 C ATOM 656 C PRO A 44 -12.609 12.293 -3.528 1.00 4.25 C ATOM 657 O PRO A 44 -12.970 13.459 -3.686 1.00 4.93 O ATOM 658 CB PRO A 44 -13.643 11.794 -5.764 1.00 5.50 C ATOM 659 CG PRO A 44 -14.842 10.975 -6.096 1.00 5.78 C ATOM 660 CD PRO A 44 -15.412 10.524 -4.783 1.00 5.03 C ATOM 0 HA PRO A 44 -12.223 10.545 -4.622 1.00 4.41 H new ATOM 0 HB2 PRO A 44 -13.908 12.842 -5.627 1.00 5.50 H new ATOM 0 HB3 PRO A 44 -12.904 11.754 -6.565 1.00 5.50 H new ATOM 0 HG2 PRO A 44 -15.571 11.560 -6.657 1.00 5.78 H new ATOM 0 HG3 PRO A 44 -14.571 10.121 -6.718 1.00 5.78 H new ATOM 0 HD2 PRO A 44 -16.145 11.232 -4.398 1.00 5.03 H new ATOM 0 HD3 PRO A 44 -15.915 9.561 -4.872 1.00 5.03 H new ATOM 668 N GLU A 45 -11.794 11.918 -2.548 1.00 3.68 N ATOM 669 CA GLU A 45 -11.268 12.879 -1.585 1.00 3.85 C ATOM 670 C GLU A 45 -10.110 12.281 -0.792 1.00 3.58 C ATOM 671 O GLU A 45 -9.759 11.114 -0.970 1.00 3.85 O ATOM 672 CB GLU A 45 -12.373 13.334 -0.630 1.00 4.50 C ATOM 673 CG GLU A 45 -13.160 14.531 -1.139 1.00 5.18 C ATOM 674 CD GLU A 45 -13.683 15.405 -0.016 1.00 5.94 C ATOM 675 OE1 GLU A 45 -12.868 16.109 0.617 1.00 6.68 O ATOM 676 OE2 GLU A 45 -14.907 15.385 0.232 1.00 6.04 O ATOM 0 H GLU A 45 -11.484 10.958 -2.400 1.00 3.68 H new ATOM 0 HA GLU A 45 -10.897 13.741 -2.139 1.00 3.85 H new ATOM 0 HB2 GLU A 45 -13.059 12.504 -0.459 1.00 4.50 H new ATOM 0 HB3 GLU A 45 -11.929 13.584 0.334 1.00 4.50 H new ATOM 0 HG2 GLU A 45 -12.524 15.128 -1.793 1.00 5.18 H new ATOM 0 HG3 GLU A 45 -13.998 14.181 -1.742 1.00 5.18 H new ATOM 683 N GLY A 46 -9.520 13.088 0.084 1.00 3.41 N ATOM 684 CA GLY A 46 -8.408 12.623 0.891 1.00 3.37 C ATOM 685 C GLY A 46 -7.155 13.451 0.682 1.00 2.71 C ATOM 686 O GLY A 46 -6.725 14.177 1.579 1.00 2.92 O ATOM 0 H GLY A 46 -9.793 14.057 0.249 1.00 3.41 H new ATOM 0 HA2 GLY A 46 -8.689 12.654 1.944 1.00 3.37 H new ATOM 0 HA3 GLY A 46 -8.197 11.582 0.648 1.00 3.37 H new ATOM 690 N THR A 47 -6.569 13.344 -0.506 1.00 2.47 N ATOM 691 CA THR A 47 -5.358 14.089 -0.833 1.00 2.41 C ATOM 692 C THR A 47 -4.267 13.841 0.204 1.00 2.10 C ATOM 693 O THR A 47 -3.435 14.711 0.463 1.00 2.54 O ATOM 694 CB THR A 47 -5.663 15.585 -0.921 1.00 3.05 C ATOM 695 OG1 THR A 47 -5.686 16.168 0.370 1.00 3.87 O ATOM 696 CG2 THR A 47 -6.989 15.887 -1.585 1.00 3.37 C ATOM 0 H THR A 47 -6.913 12.748 -1.259 1.00 2.47 H new ATOM 0 HA THR A 47 -4.998 13.740 -1.801 1.00 2.41 H new ATOM 0 HB THR A 47 -4.865 16.008 -1.531 1.00 3.05 H new ATOM 0 HG1 THR A 47 -6.275 15.646 0.954 1.00 3.87 H new ATOM 0 HG21 THR A 47 -7.144 16.966 -1.615 1.00 3.37 H new ATOM 0 HG22 THR A 47 -6.985 15.493 -2.601 1.00 3.37 H new ATOM 0 HG23 THR A 47 -7.795 15.421 -1.018 1.00 3.37 H new ATOM 704 N GLU A 48 -4.274 12.649 0.792 1.00 1.76 N ATOM 705 CA GLU A 48 -3.282 12.288 1.798 1.00 1.67 C ATOM 706 C GLU A 48 -2.627 10.935 1.494 1.00 1.41 C ATOM 707 O GLU A 48 -1.825 10.443 2.286 1.00 2.00 O ATOM 708 CB GLU A 48 -3.927 12.250 3.185 1.00 2.00 C ATOM 709 CG GLU A 48 -4.651 10.948 3.484 1.00 2.16 C ATOM 710 CD GLU A 48 -5.739 11.112 4.527 1.00 2.75 C ATOM 711 OE1 GLU A 48 -6.742 11.798 4.236 1.00 3.33 O ATOM 712 OE2 GLU A 48 -5.589 10.554 5.634 1.00 3.01 O ATOM 0 H GLU A 48 -4.955 11.917 0.589 1.00 1.76 H new ATOM 0 HA GLU A 48 -2.503 13.050 1.777 1.00 1.67 H new ATOM 0 HB2 GLU A 48 -3.156 12.409 3.939 1.00 2.00 H new ATOM 0 HB3 GLU A 48 -4.633 13.076 3.271 1.00 2.00 H new ATOM 0 HG2 GLU A 48 -5.090 10.561 2.564 1.00 2.16 H new ATOM 0 HG3 GLU A 48 -3.930 10.207 3.830 1.00 2.16 H new ATOM 719 N SER A 49 -2.964 10.335 0.351 1.00 1.02 N ATOM 720 CA SER A 49 -2.393 9.048 -0.027 1.00 0.87 C ATOM 721 C SER A 49 -2.244 8.946 -1.541 1.00 0.95 C ATOM 722 O SER A 49 -2.465 7.886 -2.127 1.00 1.49 O ATOM 723 CB SER A 49 -3.269 7.906 0.491 1.00 1.08 C ATOM 724 OG SER A 49 -4.271 8.389 1.369 1.00 1.52 O ATOM 0 H SER A 49 -3.626 10.720 -0.323 1.00 1.02 H new ATOM 0 HA SER A 49 -1.404 8.969 0.424 1.00 0.87 H new ATOM 0 HB2 SER A 49 -3.735 7.391 -0.349 1.00 1.08 H new ATOM 0 HB3 SER A 49 -2.649 7.174 1.009 1.00 1.08 H new ATOM 0 HG SER A 49 -4.818 7.640 1.685 1.00 1.52 H new ATOM 730 N GLU A 50 -1.869 10.055 -2.168 1.00 0.84 N ATOM 731 CA GLU A 50 -1.690 10.095 -3.615 1.00 1.01 C ATOM 732 C GLU A 50 -0.215 9.988 -3.994 1.00 1.01 C ATOM 733 O GLU A 50 0.121 9.543 -5.092 1.00 1.61 O ATOM 734 CB GLU A 50 -2.282 11.385 -4.186 1.00 1.21 C ATOM 735 CG GLU A 50 -3.694 11.673 -3.702 1.00 1.61 C ATOM 736 CD GLU A 50 -4.493 12.496 -4.693 1.00 2.27 C ATOM 737 OE1 GLU A 50 -3.894 13.366 -5.361 1.00 2.82 O ATOM 738 OE2 GLU A 50 -5.716 12.272 -4.801 1.00 2.84 O ATOM 0 H GLU A 50 -1.683 10.940 -1.696 1.00 0.84 H new ATOM 0 HA GLU A 50 -2.214 9.239 -4.040 1.00 1.01 H new ATOM 0 HB2 GLU A 50 -1.637 12.221 -3.917 1.00 1.21 H new ATOM 0 HB3 GLU A 50 -2.285 11.323 -5.274 1.00 1.21 H new ATOM 0 HG2 GLU A 50 -4.210 10.731 -3.518 1.00 1.61 H new ATOM 0 HG3 GLU A 50 -3.647 12.202 -2.750 1.00 1.61 H new ATOM 745 N VAL A 92 0.663 10.400 -3.084 1.00 0.63 N ATOM 746 CA VAL A 92 2.101 10.349 -3.334 1.00 0.64 C ATOM 747 C VAL A 92 2.803 9.369 -2.394 1.00 0.58 C ATOM 748 O VAL A 92 3.873 8.851 -2.716 1.00 0.73 O ATOM 749 CB VAL A 92 2.754 11.738 -3.190 1.00 0.73 C ATOM 750 CG1 VAL A 92 3.088 12.316 -4.557 1.00 0.95 C ATOM 751 CG2 VAL A 92 1.851 12.681 -2.411 1.00 0.76 C ATOM 0 H VAL A 92 0.406 10.772 -2.170 1.00 0.63 H new ATOM 0 HA VAL A 92 2.220 10.005 -4.361 1.00 0.64 H new ATOM 0 HB VAL A 92 3.683 11.623 -2.632 1.00 0.73 H new ATOM 0 HG11 VAL A 92 3.548 13.297 -4.435 1.00 0.95 H new ATOM 0 HG12 VAL A 92 3.781 11.652 -5.073 1.00 0.95 H new ATOM 0 HG13 VAL A 92 2.175 12.414 -5.144 1.00 0.95 H new ATOM 0 HG21 VAL A 92 2.332 13.655 -2.322 1.00 0.76 H new ATOM 0 HG22 VAL A 92 0.902 12.792 -2.935 1.00 0.76 H new ATOM 0 HG23 VAL A 92 1.670 12.273 -1.416 1.00 0.76 H new ATOM 761 N VAL A 93 2.196 9.107 -1.238 1.00 0.51 N ATOM 762 CA VAL A 93 2.770 8.179 -0.272 1.00 0.46 C ATOM 763 C VAL A 93 2.859 6.777 -0.862 1.00 0.45 C ATOM 764 O VAL A 93 3.851 6.073 -0.675 1.00 0.45 O ATOM 765 CB VAL A 93 1.938 8.128 1.023 1.00 0.52 C ATOM 766 CG1 VAL A 93 0.576 7.512 0.756 1.00 0.67 C ATOM 767 CG2 VAL A 93 2.675 7.353 2.102 1.00 0.59 C ATOM 0 H VAL A 93 1.310 9.523 -0.950 1.00 0.51 H new ATOM 0 HA VAL A 93 3.770 8.540 -0.033 1.00 0.46 H new ATOM 0 HB VAL A 93 1.790 9.148 1.377 1.00 0.52 H new ATOM 0 HG11 VAL A 93 0.002 7.484 1.682 1.00 0.67 H new ATOM 0 HG12 VAL A 93 0.044 8.111 0.017 1.00 0.67 H new ATOM 0 HG13 VAL A 93 0.703 6.498 0.377 1.00 0.67 H new ATOM 0 HG21 VAL A 93 2.071 7.328 3.009 1.00 0.59 H new ATOM 0 HG22 VAL A 93 2.856 6.334 1.759 1.00 0.59 H new ATOM 0 HG23 VAL A 93 3.627 7.840 2.313 1.00 0.59 H new ATOM 777 N HIS A 94 1.814 6.381 -1.585 1.00 0.51 N ATOM 778 CA HIS A 94 1.773 5.066 -2.213 1.00 0.57 C ATOM 779 C HIS A 94 2.696 5.022 -3.425 1.00 0.57 C ATOM 780 O HIS A 94 3.564 4.155 -3.527 1.00 0.58 O ATOM 781 CB HIS A 94 0.344 4.721 -2.638 1.00 0.66 C ATOM 782 CG HIS A 94 -0.609 4.588 -1.491 1.00 0.76 C ATOM 783 ND1 HIS A 94 -1.028 3.371 -0.997 1.00 1.02 N ATOM 784 CD2 HIS A 94 -1.233 5.529 -0.743 1.00 0.85 C ATOM 785 CE1 HIS A 94 -1.869 3.570 0.003 1.00 1.09 C ATOM 786 NE2 HIS A 94 -2.008 4.870 0.177 1.00 0.98 N ATOM 0 H HIS A 94 0.986 6.953 -1.749 1.00 0.51 H new ATOM 0 HA HIS A 94 2.114 4.331 -1.484 1.00 0.57 H new ATOM 0 HB2 HIS A 94 -0.021 5.494 -3.315 1.00 0.66 H new ATOM 0 HB3 HIS A 94 0.357 3.786 -3.199 1.00 0.66 H new ATOM 0 HD1 HIS A 94 -0.735 2.459 -1.348 1.00 1.02 H new ATOM 0 HD2 HIS A 94 -1.138 6.599 -0.851 1.00 0.85 H new ATOM 0 HE1 HIS A 94 -2.359 2.799 0.580 1.00 1.09 H new ATOM 794 N LEU A 95 2.503 5.968 -4.341 1.00 0.62 N ATOM 795 CA LEU A 95 3.320 6.043 -5.546 1.00 0.65 C ATOM 796 C LEU A 95 4.799 5.942 -5.198 1.00 0.58 C ATOM 797 O LEU A 95 5.555 5.224 -5.853 1.00 0.59 O ATOM 798 CB LEU A 95 3.048 7.350 -6.293 1.00 0.75 C ATOM 799 CG LEU A 95 1.759 7.373 -7.114 1.00 1.39 C ATOM 800 CD1 LEU A 95 1.551 8.742 -7.743 1.00 2.05 C ATOM 801 CD2 LEU A 95 1.791 6.292 -8.185 1.00 2.03 C ATOM 0 H LEU A 95 1.788 6.692 -4.270 1.00 0.62 H new ATOM 0 HA LEU A 95 3.055 5.205 -6.191 1.00 0.65 H new ATOM 0 HB2 LEU A 95 3.013 8.164 -5.569 1.00 0.75 H new ATOM 0 HB3 LEU A 95 3.888 7.551 -6.958 1.00 0.75 H new ATOM 0 HG LEU A 95 0.921 7.172 -6.446 1.00 1.39 H new ATOM 0 HD11 LEU A 95 0.629 8.739 -8.324 1.00 2.05 H new ATOM 0 HD12 LEU A 95 1.484 9.496 -6.959 1.00 2.05 H new ATOM 0 HD13 LEU A 95 2.391 8.973 -8.398 1.00 2.05 H new ATOM 0 HD21 LEU A 95 0.866 6.322 -8.760 1.00 2.03 H new ATOM 0 HD22 LEU A 95 2.638 6.464 -8.850 1.00 2.03 H new ATOM 0 HD23 LEU A 95 1.893 5.315 -7.713 1.00 2.03 H new ATOM 813 N ALA A 96 5.203 6.664 -4.159 1.00 0.56 N ATOM 814 CA ALA A 96 6.590 6.655 -3.716 1.00 0.55 C ATOM 815 C ALA A 96 6.961 5.301 -3.122 1.00 0.51 C ATOM 816 O ALA A 96 7.856 4.618 -3.620 1.00 0.52 O ATOM 817 CB ALA A 96 6.824 7.762 -2.700 1.00 0.61 C ATOM 0 H ALA A 96 4.588 7.263 -3.608 1.00 0.56 H new ATOM 0 HA ALA A 96 7.228 6.832 -4.582 1.00 0.55 H new ATOM 0 HB1 ALA A 96 7.865 7.745 -2.376 1.00 0.61 H new ATOM 0 HB2 ALA A 96 6.601 8.727 -3.156 1.00 0.61 H new ATOM 0 HB3 ALA A 96 6.174 7.609 -1.839 1.00 0.61 H new ATOM 823 N LEU A 97 6.265 4.922 -2.053 1.00 0.52 N ATOM 824 CA LEU A 97 6.512 3.649 -1.384 1.00 0.57 C ATOM 825 C LEU A 97 6.619 2.512 -2.395 1.00 0.55 C ATOM 826 O LEU A 97 7.493 1.651 -2.286 1.00 0.67 O ATOM 827 CB LEU A 97 5.392 3.355 -0.384 1.00 0.68 C ATOM 828 CG LEU A 97 5.615 2.128 0.501 1.00 0.57 C ATOM 829 CD1 LEU A 97 5.034 2.360 1.887 1.00 1.10 C ATOM 830 CD2 LEU A 97 4.997 0.893 -0.136 1.00 0.91 C ATOM 0 H LEU A 97 5.523 5.481 -1.631 1.00 0.52 H new ATOM 0 HA LEU A 97 7.460 3.723 -0.851 1.00 0.57 H new ATOM 0 HB2 LEU A 97 5.261 4.227 0.257 1.00 0.68 H new ATOM 0 HB3 LEU A 97 4.461 3.222 -0.935 1.00 0.68 H new ATOM 0 HG LEU A 97 6.688 1.964 0.600 1.00 0.57 H new ATOM 0 HD11 LEU A 97 5.201 1.477 2.504 1.00 1.10 H new ATOM 0 HD12 LEU A 97 5.520 3.221 2.346 1.00 1.10 H new ATOM 0 HD13 LEU A 97 3.963 2.548 1.806 1.00 1.10 H new ATOM 0 HD21 LEU A 97 5.165 0.029 0.507 1.00 0.91 H new ATOM 0 HD22 LEU A 97 3.926 1.047 -0.264 1.00 0.91 H new ATOM 0 HD23 LEU A 97 5.457 0.716 -1.108 1.00 0.91 H new ATOM 842 N ARG A 98 5.727 2.517 -3.380 1.00 0.47 N ATOM 843 CA ARG A 98 5.724 1.488 -4.413 1.00 0.49 C ATOM 844 C ARG A 98 6.946 1.621 -5.318 1.00 0.48 C ATOM 845 O ARG A 98 7.444 0.630 -5.854 1.00 0.50 O ATOM 846 CB ARG A 98 4.445 1.577 -5.248 1.00 0.51 C ATOM 847 CG ARG A 98 4.684 1.449 -6.743 1.00 0.91 C ATOM 848 CD ARG A 98 3.379 1.288 -7.504 1.00 1.29 C ATOM 849 NE ARG A 98 3.292 2.200 -8.642 1.00 1.76 N ATOM 850 CZ ARG A 98 3.994 2.057 -9.765 1.00 2.14 C ATOM 851 NH1 ARG A 98 4.838 1.042 -9.909 1.00 2.52 N ATOM 852 NH2 ARG A 98 3.852 2.934 -10.749 1.00 2.83 N ATOM 0 H ARG A 98 4.997 3.222 -3.485 1.00 0.47 H new ATOM 0 HA ARG A 98 5.762 0.516 -3.922 1.00 0.49 H new ATOM 0 HB2 ARG A 98 3.758 0.793 -4.930 1.00 0.51 H new ATOM 0 HB3 ARG A 98 3.956 2.530 -5.047 1.00 0.51 H new ATOM 0 HG2 ARG A 98 5.211 2.332 -7.105 1.00 0.91 H new ATOM 0 HG3 ARG A 98 5.328 0.591 -6.937 1.00 0.91 H new ATOM 0 HD2 ARG A 98 3.289 0.260 -7.856 1.00 1.29 H new ATOM 0 HD3 ARG A 98 2.542 1.469 -6.830 1.00 1.29 H new ATOM 0 HE ARG A 98 2.655 2.994 -8.572 1.00 1.76 H new ATOM 0 HH11 ARG A 98 4.953 0.364 -9.156 1.00 2.52 H new ATOM 0 HH12 ARG A 98 5.371 0.941 -10.773 1.00 2.52 H new ATOM 0 HH21 ARG A 98 3.206 3.717 -10.645 1.00 2.83 H new ATOM 0 HH22 ARG A 98 4.389 2.826 -11.610 1.00 2.83 H new ATOM 866 N GLN A 99 7.427 2.850 -5.480 1.00 0.46 N ATOM 867 CA GLN A 99 8.593 3.110 -6.316 1.00 0.47 C ATOM 868 C GLN A 99 9.878 2.735 -5.584 1.00 0.47 C ATOM 869 O GLN A 99 10.721 2.013 -6.118 1.00 0.54 O ATOM 870 CB GLN A 99 8.637 4.583 -6.725 1.00 0.47 C ATOM 871 CG GLN A 99 8.797 4.795 -8.222 1.00 0.96 C ATOM 872 CD GLN A 99 8.876 6.262 -8.597 1.00 1.12 C ATOM 873 OE1 GLN A 99 7.993 7.050 -8.259 1.00 1.72 O ATOM 874 NE2 GLN A 99 9.938 6.636 -9.302 1.00 1.71 N ATOM 0 H GLN A 99 7.027 3.681 -5.043 1.00 0.46 H new ATOM 0 HA GLN A 99 8.512 2.495 -7.212 1.00 0.47 H new ATOM 0 HB2 GLN A 99 7.720 5.071 -6.393 1.00 0.47 H new ATOM 0 HB3 GLN A 99 9.463 5.071 -6.207 1.00 0.47 H new ATOM 0 HG2 GLN A 99 9.699 4.287 -8.563 1.00 0.96 H new ATOM 0 HG3 GLN A 99 7.957 4.335 -8.742 1.00 0.96 H new ATOM 0 HE21 GLN A 99 10.646 5.949 -9.561 1.00 1.71 H new ATOM 0 HE22 GLN A 99 10.045 7.610 -9.585 1.00 1.71 H new ATOM 883 N ALA A 100 10.019 3.230 -4.359 1.00 0.45 N ATOM 884 CA ALA A 100 11.199 2.948 -3.551 1.00 0.46 C ATOM 885 C ALA A 100 11.521 1.458 -3.549 1.00 0.46 C ATOM 886 O ALA A 100 12.684 1.063 -3.636 1.00 0.45 O ATOM 887 CB ALA A 100 10.994 3.447 -2.128 1.00 0.50 C ATOM 0 H ALA A 100 9.330 3.829 -3.904 1.00 0.45 H new ATOM 0 HA ALA A 100 12.045 3.475 -3.992 1.00 0.46 H new ATOM 0 HB1 ALA A 100 11.882 3.230 -1.535 1.00 0.50 H new ATOM 0 HB2 ALA A 100 10.820 4.523 -2.141 1.00 0.50 H new ATOM 0 HB3 ALA A 100 10.132 2.946 -1.687 1.00 0.50 H new ATOM 893 N GLY A 101 10.483 0.633 -3.450 1.00 0.51 N ATOM 894 CA GLY A 101 10.677 -0.805 -3.439 1.00 0.55 C ATOM 895 C GLY A 101 11.485 -1.291 -4.626 1.00 0.52 C ATOM 896 O GLY A 101 12.442 -2.047 -4.465 1.00 0.55 O ATOM 0 H GLY A 101 9.511 0.935 -3.377 1.00 0.51 H new ATOM 0 HA2 GLY A 101 11.182 -1.093 -2.517 1.00 0.55 H new ATOM 0 HA3 GLY A 101 9.706 -1.299 -3.438 1.00 0.55 H new ATOM 900 N ASP A 102 11.100 -0.854 -5.820 1.00 0.51 N ATOM 901 CA ASP A 102 11.796 -1.249 -7.039 1.00 0.54 C ATOM 902 C ASP A 102 13.164 -0.581 -7.124 1.00 0.59 C ATOM 903 O ASP A 102 14.167 -1.231 -7.419 1.00 0.65 O ATOM 904 CB ASP A 102 10.961 -0.884 -8.268 1.00 0.55 C ATOM 905 CG ASP A 102 10.935 -1.994 -9.300 1.00 1.30 C ATOM 906 OD1 ASP A 102 11.761 -2.926 -9.191 1.00 1.96 O ATOM 907 OD2 ASP A 102 10.090 -1.933 -10.217 1.00 2.06 O ATOM 0 H ASP A 102 10.310 -0.226 -5.970 1.00 0.51 H new ATOM 0 HA ASP A 102 11.939 -2.329 -7.013 1.00 0.54 H new ATOM 0 HB2 ASP A 102 9.941 -0.657 -7.957 1.00 0.55 H new ATOM 0 HB3 ASP A 102 11.364 0.021 -8.722 1.00 0.55 H new ATOM 912 N ASP A 103 13.197 0.722 -6.865 1.00 0.61 N ATOM 913 CA ASP A 103 14.441 1.481 -6.913 1.00 0.70 C ATOM 914 C ASP A 103 15.459 0.931 -5.919 1.00 0.69 C ATOM 915 O ASP A 103 16.667 1.012 -6.144 1.00 0.78 O ATOM 916 CB ASP A 103 14.172 2.958 -6.619 1.00 0.75 C ATOM 917 CG ASP A 103 15.133 3.877 -7.347 1.00 1.24 C ATOM 918 OD1 ASP A 103 14.939 4.098 -8.561 1.00 1.81 O ATOM 919 OD2 ASP A 103 16.080 4.375 -6.703 1.00 1.88 O ATOM 0 H ASP A 103 12.376 1.275 -6.620 1.00 0.61 H new ATOM 0 HA ASP A 103 14.855 1.384 -7.917 1.00 0.70 H new ATOM 0 HB2 ASP A 103 13.150 3.203 -6.908 1.00 0.75 H new ATOM 0 HB3 ASP A 103 14.250 3.132 -5.546 1.00 0.75 H new ATOM 924 N PHE A 104 14.966 0.373 -4.817 1.00 0.63 N ATOM 925 CA PHE A 104 15.836 -0.188 -3.789 1.00 0.63 C ATOM 926 C PHE A 104 16.078 -1.675 -4.027 1.00 0.66 C ATOM 927 O PHE A 104 17.219 -2.109 -4.187 1.00 0.90 O ATOM 928 CB PHE A 104 15.227 0.024 -2.403 1.00 0.61 C ATOM 929 CG PHE A 104 15.915 -0.758 -1.321 1.00 0.67 C ATOM 930 CD1 PHE A 104 17.065 -0.270 -0.722 1.00 1.34 C ATOM 931 CD2 PHE A 104 15.412 -1.979 -0.903 1.00 1.30 C ATOM 932 CE1 PHE A 104 17.701 -0.986 0.275 1.00 1.44 C ATOM 933 CE2 PHE A 104 16.044 -2.700 0.092 1.00 1.48 C ATOM 934 CZ PHE A 104 17.190 -2.203 0.682 1.00 1.10 C ATOM 0 H PHE A 104 13.969 0.297 -4.613 1.00 0.63 H new ATOM 0 HA PHE A 104 16.794 0.330 -3.842 1.00 0.63 H new ATOM 0 HB2 PHE A 104 15.267 1.085 -2.155 1.00 0.61 H new ATOM 0 HB3 PHE A 104 14.174 -0.257 -2.430 1.00 0.61 H new ATOM 0 HD1 PHE A 104 17.469 0.681 -1.038 1.00 1.34 H new ATOM 0 HD2 PHE A 104 14.516 -2.372 -1.360 1.00 1.30 H new ATOM 0 HE1 PHE A 104 18.596 -0.594 0.735 1.00 1.44 H new ATOM 0 HE2 PHE A 104 15.642 -3.651 0.408 1.00 1.48 H new ATOM 0 HZ PHE A 104 17.685 -2.765 1.460 1.00 1.10 H new ATOM 944 N SER A 105 14.998 -2.451 -4.044 1.00 0.59 N ATOM 945 CA SER A 105 15.091 -3.891 -4.258 1.00 0.65 C ATOM 946 C SER A 105 15.997 -4.210 -5.444 1.00 0.70 C ATOM 947 O SER A 105 16.730 -5.198 -5.429 1.00 0.75 O ATOM 948 CB SER A 105 13.701 -4.486 -4.489 1.00 0.70 C ATOM 949 OG SER A 105 13.780 -5.870 -4.783 1.00 1.07 O ATOM 0 H SER A 105 14.047 -2.106 -3.912 1.00 0.59 H new ATOM 0 HA SER A 105 15.525 -4.337 -3.363 1.00 0.65 H new ATOM 0 HB2 SER A 105 13.085 -4.334 -3.602 1.00 0.70 H new ATOM 0 HB3 SER A 105 13.211 -3.964 -5.311 1.00 0.70 H new ATOM 0 HG SER A 105 13.370 -6.383 -4.055 1.00 1.07 H new ATOM 955 N ARG A 106 15.941 -3.366 -6.469 1.00 0.73 N ATOM 956 CA ARG A 106 16.758 -3.557 -7.662 1.00 0.81 C ATOM 957 C ARG A 106 18.208 -3.159 -7.401 1.00 0.81 C ATOM 958 O ARG A 106 19.129 -3.699 -8.015 1.00 0.86 O ATOM 959 CB ARG A 106 16.196 -2.741 -8.827 1.00 0.89 C ATOM 960 CG ARG A 106 14.859 -3.251 -9.338 1.00 1.12 C ATOM 961 CD ARG A 106 14.354 -2.419 -10.506 1.00 1.58 C ATOM 962 NE ARG A 106 15.228 -2.525 -11.672 1.00 1.92 N ATOM 963 CZ ARG A 106 15.237 -1.651 -12.677 1.00 2.21 C ATOM 964 NH1 ARG A 106 14.422 -0.603 -12.667 1.00 2.24 N ATOM 965 NH2 ARG A 106 16.066 -1.826 -13.697 1.00 3.08 N ATOM 0 H ARG A 106 15.339 -2.543 -6.498 1.00 0.73 H new ATOM 0 HA ARG A 106 16.732 -4.615 -7.922 1.00 0.81 H new ATOM 0 HB2 ARG A 106 16.083 -1.704 -8.512 1.00 0.89 H new ATOM 0 HB3 ARG A 106 16.915 -2.749 -9.646 1.00 0.89 H new ATOM 0 HG2 ARG A 106 14.960 -4.291 -9.648 1.00 1.12 H new ATOM 0 HG3 ARG A 106 14.127 -3.228 -8.531 1.00 1.12 H new ATOM 0 HD2 ARG A 106 13.349 -2.745 -10.775 1.00 1.58 H new ATOM 0 HD3 ARG A 106 14.280 -1.375 -10.202 1.00 1.58 H new ATOM 0 HE ARG A 106 15.870 -3.316 -11.719 1.00 1.92 H new ATOM 0 HH11 ARG A 106 13.782 -0.462 -11.885 1.00 2.24 H new ATOM 0 HH12 ARG A 106 14.436 0.061 -13.441 1.00 2.24 H new ATOM 0 HH21 ARG A 106 16.695 -2.629 -13.711 1.00 3.08 H new ATOM 0 HH22 ARG A 106 16.075 -1.158 -14.468 1.00 3.08 H new ATOM 979 N ARG A 107 18.406 -2.214 -6.487 1.00 0.79 N ATOM 980 CA ARG A 107 19.746 -1.748 -6.148 1.00 0.83 C ATOM 981 C ARG A 107 20.603 -2.896 -5.625 1.00 0.82 C ATOM 982 O ARG A 107 21.747 -3.069 -6.043 1.00 0.85 O ATOM 983 CB ARG A 107 19.672 -0.633 -5.103 1.00 0.84 C ATOM 984 CG ARG A 107 20.964 0.156 -4.964 1.00 0.97 C ATOM 985 CD ARG A 107 21.371 0.306 -3.507 1.00 1.12 C ATOM 986 NE ARG A 107 22.472 1.251 -3.340 1.00 1.65 N ATOM 987 CZ ARG A 107 22.895 1.699 -2.159 1.00 2.22 C ATOM 988 NH1 ARG A 107 22.316 1.292 -1.036 1.00 2.62 N ATOM 989 NH2 ARG A 107 23.904 2.559 -2.102 1.00 3.04 N ATOM 0 H ARG A 107 17.656 -1.756 -5.968 1.00 0.79 H new ATOM 0 HA ARG A 107 20.208 -1.356 -7.054 1.00 0.83 H new ATOM 0 HB2 ARG A 107 18.865 0.050 -5.369 1.00 0.84 H new ATOM 0 HB3 ARG A 107 19.416 -1.068 -4.137 1.00 0.84 H new ATOM 0 HG2 ARG A 107 21.759 -0.346 -5.515 1.00 0.97 H new ATOM 0 HG3 ARG A 107 20.839 1.142 -5.411 1.00 0.97 H new ATOM 0 HD2 ARG A 107 20.514 0.642 -2.924 1.00 1.12 H new ATOM 0 HD3 ARG A 107 21.665 -0.666 -3.111 1.00 1.12 H new ATOM 0 HE ARG A 107 22.946 1.588 -4.178 1.00 1.65 H new ATOM 0 HH11 ARG A 107 21.540 0.631 -1.073 1.00 2.62 H new ATOM 0 HH12 ARG A 107 22.647 1.641 -0.136 1.00 2.62 H new ATOM 0 HH21 ARG A 107 24.354 2.875 -2.961 1.00 3.04 H new ATOM 0 HH22 ARG A 107 24.230 2.904 -1.199 1.00 3.04 H new ATOM 1003 N TYR A 108 20.042 -3.678 -4.708 1.00 0.80 N ATOM 1004 CA TYR A 108 20.759 -4.810 -4.131 1.00 0.83 C ATOM 1005 C TYR A 108 20.747 -6.002 -5.082 1.00 0.88 C ATOM 1006 O TYR A 108 21.776 -6.367 -5.650 1.00 0.93 O ATOM 1007 CB TYR A 108 20.133 -5.207 -2.793 1.00 0.82 C ATOM 1008 CG TYR A 108 20.741 -4.498 -1.604 1.00 0.83 C ATOM 1009 CD1 TYR A 108 21.983 -4.875 -1.109 1.00 1.31 C ATOM 1010 CD2 TYR A 108 20.073 -3.454 -0.978 1.00 1.19 C ATOM 1011 CE1 TYR A 108 22.542 -4.231 -0.022 1.00 1.35 C ATOM 1012 CE2 TYR A 108 20.627 -2.804 0.109 1.00 1.24 C ATOM 1013 CZ TYR A 108 21.860 -3.197 0.583 1.00 0.95 C ATOM 1014 OH TYR A 108 22.414 -2.552 1.665 1.00 1.05 O ATOM 0 H TYR A 108 19.096 -3.549 -4.349 1.00 0.80 H new ATOM 0 HA TYR A 108 21.793 -4.508 -3.967 1.00 0.83 H new ATOM 0 HB2 TYR A 108 19.064 -4.994 -2.824 1.00 0.82 H new ATOM 0 HB3 TYR A 108 20.240 -6.283 -2.657 1.00 0.82 H new ATOM 0 HD1 TYR A 108 22.520 -5.684 -1.581 1.00 1.31 H new ATOM 0 HD2 TYR A 108 19.106 -3.145 -1.346 1.00 1.19 H new ATOM 0 HE1 TYR A 108 23.508 -4.536 0.352 1.00 1.35 H new ATOM 0 HE2 TYR A 108 20.096 -1.992 0.584 1.00 1.24 H new ATOM 0 HH TYR A 108 21.806 -1.847 1.972 1.00 1.05 H new ATOM 1024 N ARG A 109 19.575 -6.606 -5.247 1.00 0.90 N ATOM 1025 CA ARG A 109 19.426 -7.761 -6.127 1.00 0.99 C ATOM 1026 C ARG A 109 20.208 -8.972 -5.611 1.00 1.01 C ATOM 1027 O ARG A 109 20.403 -9.944 -6.341 1.00 1.08 O ATOM 1028 CB ARG A 109 19.889 -7.408 -7.541 1.00 1.05 C ATOM 1029 CG ARG A 109 18.922 -7.853 -8.626 1.00 1.63 C ATOM 1030 CD ARG A 109 19.349 -7.350 -9.995 1.00 2.00 C ATOM 1031 NE ARG A 109 18.639 -8.034 -11.073 1.00 1.71 N ATOM 1032 CZ ARG A 109 19.023 -8.013 -12.348 1.00 2.17 C ATOM 1033 NH1 ARG A 109 20.109 -7.343 -12.715 1.00 2.98 N ATOM 1034 NH2 ARG A 109 18.318 -8.666 -13.262 1.00 2.38 N ATOM 0 H ARG A 109 18.714 -6.316 -4.783 1.00 0.90 H new ATOM 0 HA ARG A 109 18.369 -8.028 -6.145 1.00 0.99 H new ATOM 0 HB2 ARG A 109 20.028 -6.329 -7.610 1.00 1.05 H new ATOM 0 HB3 ARG A 109 20.861 -7.867 -7.721 1.00 1.05 H new ATOM 0 HG2 ARG A 109 18.864 -8.941 -8.639 1.00 1.63 H new ATOM 0 HG3 ARG A 109 17.922 -7.484 -8.397 1.00 1.63 H new ATOM 0 HD2 ARG A 109 19.164 -6.278 -10.062 1.00 2.00 H new ATOM 0 HD3 ARG A 109 20.422 -7.497 -10.117 1.00 2.00 H new ATOM 0 HE ARG A 109 17.798 -8.560 -10.835 1.00 1.71 H new ATOM 0 HH11 ARG A 109 20.657 -6.839 -12.018 1.00 2.98 H new ATOM 0 HH12 ARG A 109 20.395 -7.333 -13.694 1.00 2.98 H new ATOM 0 HH21 ARG A 109 17.483 -9.183 -12.988 1.00 2.38 H new ATOM 0 HH22 ARG A 109 18.611 -8.651 -14.239 1.00 2.38 H new ATOM 1048 N GLY A 110 20.654 -8.918 -4.355 1.00 0.97 N ATOM 1049 CA GLY A 110 21.403 -10.025 -3.791 1.00 1.00 C ATOM 1050 C GLY A 110 20.591 -10.823 -2.789 1.00 0.93 C ATOM 1051 O GLY A 110 20.613 -12.053 -2.801 1.00 1.05 O ATOM 0 H GLY A 110 20.509 -8.130 -3.723 1.00 0.97 H new ATOM 0 HA2 GLY A 110 21.732 -10.684 -4.594 1.00 1.00 H new ATOM 0 HA3 GLY A 110 22.300 -9.642 -3.305 1.00 1.00 H new ATOM 1055 N ASP A 111 19.871 -10.119 -1.922 1.00 0.89 N ATOM 1056 CA ASP A 111 19.045 -10.765 -0.909 1.00 0.92 C ATOM 1057 C ASP A 111 17.568 -10.495 -1.162 1.00 0.98 C ATOM 1058 O ASP A 111 17.197 -9.965 -2.210 1.00 1.89 O ATOM 1059 CB ASP A 111 19.435 -10.273 0.486 1.00 0.95 C ATOM 1060 CG ASP A 111 20.936 -10.124 0.647 1.00 1.48 C ATOM 1061 OD1 ASP A 111 21.519 -9.239 -0.013 1.00 2.26 O ATOM 1062 OD2 ASP A 111 21.528 -10.894 1.433 1.00 2.10 O ATOM 0 H ASP A 111 19.843 -9.100 -1.901 1.00 0.89 H new ATOM 0 HA ASP A 111 19.215 -11.840 -0.967 1.00 0.92 H new ATOM 0 HB2 ASP A 111 18.955 -9.314 0.678 1.00 0.95 H new ATOM 0 HB3 ASP A 111 19.060 -10.972 1.233 1.00 0.95 H new ATOM 1067 N PHE A 112 16.731 -10.867 -0.197 1.00 0.56 N ATOM 1068 CA PHE A 112 15.289 -10.670 -0.299 1.00 0.53 C ATOM 1069 C PHE A 112 14.670 -11.564 -1.369 1.00 0.71 C ATOM 1070 O PHE A 112 14.167 -12.644 -1.059 1.00 1.57 O ATOM 1071 CB PHE A 112 14.961 -9.203 -0.571 1.00 0.48 C ATOM 1072 CG PHE A 112 14.641 -8.438 0.675 1.00 0.43 C ATOM 1073 CD1 PHE A 112 13.346 -8.392 1.158 1.00 1.11 C ATOM 1074 CD2 PHE A 112 15.639 -7.774 1.366 1.00 1.19 C ATOM 1075 CE1 PHE A 112 13.049 -7.693 2.312 1.00 1.18 C ATOM 1076 CE2 PHE A 112 15.350 -7.071 2.520 1.00 1.20 C ATOM 1077 CZ PHE A 112 14.052 -7.030 2.993 1.00 0.59 C ATOM 0 H PHE A 112 17.031 -11.310 0.671 1.00 0.56 H new ATOM 0 HA PHE A 112 14.854 -10.953 0.659 1.00 0.53 H new ATOM 0 HB2 PHE A 112 15.807 -8.733 -1.073 1.00 0.48 H new ATOM 0 HB3 PHE A 112 14.114 -9.146 -1.254 1.00 0.48 H new ATOM 0 HD1 PHE A 112 12.559 -8.908 0.628 1.00 1.11 H new ATOM 0 HD2 PHE A 112 16.654 -7.805 1.000 1.00 1.19 H new ATOM 0 HE1 PHE A 112 12.034 -7.665 2.681 1.00 1.18 H new ATOM 0 HE2 PHE A 112 16.136 -6.555 3.051 1.00 1.20 H new ATOM 0 HZ PHE A 112 13.822 -6.480 3.894 1.00 0.59 H new ATOM 1087 N ALA A 113 14.692 -11.111 -2.621 1.00 0.61 N ATOM 1088 CA ALA A 113 14.115 -11.880 -3.717 1.00 0.68 C ATOM 1089 C ALA A 113 14.559 -13.338 -3.664 1.00 0.77 C ATOM 1090 O ALA A 113 13.758 -14.231 -3.386 1.00 0.92 O ATOM 1091 CB ALA A 113 14.493 -11.258 -5.053 1.00 0.73 C ATOM 0 H ALA A 113 15.102 -10.219 -2.899 1.00 0.61 H new ATOM 0 HA ALA A 113 13.030 -11.857 -3.611 1.00 0.68 H new ATOM 0 HB1 ALA A 113 14.056 -11.842 -5.863 1.00 0.73 H new ATOM 0 HB2 ALA A 113 14.116 -10.236 -5.098 1.00 0.73 H new ATOM 0 HB3 ALA A 113 15.578 -11.250 -5.156 1.00 0.73 H new ATOM 1097 N GLU A 114 15.841 -13.574 -3.925 1.00 0.91 N ATOM 1098 CA GLU A 114 16.387 -14.926 -3.897 1.00 1.05 C ATOM 1099 C GLU A 114 16.379 -15.482 -2.476 1.00 1.01 C ATOM 1100 O GLU A 114 16.249 -16.689 -2.272 1.00 1.12 O ATOM 1101 CB GLU A 114 17.812 -14.939 -4.457 1.00 1.28 C ATOM 1102 CG GLU A 114 18.794 -14.107 -3.649 1.00 2.14 C ATOM 1103 CD GLU A 114 20.226 -14.574 -3.816 1.00 2.64 C ATOM 1104 OE1 GLU A 114 20.717 -14.587 -4.964 1.00 2.92 O ATOM 1105 OE2 GLU A 114 20.858 -14.927 -2.798 1.00 3.21 O ATOM 0 H GLU A 114 16.519 -12.849 -4.158 1.00 0.91 H new ATOM 0 HA GLU A 114 15.757 -15.560 -4.521 1.00 1.05 H new ATOM 0 HB2 GLU A 114 18.168 -15.968 -4.496 1.00 1.28 H new ATOM 0 HB3 GLU A 114 17.793 -14.569 -5.482 1.00 1.28 H new ATOM 0 HG2 GLU A 114 18.718 -13.063 -3.954 1.00 2.14 H new ATOM 0 HG3 GLU A 114 18.521 -14.152 -2.595 1.00 2.14 H new ATOM 1112 N MET A 115 16.510 -14.593 -1.496 1.00 0.98 N ATOM 1113 CA MET A 115 16.510 -14.993 -0.093 1.00 1.08 C ATOM 1114 C MET A 115 15.233 -15.753 0.264 1.00 1.05 C ATOM 1115 O MET A 115 15.205 -16.511 1.234 1.00 1.11 O ATOM 1116 CB MET A 115 16.654 -13.764 0.806 1.00 1.27 C ATOM 1117 CG MET A 115 16.584 -14.082 2.290 1.00 1.30 C ATOM 1118 SD MET A 115 16.502 -12.600 3.314 1.00 1.45 S ATOM 1119 CE MET A 115 14.861 -12.004 2.917 1.00 0.90 C ATOM 0 H MET A 115 16.618 -13.590 -1.648 1.00 0.98 H new ATOM 0 HA MET A 115 17.359 -15.658 0.068 1.00 1.08 H new ATOM 0 HB2 MET A 115 17.606 -13.278 0.592 1.00 1.27 H new ATOM 0 HB3 MET A 115 15.868 -13.050 0.559 1.00 1.27 H new ATOM 0 HG2 MET A 115 15.709 -14.702 2.484 1.00 1.30 H new ATOM 0 HG3 MET A 115 17.459 -14.667 2.574 1.00 1.30 H new ATOM 0 HE1 MET A 115 14.914 -10.952 2.638 1.00 0.90 H new ATOM 0 HE2 MET A 115 14.456 -12.580 2.085 1.00 0.90 H new ATOM 0 HE3 MET A 115 14.213 -12.117 3.786 1.00 0.90 H new ATOM 1129 N SER A 116 14.176 -15.550 -0.524 1.00 1.07 N ATOM 1130 CA SER A 116 12.901 -16.219 -0.286 1.00 1.20 C ATOM 1131 C SER A 116 13.008 -17.738 -0.457 1.00 1.08 C ATOM 1132 O SER A 116 12.100 -18.472 -0.067 1.00 1.15 O ATOM 1133 CB SER A 116 11.834 -15.668 -1.234 1.00 1.46 C ATOM 1134 OG SER A 116 11.623 -16.542 -2.328 1.00 2.14 O ATOM 0 H SER A 116 14.180 -14.927 -1.332 1.00 1.07 H new ATOM 0 HA SER A 116 12.617 -16.019 0.747 1.00 1.20 H new ATOM 0 HB2 SER A 116 10.899 -15.527 -0.692 1.00 1.46 H new ATOM 0 HB3 SER A 116 12.140 -14.688 -1.601 1.00 1.46 H new ATOM 0 HG SER A 116 10.840 -17.105 -2.151 1.00 2.14 H new ATOM 1140 N SER A 117 14.115 -18.214 -1.031 1.00 0.97 N ATOM 1141 CA SER A 117 14.310 -19.645 -1.229 1.00 0.98 C ATOM 1142 C SER A 117 14.451 -20.361 0.111 1.00 0.85 C ATOM 1143 O SER A 117 14.071 -21.524 0.246 1.00 0.90 O ATOM 1144 CB SER A 117 15.550 -19.899 -2.089 1.00 1.05 C ATOM 1145 OG SER A 117 15.643 -21.264 -2.459 1.00 1.64 O ATOM 0 H SER A 117 14.883 -17.631 -1.364 1.00 0.97 H new ATOM 0 HA SER A 117 13.434 -20.040 -1.744 1.00 0.98 H new ATOM 0 HB2 SER A 117 15.509 -19.278 -2.984 1.00 1.05 H new ATOM 0 HB3 SER A 117 16.444 -19.606 -1.539 1.00 1.05 H new ATOM 0 HG SER A 117 16.443 -21.400 -3.009 1.00 1.64 H new ATOM 1151 N GLN A 118 14.997 -19.659 1.099 1.00 0.75 N ATOM 1152 CA GLN A 118 15.186 -20.228 2.429 1.00 0.74 C ATOM 1153 C GLN A 118 13.873 -20.783 2.971 1.00 0.78 C ATOM 1154 O GLN A 118 13.758 -21.978 3.244 1.00 0.98 O ATOM 1155 CB GLN A 118 15.739 -19.169 3.386 1.00 0.90 C ATOM 1156 CG GLN A 118 17.065 -19.557 4.021 1.00 1.07 C ATOM 1157 CD GLN A 118 16.968 -19.706 5.527 1.00 1.80 C ATOM 1158 OE1 GLN A 118 15.887 -19.924 6.073 1.00 2.52 O ATOM 1159 NE2 GLN A 118 18.103 -19.587 6.207 1.00 2.42 N ATOM 0 H GLN A 118 15.316 -18.695 1.004 1.00 0.75 H new ATOM 0 HA GLN A 118 15.903 -21.046 2.350 1.00 0.74 H new ATOM 0 HB2 GLN A 118 15.865 -18.232 2.844 1.00 0.90 H new ATOM 0 HB3 GLN A 118 15.008 -18.986 4.174 1.00 0.90 H new ATOM 0 HG2 GLN A 118 17.410 -20.496 3.588 1.00 1.07 H new ATOM 0 HG3 GLN A 118 17.813 -18.801 3.782 1.00 1.07 H new ATOM 0 HE21 GLN A 118 18.977 -19.406 5.713 1.00 2.42 H new ATOM 0 HE22 GLN A 118 18.101 -19.676 7.223 1.00 2.42 H new ATOM 1168 N LEU A 119 12.885 -19.908 3.123 1.00 0.83 N ATOM 1169 CA LEU A 119 11.578 -20.309 3.630 1.00 0.95 C ATOM 1170 C LEU A 119 11.048 -21.517 2.866 1.00 0.98 C ATOM 1171 O LEU A 119 11.312 -21.675 1.674 1.00 1.67 O ATOM 1172 CB LEU A 119 10.589 -19.146 3.522 1.00 1.14 C ATOM 1173 CG LEU A 119 9.174 -19.447 4.019 1.00 1.19 C ATOM 1174 CD1 LEU A 119 8.471 -18.166 4.440 1.00 1.71 C ATOM 1175 CD2 LEU A 119 8.373 -20.167 2.944 1.00 1.84 C ATOM 0 H LEU A 119 12.965 -18.915 2.902 1.00 0.83 H new ATOM 0 HA LEU A 119 11.689 -20.585 4.678 1.00 0.95 H new ATOM 0 HB2 LEU A 119 10.983 -18.301 4.087 1.00 1.14 H new ATOM 0 HB3 LEU A 119 10.532 -18.834 2.479 1.00 1.14 H new ATOM 0 HG LEU A 119 9.247 -20.100 4.889 1.00 1.19 H new ATOM 0 HD11 LEU A 119 7.466 -18.401 4.790 1.00 1.71 H new ATOM 0 HD12 LEU A 119 9.033 -17.689 5.243 1.00 1.71 H new ATOM 0 HD13 LEU A 119 8.409 -17.488 3.589 1.00 1.71 H new ATOM 0 HD21 LEU A 119 7.369 -20.373 3.315 1.00 1.84 H new ATOM 0 HD22 LEU A 119 8.310 -19.539 2.055 1.00 1.84 H new ATOM 0 HD23 LEU A 119 8.866 -21.106 2.690 1.00 1.84 H new ATOM 1187 N HIS A 120 10.298 -22.368 3.559 1.00 1.27 N ATOM 1188 CA HIS A 120 9.731 -23.561 2.944 1.00 1.36 C ATOM 1189 C HIS A 120 8.665 -23.173 1.899 1.00 1.34 C ATOM 1190 O HIS A 120 8.971 -22.428 0.968 1.00 2.24 O ATOM 1191 CB HIS A 120 9.177 -24.487 4.035 1.00 1.59 C ATOM 1192 CG HIS A 120 8.894 -25.879 3.559 1.00 1.78 C ATOM 1193 ND1 HIS A 120 8.485 -26.894 4.399 1.00 2.29 N ATOM 1194 CD2 HIS A 120 8.961 -26.423 2.320 1.00 2.33 C ATOM 1195 CE1 HIS A 120 8.313 -28.001 3.698 1.00 2.68 C ATOM 1196 NE2 HIS A 120 8.594 -27.741 2.434 1.00 2.66 N ATOM 0 H HIS A 120 10.069 -22.253 4.546 1.00 1.27 H new ATOM 0 HA HIS A 120 10.508 -24.108 2.410 1.00 1.36 H new ATOM 0 HB2 HIS A 120 9.891 -24.532 4.857 1.00 1.59 H new ATOM 0 HB3 HIS A 120 8.259 -24.055 4.433 1.00 1.59 H new ATOM 0 HD2 HIS A 120 9.249 -25.915 1.412 1.00 2.33 H new ATOM 0 HE1 HIS A 120 7.997 -28.956 4.092 1.00 2.68 H new ATOM 0 HE2 HIS A 120 8.546 -28.411 1.667 1.00 2.66 H new ATOM 1204 N LEU A 121 7.425 -23.662 2.034 1.00 0.99 N ATOM 1205 CA LEU A 121 6.373 -23.334 1.079 1.00 1.04 C ATOM 1206 C LEU A 121 5.074 -24.038 1.454 1.00 1.09 C ATOM 1207 O LEU A 121 4.883 -25.210 1.137 1.00 1.88 O ATOM 1208 CB LEU A 121 6.792 -23.735 -0.338 1.00 1.47 C ATOM 1209 CG LEU A 121 6.481 -22.703 -1.423 1.00 1.43 C ATOM 1210 CD1 LEU A 121 5.020 -22.283 -1.357 1.00 1.91 C ATOM 1211 CD2 LEU A 121 7.392 -21.493 -1.284 1.00 1.93 C ATOM 0 H LEU A 121 7.133 -24.281 2.791 1.00 0.99 H new ATOM 0 HA LEU A 121 6.211 -22.257 1.107 1.00 1.04 H new ATOM 0 HB2 LEU A 121 7.864 -23.931 -0.341 1.00 1.47 H new ATOM 0 HB3 LEU A 121 6.296 -24.671 -0.596 1.00 1.47 H new ATOM 0 HG LEU A 121 6.663 -23.160 -2.396 1.00 1.43 H new ATOM 0 HD11 LEU A 121 4.817 -21.548 -2.136 1.00 1.91 H new ATOM 0 HD12 LEU A 121 4.384 -23.155 -1.506 1.00 1.91 H new ATOM 0 HD13 LEU A 121 4.811 -21.844 -0.381 1.00 1.91 H new ATOM 0 HD21 LEU A 121 7.157 -20.769 -2.064 1.00 1.93 H new ATOM 0 HD22 LEU A 121 7.242 -21.035 -0.306 1.00 1.93 H new ATOM 0 HD23 LEU A 121 8.431 -21.807 -1.382 1.00 1.93 H new ATOM 1223 N THR A 122 4.185 -23.311 2.129 1.00 1.15 N ATOM 1224 CA THR A 122 2.894 -23.852 2.557 1.00 1.32 C ATOM 1225 C THR A 122 2.229 -22.916 3.560 1.00 0.98 C ATOM 1226 O THR A 122 2.876 -22.034 4.125 1.00 0.95 O ATOM 1227 CB THR A 122 3.048 -25.242 3.189 1.00 1.86 C ATOM 1228 OG1 THR A 122 4.372 -25.457 3.645 1.00 2.15 O ATOM 1229 CG2 THR A 122 2.690 -26.373 2.249 1.00 2.79 C ATOM 0 H THR A 122 4.336 -22.338 2.393 1.00 1.15 H new ATOM 0 HA THR A 122 2.269 -23.941 1.668 1.00 1.32 H new ATOM 0 HB THR A 122 2.347 -25.250 4.023 1.00 1.86 H new ATOM 0 HG1 THR A 122 4.664 -24.687 4.177 1.00 2.15 H new ATOM 0 HG21 THR A 122 2.822 -27.327 2.760 1.00 2.79 H new ATOM 0 HG22 THR A 122 1.651 -26.270 1.935 1.00 2.79 H new ATOM 0 HG23 THR A 122 3.339 -26.338 1.374 1.00 2.79 H new ATOM 1237 N PRO A 123 0.923 -23.102 3.801 1.00 1.25 N ATOM 1238 CA PRO A 123 0.172 -22.277 4.751 1.00 1.45 C ATOM 1239 C PRO A 123 0.634 -22.494 6.189 1.00 1.38 C ATOM 1240 O PRO A 123 0.488 -21.614 7.038 1.00 2.04 O ATOM 1241 CB PRO A 123 -1.274 -22.748 4.574 1.00 1.99 C ATOM 1242 CG PRO A 123 -1.162 -24.127 4.022 1.00 2.19 C ATOM 1243 CD PRO A 123 0.081 -24.135 3.175 1.00 1.77 C ATOM 0 HA PRO A 123 0.308 -21.212 4.563 1.00 1.45 H new ATOM 0 HB2 PRO A 123 -1.810 -22.745 5.523 1.00 1.99 H new ATOM 0 HB3 PRO A 123 -1.822 -22.094 3.896 1.00 1.99 H new ATOM 0 HG2 PRO A 123 -1.093 -24.863 4.823 1.00 2.19 H new ATOM 0 HG3 PRO A 123 -2.040 -24.382 3.429 1.00 2.19 H new ATOM 0 HD2 PRO A 123 0.568 -25.110 3.184 1.00 1.77 H new ATOM 0 HD3 PRO A 123 -0.140 -23.898 2.134 1.00 1.77 H new ATOM 1251 N PHE A 124 1.195 -23.672 6.456 1.00 1.15 N ATOM 1252 CA PHE A 124 1.682 -24.005 7.790 1.00 1.22 C ATOM 1253 C PHE A 124 3.179 -23.716 7.924 1.00 1.20 C ATOM 1254 O PHE A 124 3.850 -24.278 8.791 1.00 1.52 O ATOM 1255 CB PHE A 124 1.407 -25.479 8.092 1.00 1.39 C ATOM 1256 CG PHE A 124 1.729 -25.877 9.505 1.00 2.02 C ATOM 1257 CD1 PHE A 124 0.902 -25.499 10.550 1.00 2.82 C ATOM 1258 CD2 PHE A 124 2.857 -26.632 9.786 1.00 2.65 C ATOM 1259 CE1 PHE A 124 1.195 -25.865 11.850 1.00 3.74 C ATOM 1260 CE2 PHE A 124 3.155 -27.000 11.084 1.00 3.58 C ATOM 1261 CZ PHE A 124 2.323 -26.617 12.117 1.00 3.98 C ATOM 0 H PHE A 124 1.323 -24.411 5.765 1.00 1.15 H new ATOM 0 HA PHE A 124 1.152 -23.381 8.509 1.00 1.22 H new ATOM 0 HB2 PHE A 124 0.356 -25.691 7.895 1.00 1.39 H new ATOM 0 HB3 PHE A 124 1.990 -26.096 7.408 1.00 1.39 H new ATOM 0 HD1 PHE A 124 0.019 -24.912 10.347 1.00 2.82 H new ATOM 0 HD2 PHE A 124 3.510 -26.936 8.981 1.00 2.65 H new ATOM 0 HE1 PHE A 124 0.543 -25.564 12.656 1.00 3.74 H new ATOM 0 HE2 PHE A 124 4.038 -27.587 11.290 1.00 3.58 H new ATOM 0 HZ PHE A 124 2.553 -26.905 13.132 1.00 3.98 H new ATOM 1271 N THR A 125 3.702 -22.840 7.067 1.00 1.14 N ATOM 1272 CA THR A 125 5.118 -22.491 7.106 1.00 1.32 C ATOM 1273 C THR A 125 5.309 -20.978 7.157 1.00 1.00 C ATOM 1274 O THR A 125 5.961 -20.458 8.063 1.00 0.94 O ATOM 1275 CB THR A 125 5.841 -23.068 5.889 1.00 1.74 C ATOM 1276 OG1 THR A 125 4.945 -23.235 4.805 1.00 2.19 O ATOM 1277 CG2 THR A 125 6.490 -24.409 6.158 1.00 2.26 C ATOM 0 H THR A 125 3.168 -22.362 6.341 1.00 1.14 H new ATOM 0 HA THR A 125 5.545 -22.921 8.012 1.00 1.32 H new ATOM 0 HB THR A 125 6.621 -22.346 5.649 1.00 1.74 H new ATOM 0 HG1 THR A 125 4.469 -22.394 4.642 1.00 2.19 H new ATOM 0 HG21 THR A 125 6.985 -24.762 5.253 1.00 2.26 H new ATOM 0 HG22 THR A 125 7.225 -24.304 6.956 1.00 2.26 H new ATOM 0 HG23 THR A 125 5.728 -25.128 6.458 1.00 2.26 H new ATOM 1285 N ALA A 126 4.744 -20.281 6.175 1.00 0.97 N ATOM 1286 CA ALA A 126 4.854 -18.827 6.099 1.00 0.82 C ATOM 1287 C ALA A 126 4.603 -18.173 7.454 1.00 0.86 C ATOM 1288 O ALA A 126 5.270 -17.206 7.819 1.00 1.77 O ATOM 1289 CB ALA A 126 3.883 -18.282 5.063 1.00 0.80 C ATOM 0 H ALA A 126 4.204 -20.701 5.419 1.00 0.97 H new ATOM 0 HA ALA A 126 5.873 -18.585 5.798 1.00 0.82 H new ATOM 0 HB1 ALA A 126 3.974 -17.197 5.015 1.00 0.80 H new ATOM 0 HB2 ALA A 126 4.114 -18.709 4.087 1.00 0.80 H new ATOM 0 HB3 ALA A 126 2.864 -18.549 5.343 1.00 0.80 H new ATOM 1295 N ARG A 127 3.636 -18.704 8.195 1.00 0.59 N ATOM 1296 CA ARG A 127 3.298 -18.167 9.509 1.00 0.65 C ATOM 1297 C ARG A 127 4.548 -17.967 10.361 1.00 0.64 C ATOM 1298 O ARG A 127 4.940 -16.836 10.648 1.00 0.84 O ATOM 1299 CB ARG A 127 2.322 -19.101 10.228 1.00 0.87 C ATOM 1300 CG ARG A 127 1.103 -18.389 10.793 1.00 1.05 C ATOM 1301 CD ARG A 127 1.486 -17.091 11.485 1.00 0.62 C ATOM 1302 NE ARG A 127 0.614 -16.798 12.620 1.00 1.18 N ATOM 1303 CZ ARG A 127 0.698 -15.692 13.357 1.00 1.67 C ATOM 1304 NH1 ARG A 127 1.614 -14.768 13.086 1.00 2.22 N ATOM 1305 NH2 ARG A 127 -0.137 -15.508 14.371 1.00 2.27 N ATOM 0 H ARG A 127 3.073 -19.505 7.909 1.00 0.59 H new ATOM 0 HA ARG A 127 2.825 -17.196 9.363 1.00 0.65 H new ATOM 0 HB2 ARG A 127 1.992 -19.873 9.533 1.00 0.87 H new ATOM 0 HB3 ARG A 127 2.846 -19.606 11.039 1.00 0.87 H new ATOM 0 HG2 ARG A 127 0.398 -18.179 9.989 1.00 1.05 H new ATOM 0 HG3 ARG A 127 0.594 -19.043 11.501 1.00 1.05 H new ATOM 0 HD2 ARG A 127 2.519 -17.154 11.828 1.00 0.62 H new ATOM 0 HD3 ARG A 127 1.437 -16.270 10.769 1.00 0.62 H new ATOM 0 HE ARG A 127 -0.103 -17.482 12.863 1.00 1.18 H new ATOM 0 HH11 ARG A 127 2.260 -14.903 12.308 1.00 2.22 H new ATOM 0 HH12 ARG A 127 1.671 -13.924 13.656 1.00 2.22 H new ATOM 0 HH21 ARG A 127 -0.842 -16.213 14.585 1.00 2.27 H new ATOM 0 HH22 ARG A 127 -0.074 -14.661 14.936 1.00 2.27 H new ATOM 1319 N GLY A 128 5.167 -19.071 10.766 1.00 0.53 N ATOM 1320 CA GLY A 128 6.363 -18.994 11.585 1.00 0.54 C ATOM 1321 C GLY A 128 7.496 -18.252 10.902 1.00 0.47 C ATOM 1322 O GLY A 128 7.987 -17.247 11.418 1.00 0.65 O ATOM 0 H GLY A 128 4.862 -20.018 10.542 1.00 0.53 H new ATOM 0 HA2 GLY A 128 6.123 -18.496 12.525 1.00 0.54 H new ATOM 0 HA3 GLY A 128 6.693 -20.003 11.834 1.00 0.54 H new ATOM 1326 N ARG A 129 7.917 -18.750 9.743 1.00 0.46 N ATOM 1327 CA ARG A 129 9.005 -18.132 8.992 1.00 0.43 C ATOM 1328 C ARG A 129 8.814 -16.622 8.884 1.00 0.39 C ATOM 1329 O ARG A 129 9.764 -15.855 9.040 1.00 0.46 O ATOM 1330 CB ARG A 129 9.103 -18.748 7.595 1.00 0.47 C ATOM 1331 CG ARG A 129 10.320 -19.639 7.409 1.00 0.84 C ATOM 1332 CD ARG A 129 10.087 -21.028 7.981 1.00 0.87 C ATOM 1333 NE ARG A 129 11.333 -21.777 8.125 1.00 1.42 N ATOM 1334 CZ ARG A 129 12.192 -21.607 9.128 1.00 1.85 C ATOM 1335 NH1 ARG A 129 11.948 -20.714 10.081 1.00 2.23 N ATOM 1336 NH2 ARG A 129 13.300 -22.333 9.179 1.00 2.65 N ATOM 0 H ARG A 129 7.521 -19.581 9.303 1.00 0.46 H new ATOM 0 HA ARG A 129 9.933 -18.320 9.532 1.00 0.43 H new ATOM 0 HB2 ARG A 129 8.203 -19.331 7.400 1.00 0.47 H new ATOM 0 HB3 ARG A 129 9.132 -17.948 6.855 1.00 0.47 H new ATOM 0 HG2 ARG A 129 10.557 -19.717 6.348 1.00 0.84 H new ATOM 0 HG3 ARG A 129 11.183 -19.184 7.896 1.00 0.84 H new ATOM 0 HD2 ARG A 129 9.601 -20.943 8.953 1.00 0.87 H new ATOM 0 HD3 ARG A 129 9.406 -21.578 7.331 1.00 0.87 H new ATOM 0 HE ARG A 129 11.559 -22.473 7.414 1.00 1.42 H new ATOM 0 HH11 ARG A 129 11.097 -20.152 10.048 1.00 2.23 H new ATOM 0 HH12 ARG A 129 12.611 -20.590 10.846 1.00 2.23 H new ATOM 0 HH21 ARG A 129 13.493 -23.020 8.451 1.00 2.65 H new ATOM 0 HH22 ARG A 129 13.959 -22.204 9.947 1.00 2.65 H new ATOM 1350 N PHE A 130 7.583 -16.201 8.615 1.00 0.37 N ATOM 1351 CA PHE A 130 7.272 -14.782 8.488 1.00 0.40 C ATOM 1352 C PHE A 130 7.846 -13.991 9.659 1.00 0.40 C ATOM 1353 O PHE A 130 8.438 -12.927 9.473 1.00 0.42 O ATOM 1354 CB PHE A 130 5.759 -14.573 8.410 1.00 0.51 C ATOM 1355 CG PHE A 130 5.332 -13.162 8.698 1.00 0.52 C ATOM 1356 CD1 PHE A 130 5.135 -12.736 10.001 1.00 1.24 C ATOM 1357 CD2 PHE A 130 5.127 -12.263 7.664 1.00 1.37 C ATOM 1358 CE1 PHE A 130 4.741 -11.438 10.268 1.00 1.35 C ATOM 1359 CE2 PHE A 130 4.733 -10.964 7.924 1.00 1.44 C ATOM 1360 CZ PHE A 130 4.540 -10.551 9.228 1.00 0.87 C ATOM 0 H PHE A 130 6.785 -16.822 8.481 1.00 0.37 H new ATOM 0 HA PHE A 130 7.729 -14.418 7.568 1.00 0.40 H new ATOM 0 HB2 PHE A 130 5.413 -14.853 7.415 1.00 0.51 H new ATOM 0 HB3 PHE A 130 5.271 -15.243 9.118 1.00 0.51 H new ATOM 0 HD1 PHE A 130 5.291 -13.425 10.818 1.00 1.24 H new ATOM 0 HD2 PHE A 130 5.277 -12.581 6.643 1.00 1.37 H new ATOM 0 HE1 PHE A 130 4.591 -11.118 11.288 1.00 1.35 H new ATOM 0 HE2 PHE A 130 4.576 -10.273 7.109 1.00 1.44 H new ATOM 0 HZ PHE A 130 4.233 -9.536 9.434 1.00 0.87 H new ATOM 1370 N ALA A 131 7.668 -14.517 10.867 1.00 0.44 N ATOM 1371 CA ALA A 131 8.168 -13.860 12.068 1.00 0.48 C ATOM 1372 C ALA A 131 9.686 -13.719 12.027 1.00 0.43 C ATOM 1373 O ALA A 131 10.232 -12.667 12.360 1.00 0.43 O ATOM 1374 CB ALA A 131 7.742 -14.632 13.308 1.00 0.58 C ATOM 0 H ALA A 131 7.181 -15.397 11.039 1.00 0.44 H new ATOM 0 HA ALA A 131 7.738 -12.859 12.110 1.00 0.48 H new ATOM 0 HB1 ALA A 131 8.122 -14.130 14.198 1.00 0.58 H new ATOM 0 HB2 ALA A 131 6.654 -14.676 13.353 1.00 0.58 H new ATOM 0 HB3 ALA A 131 8.144 -15.644 13.263 1.00 0.58 H new ATOM 1380 N THR A 132 10.364 -14.787 11.619 1.00 0.41 N ATOM 1381 CA THR A 132 11.820 -14.783 11.538 1.00 0.40 C ATOM 1382 C THR A 132 12.309 -13.775 10.502 1.00 0.35 C ATOM 1383 O THR A 132 13.067 -12.859 10.821 1.00 0.37 O ATOM 1384 CB THR A 132 12.336 -16.180 11.188 1.00 0.44 C ATOM 1385 OG1 THR A 132 11.570 -17.175 11.844 1.00 0.73 O ATOM 1386 CG2 THR A 132 13.786 -16.394 11.565 1.00 0.66 C ATOM 0 H THR A 132 9.928 -15.666 11.339 1.00 0.41 H new ATOM 0 HA THR A 132 12.210 -14.491 12.513 1.00 0.40 H new ATOM 0 HB THR A 132 12.244 -16.260 10.105 1.00 0.44 H new ATOM 0 HG1 THR A 132 11.914 -18.062 11.607 1.00 0.73 H new ATOM 0 HG21 THR A 132 14.088 -17.404 11.290 1.00 0.66 H new ATOM 0 HG22 THR A 132 14.409 -15.672 11.037 1.00 0.66 H new ATOM 0 HG23 THR A 132 13.906 -16.260 12.640 1.00 0.66 H new ATOM 1394 N VAL A 133 11.873 -13.952 9.259 1.00 0.37 N ATOM 1395 CA VAL A 133 12.269 -13.061 8.176 1.00 0.34 C ATOM 1396 C VAL A 133 12.113 -11.597 8.577 1.00 0.32 C ATOM 1397 O VAL A 133 13.059 -10.814 8.483 1.00 0.32 O ATOM 1398 CB VAL A 133 11.443 -13.321 6.903 1.00 0.37 C ATOM 1399 CG1 VAL A 133 11.902 -12.414 5.773 1.00 0.40 C ATOM 1400 CG2 VAL A 133 11.538 -14.784 6.495 1.00 0.47 C ATOM 0 H VAL A 133 11.245 -14.705 8.977 1.00 0.37 H new ATOM 0 HA VAL A 133 13.319 -13.268 7.969 1.00 0.34 H new ATOM 0 HB VAL A 133 10.399 -13.094 7.117 1.00 0.37 H new ATOM 0 HG11 VAL A 133 11.306 -12.613 4.882 1.00 0.40 H new ATOM 0 HG12 VAL A 133 11.776 -11.372 6.069 1.00 0.40 H new ATOM 0 HG13 VAL A 133 12.953 -12.605 5.557 1.00 0.40 H new ATOM 0 HG21 VAL A 133 10.948 -14.949 5.593 1.00 0.47 H new ATOM 0 HG22 VAL A 133 12.579 -15.040 6.299 1.00 0.47 H new ATOM 0 HG23 VAL A 133 11.155 -15.412 7.300 1.00 0.47 H new ATOM 1410 N VAL A 134 10.914 -11.233 9.022 1.00 0.32 N ATOM 1411 CA VAL A 134 10.633 -9.862 9.434 1.00 0.32 C ATOM 1412 C VAL A 134 11.503 -9.447 10.615 1.00 0.31 C ATOM 1413 O VAL A 134 12.009 -8.325 10.664 1.00 0.34 O ATOM 1414 CB VAL A 134 9.152 -9.684 9.819 1.00 0.35 C ATOM 1415 CG1 VAL A 134 8.937 -8.348 10.514 1.00 0.49 C ATOM 1416 CG2 VAL A 134 8.263 -9.804 8.591 1.00 0.40 C ATOM 0 H VAL A 134 10.121 -11.869 9.106 1.00 0.32 H new ATOM 0 HA VAL A 134 10.861 -9.226 8.579 1.00 0.32 H new ATOM 0 HB VAL A 134 8.879 -10.477 10.515 1.00 0.35 H new ATOM 0 HG11 VAL A 134 7.885 -8.240 10.778 1.00 0.49 H new ATOM 0 HG12 VAL A 134 9.544 -8.306 11.418 1.00 0.49 H new ATOM 0 HG13 VAL A 134 9.227 -7.539 9.844 1.00 0.49 H new ATOM 0 HG21 VAL A 134 7.221 -9.676 8.883 1.00 0.40 H new ATOM 0 HG22 VAL A 134 8.535 -9.035 7.868 1.00 0.40 H new ATOM 0 HG23 VAL A 134 8.395 -10.788 8.141 1.00 0.40 H new ATOM 1426 N GLU A 135 11.674 -10.355 11.567 1.00 0.33 N ATOM 1427 CA GLU A 135 12.483 -10.077 12.746 1.00 0.34 C ATOM 1428 C GLU A 135 13.850 -9.528 12.349 1.00 0.33 C ATOM 1429 O GLU A 135 14.334 -8.558 12.932 1.00 0.33 O ATOM 1430 CB GLU A 135 12.652 -11.344 13.586 1.00 0.41 C ATOM 1431 CG GLU A 135 11.543 -11.552 14.604 1.00 0.67 C ATOM 1432 CD GLU A 135 11.942 -11.113 15.999 1.00 1.33 C ATOM 1433 OE1 GLU A 135 12.759 -10.176 16.116 1.00 1.83 O ATOM 1434 OE2 GLU A 135 11.437 -11.707 16.975 1.00 2.14 O ATOM 0 H GLU A 135 11.264 -11.289 11.546 1.00 0.33 H new ATOM 0 HA GLU A 135 11.967 -9.323 13.341 1.00 0.34 H new ATOM 0 HB2 GLU A 135 12.691 -12.208 12.922 1.00 0.41 H new ATOM 0 HB3 GLU A 135 13.608 -11.299 14.107 1.00 0.41 H new ATOM 0 HG2 GLU A 135 10.659 -10.996 14.291 1.00 0.67 H new ATOM 0 HG3 GLU A 135 11.266 -12.606 14.624 1.00 0.67 H new ATOM 1441 N GLU A 136 14.471 -10.158 11.356 1.00 0.37 N ATOM 1442 CA GLU A 136 15.786 -9.738 10.882 1.00 0.41 C ATOM 1443 C GLU A 136 15.701 -8.434 10.092 1.00 0.40 C ATOM 1444 O GLU A 136 16.615 -7.611 10.137 1.00 0.45 O ATOM 1445 CB GLU A 136 16.411 -10.832 10.015 1.00 0.51 C ATOM 1446 CG GLU A 136 17.913 -10.683 9.837 1.00 1.39 C ATOM 1447 CD GLU A 136 18.660 -11.979 10.083 1.00 1.92 C ATOM 1448 OE1 GLU A 136 18.185 -13.036 9.616 1.00 2.43 O ATOM 1449 OE2 GLU A 136 19.721 -11.937 10.741 1.00 2.56 O ATOM 0 H GLU A 136 14.084 -10.963 10.863 1.00 0.37 H new ATOM 0 HA GLU A 136 16.416 -9.567 11.755 1.00 0.41 H new ATOM 0 HB2 GLU A 136 16.201 -11.803 10.463 1.00 0.51 H new ATOM 0 HB3 GLU A 136 15.935 -10.824 9.035 1.00 0.51 H new ATOM 0 HG2 GLU A 136 18.123 -10.333 8.826 1.00 1.39 H new ATOM 0 HG3 GLU A 136 18.282 -9.919 10.521 1.00 1.39 H new ATOM 1456 N LEU A 137 14.600 -8.251 9.368 1.00 0.39 N ATOM 1457 CA LEU A 137 14.406 -7.044 8.571 1.00 0.44 C ATOM 1458 C LEU A 137 14.647 -5.795 9.412 1.00 0.44 C ATOM 1459 O LEU A 137 15.460 -4.943 9.054 1.00 0.52 O ATOM 1460 CB LEU A 137 12.996 -7.008 7.982 1.00 0.45 C ATOM 1461 CG LEU A 137 12.709 -8.042 6.889 1.00 0.49 C ATOM 1462 CD1 LEU A 137 11.533 -7.592 6.049 1.00 1.08 C ATOM 1463 CD2 LEU A 137 13.929 -8.262 6.005 1.00 0.98 C ATOM 0 H LEU A 137 13.832 -8.920 9.317 1.00 0.39 H new ATOM 0 HA LEU A 137 15.129 -7.062 7.755 1.00 0.44 H new ATOM 0 HB2 LEU A 137 12.280 -7.152 8.791 1.00 0.45 H new ATOM 0 HB3 LEU A 137 12.818 -6.014 7.572 1.00 0.45 H new ATOM 0 HG LEU A 137 12.467 -8.989 7.372 1.00 0.49 H new ATOM 0 HD11 LEU A 137 11.335 -8.332 5.274 1.00 1.08 H new ATOM 0 HD12 LEU A 137 10.653 -7.486 6.683 1.00 1.08 H new ATOM 0 HD13 LEU A 137 11.763 -6.633 5.584 1.00 1.08 H new ATOM 0 HD21 LEU A 137 13.695 -9.001 5.239 1.00 0.98 H new ATOM 0 HD22 LEU A 137 14.208 -7.322 5.529 1.00 0.98 H new ATOM 0 HD23 LEU A 137 14.759 -8.621 6.613 1.00 0.98 H new ATOM 1475 N PHE A 138 13.934 -5.691 10.528 1.00 0.41 N ATOM 1476 CA PHE A 138 14.074 -4.540 11.415 1.00 0.47 C ATOM 1477 C PHE A 138 14.895 -4.874 12.666 1.00 0.71 C ATOM 1478 O PHE A 138 14.978 -4.059 13.585 1.00 1.31 O ATOM 1479 CB PHE A 138 12.695 -4.022 11.822 1.00 0.67 C ATOM 1480 CG PHE A 138 11.786 -3.768 10.653 1.00 0.53 C ATOM 1481 CD1 PHE A 138 12.071 -2.761 9.744 1.00 1.14 C ATOM 1482 CD2 PHE A 138 10.650 -4.537 10.462 1.00 1.35 C ATOM 1483 CE1 PHE A 138 11.239 -2.527 8.666 1.00 1.16 C ATOM 1484 CE2 PHE A 138 9.815 -4.308 9.385 1.00 1.36 C ATOM 1485 CZ PHE A 138 10.110 -3.301 8.486 1.00 0.59 C ATOM 0 H PHE A 138 13.256 -6.386 10.840 1.00 0.41 H new ATOM 0 HA PHE A 138 14.610 -3.767 10.865 1.00 0.47 H new ATOM 0 HB2 PHE A 138 12.225 -4.745 12.488 1.00 0.67 H new ATOM 0 HB3 PHE A 138 12.814 -3.098 12.388 1.00 0.67 H new ATOM 0 HD1 PHE A 138 12.953 -2.153 9.880 1.00 1.14 H new ATOM 0 HD2 PHE A 138 10.414 -5.324 11.163 1.00 1.35 H new ATOM 0 HE1 PHE A 138 11.472 -1.739 7.965 1.00 1.16 H new ATOM 0 HE2 PHE A 138 8.933 -4.915 9.246 1.00 1.36 H new ATOM 0 HZ PHE A 138 9.458 -3.120 7.644 1.00 0.59 H new ATOM 1495 N ARG A 139 15.490 -6.072 12.703 1.00 0.62 N ATOM 1496 CA ARG A 139 16.292 -6.500 13.848 1.00 0.99 C ATOM 1497 C ARG A 139 17.221 -5.387 14.324 1.00 1.08 C ATOM 1498 O ARG A 139 17.410 -5.198 15.526 1.00 1.31 O ATOM 1499 CB ARG A 139 17.111 -7.740 13.484 1.00 1.35 C ATOM 1500 CG ARG A 139 18.341 -7.934 14.356 1.00 1.80 C ATOM 1501 CD ARG A 139 18.748 -9.397 14.425 1.00 2.54 C ATOM 1502 NE ARG A 139 20.066 -9.570 15.032 1.00 3.08 N ATOM 1503 CZ ARG A 139 20.598 -10.755 15.329 1.00 3.61 C ATOM 1504 NH1 ARG A 139 19.933 -11.876 15.076 1.00 3.79 N ATOM 1505 NH2 ARG A 139 21.803 -10.819 15.880 1.00 4.36 N ATOM 0 H ARG A 139 15.429 -6.760 11.952 1.00 0.62 H new ATOM 0 HA ARG A 139 15.609 -6.743 14.662 1.00 0.99 H new ATOM 0 HB2 ARG A 139 16.475 -8.622 13.565 1.00 1.35 H new ATOM 0 HB3 ARG A 139 17.422 -7.667 12.442 1.00 1.35 H new ATOM 0 HG2 ARG A 139 19.167 -7.344 13.959 1.00 1.80 H new ATOM 0 HG3 ARG A 139 18.138 -7.564 15.361 1.00 1.80 H new ATOM 0 HD2 ARG A 139 18.008 -9.953 15.001 1.00 2.54 H new ATOM 0 HD3 ARG A 139 18.753 -9.820 13.420 1.00 2.54 H new ATOM 0 HE ARG A 139 20.611 -8.734 15.241 1.00 3.08 H new ATOM 0 HH11 ARG A 139 19.007 -11.835 14.651 1.00 3.79 H new ATOM 0 HH12 ARG A 139 20.348 -12.779 15.307 1.00 3.79 H new ATOM 0 HH21 ARG A 139 22.321 -9.962 16.076 1.00 4.36 H new ATOM 0 HH22 ARG A 139 22.212 -11.725 16.108 1.00 4.36 H new ATOM 1519 N ASP A 140 17.798 -4.653 13.379 1.00 1.12 N ATOM 1520 CA ASP A 140 18.705 -3.560 13.710 1.00 1.33 C ATOM 1521 C ASP A 140 18.044 -2.209 13.458 1.00 0.97 C ATOM 1522 O ASP A 140 18.335 -1.541 12.466 1.00 1.61 O ATOM 1523 CB ASP A 140 19.992 -3.672 12.892 1.00 1.81 C ATOM 1524 CG ASP A 140 21.135 -4.265 13.691 1.00 2.60 C ATOM 1525 OD1 ASP A 140 21.643 -3.577 14.601 1.00 3.20 O ATOM 1526 OD2 ASP A 140 21.522 -5.418 13.407 1.00 3.14 O ATOM 0 H ASP A 140 17.654 -4.795 12.379 1.00 1.12 H new ATOM 0 HA ASP A 140 18.949 -3.632 14.770 1.00 1.33 H new ATOM 0 HB2 ASP A 140 19.808 -4.290 12.013 1.00 1.81 H new ATOM 0 HB3 ASP A 140 20.278 -2.683 12.533 1.00 1.81 H new ATOM 1531 N GLY A 141 17.153 -1.813 14.361 1.00 0.90 N ATOM 1532 CA GLY A 141 16.465 -0.543 14.217 1.00 0.75 C ATOM 1533 C GLY A 141 15.605 -0.488 12.970 1.00 0.63 C ATOM 1534 O GLY A 141 15.940 -1.091 11.950 1.00 0.90 O ATOM 0 H GLY A 141 16.895 -2.349 15.190 1.00 0.90 H new ATOM 0 HA2 GLY A 141 15.840 -0.370 15.093 1.00 0.75 H new ATOM 0 HA3 GLY A 141 17.199 0.263 14.185 1.00 0.75 H new ATOM 1538 N VAL A 142 14.491 0.232 13.052 1.00 0.47 N ATOM 1539 CA VAL A 142 13.579 0.359 11.923 1.00 0.45 C ATOM 1540 C VAL A 142 13.782 1.680 11.188 1.00 0.55 C ATOM 1541 O VAL A 142 14.047 2.713 11.802 1.00 1.24 O ATOM 1542 CB VAL A 142 12.110 0.256 12.374 1.00 0.51 C ATOM 1543 CG1 VAL A 142 11.216 -0.121 11.202 1.00 0.70 C ATOM 1544 CG2 VAL A 142 11.969 -0.748 13.507 1.00 0.47 C ATOM 0 H VAL A 142 14.199 0.736 13.889 1.00 0.47 H new ATOM 0 HA VAL A 142 13.804 -0.465 11.245 1.00 0.45 H new ATOM 0 HB VAL A 142 11.793 1.232 12.743 1.00 0.51 H new ATOM 0 HG11 VAL A 142 10.182 -0.189 11.540 1.00 0.70 H new ATOM 0 HG12 VAL A 142 11.294 0.640 10.425 1.00 0.70 H new ATOM 0 HG13 VAL A 142 11.530 -1.084 10.800 1.00 0.70 H new ATOM 0 HG21 VAL A 142 10.924 -0.807 13.813 1.00 0.47 H new ATOM 0 HG22 VAL A 142 12.304 -1.728 13.168 1.00 0.47 H new ATOM 0 HG23 VAL A 142 12.577 -0.429 14.354 1.00 0.47 H new ATOM 1554 N ASN A 143 13.653 1.632 9.867 1.00 0.41 N ATOM 1555 CA ASN A 143 13.816 2.816 9.030 1.00 0.41 C ATOM 1556 C ASN A 143 12.962 2.702 7.771 1.00 0.37 C ATOM 1557 O ASN A 143 12.529 1.609 7.407 1.00 0.36 O ATOM 1558 CB ASN A 143 15.286 3.001 8.649 1.00 0.45 C ATOM 1559 CG ASN A 143 15.990 4.010 9.536 1.00 1.16 C ATOM 1560 OD1 ASN A 143 15.347 4.798 10.231 1.00 2.05 O ATOM 1561 ND2 ASN A 143 17.317 3.991 9.516 1.00 1.67 N ATOM 0 H ASN A 143 13.435 0.781 9.350 1.00 0.41 H new ATOM 0 HA ASN A 143 13.487 3.686 9.599 1.00 0.41 H new ATOM 0 HB2 ASN A 143 15.799 2.042 8.716 1.00 0.45 H new ATOM 0 HB3 ASN A 143 15.351 3.326 7.611 1.00 0.45 H new ATOM 0 HD21 ASN A 143 17.845 4.647 10.092 1.00 1.67 H new ATOM 0 HD22 ASN A 143 17.809 3.321 8.925 1.00 1.67 H new ATOM 1568 N TRP A 144 12.717 3.829 7.108 1.00 0.36 N ATOM 1569 CA TRP A 144 11.909 3.835 5.894 1.00 0.35 C ATOM 1570 C TRP A 144 12.398 2.773 4.918 1.00 0.33 C ATOM 1571 O TRP A 144 11.666 1.843 4.580 1.00 0.32 O ATOM 1572 CB TRP A 144 11.948 5.213 5.230 1.00 0.36 C ATOM 1573 CG TRP A 144 11.114 6.239 5.937 1.00 0.33 C ATOM 1574 CD1 TRP A 144 11.511 7.486 6.327 1.00 0.34 C ATOM 1575 CD2 TRP A 144 9.744 6.109 6.338 1.00 0.32 C ATOM 1576 NE1 TRP A 144 10.472 8.139 6.945 1.00 0.34 N ATOM 1577 CE2 TRP A 144 9.378 7.316 6.965 1.00 0.32 C ATOM 1578 CE3 TRP A 144 8.791 5.092 6.228 1.00 0.34 C ATOM 1579 CZ2 TRP A 144 8.102 7.530 7.479 1.00 0.33 C ATOM 1580 CZ3 TRP A 144 7.525 5.307 6.740 1.00 0.35 C ATOM 1581 CH2 TRP A 144 7.190 6.518 7.358 1.00 0.34 C ATOM 0 H TRP A 144 13.065 4.745 7.390 1.00 0.36 H new ATOM 0 HA TRP A 144 10.880 3.607 6.171 1.00 0.35 H new ATOM 0 HB2 TRP A 144 12.981 5.560 5.190 1.00 0.36 H new ATOM 0 HB3 TRP A 144 11.603 5.122 4.200 1.00 0.36 H new ATOM 0 HD1 TRP A 144 12.497 7.898 6.172 1.00 0.34 H new ATOM 0 HE1 TRP A 144 10.510 9.084 7.327 1.00 0.34 H new ATOM 0 HE3 TRP A 144 9.039 4.155 5.752 1.00 0.34 H new ATOM 0 HZ2 TRP A 144 7.841 8.463 7.957 1.00 0.33 H new ATOM 0 HZ3 TRP A 144 6.782 4.528 6.662 1.00 0.35 H new ATOM 0 HH2 TRP A 144 6.192 6.656 7.747 1.00 0.34 H new ATOM 1592 N GLY A 145 13.641 2.917 4.472 1.00 0.34 N ATOM 1593 CA GLY A 145 14.211 1.960 3.542 1.00 0.34 C ATOM 1594 C GLY A 145 13.990 0.530 3.989 1.00 0.32 C ATOM 1595 O GLY A 145 13.687 -0.345 3.177 1.00 0.32 O ATOM 0 H GLY A 145 14.264 3.679 4.738 1.00 0.34 H new ATOM 0 HA2 GLY A 145 13.767 2.104 2.557 1.00 0.34 H new ATOM 0 HA3 GLY A 145 15.280 2.146 3.440 1.00 0.34 H new ATOM 1599 N ARG A 146 14.129 0.296 5.290 1.00 0.31 N ATOM 1600 CA ARG A 146 13.931 -1.032 5.852 1.00 0.31 C ATOM 1601 C ARG A 146 12.475 -1.456 5.707 1.00 0.29 C ATOM 1602 O ARG A 146 12.179 -2.623 5.448 1.00 0.31 O ATOM 1603 CB ARG A 146 14.338 -1.053 7.325 1.00 0.32 C ATOM 1604 CG ARG A 146 15.833 -1.214 7.542 1.00 0.63 C ATOM 1605 CD ARG A 146 16.217 -2.675 7.705 1.00 0.81 C ATOM 1606 NE ARG A 146 17.385 -3.026 6.900 1.00 1.38 N ATOM 1607 CZ ARG A 146 18.154 -4.090 7.126 1.00 1.66 C ATOM 1608 NH1 ARG A 146 17.887 -4.914 8.133 1.00 2.09 N ATOM 1609 NH2 ARG A 146 19.196 -4.330 6.342 1.00 2.22 N ATOM 0 H ARG A 146 14.378 1.010 5.974 1.00 0.31 H new ATOM 0 HA ARG A 146 14.559 -1.735 5.305 1.00 0.31 H new ATOM 0 HB2 ARG A 146 14.009 -0.127 7.797 1.00 0.32 H new ATOM 0 HB3 ARG A 146 13.817 -1.869 7.825 1.00 0.32 H new ATOM 0 HG2 ARG A 146 16.373 -0.787 6.697 1.00 0.63 H new ATOM 0 HG3 ARG A 146 16.135 -0.656 8.428 1.00 0.63 H new ATOM 0 HD2 ARG A 146 16.425 -2.880 8.755 1.00 0.81 H new ATOM 0 HD3 ARG A 146 15.376 -3.305 7.418 1.00 0.81 H new ATOM 0 HE ARG A 146 17.626 -2.419 6.117 1.00 1.38 H new ATOM 0 HH11 ARG A 146 17.088 -4.734 8.741 1.00 2.09 H new ATOM 0 HH12 ARG A 146 18.481 -5.726 8.299 1.00 2.09 H new ATOM 0 HH21 ARG A 146 19.407 -3.701 5.568 1.00 2.22 H new ATOM 0 HH22 ARG A 146 19.786 -5.144 6.513 1.00 2.22 H new ATOM 1623 N ILE A 147 11.567 -0.495 5.861 1.00 0.27 N ATOM 1624 CA ILE A 147 10.143 -0.766 5.731 1.00 0.28 C ATOM 1625 C ILE A 147 9.822 -1.192 4.308 1.00 0.29 C ATOM 1626 O ILE A 147 9.260 -2.263 4.079 1.00 0.30 O ATOM 1627 CB ILE A 147 9.294 0.469 6.089 1.00 0.29 C ATOM 1628 CG1 ILE A 147 9.153 0.598 7.606 1.00 0.44 C ATOM 1629 CG2 ILE A 147 7.926 0.379 5.431 1.00 0.46 C ATOM 1630 CD1 ILE A 147 9.483 1.980 8.128 1.00 0.70 C ATOM 0 H ILE A 147 11.794 0.476 6.076 1.00 0.27 H new ATOM 0 HA ILE A 147 9.898 -1.568 6.428 1.00 0.28 H new ATOM 0 HB ILE A 147 9.799 1.359 5.714 1.00 0.29 H new ATOM 0 HG12 ILE A 147 8.132 0.345 7.891 1.00 0.44 H new ATOM 0 HG13 ILE A 147 9.807 -0.129 8.087 1.00 0.44 H new ATOM 0 HG21 ILE A 147 7.338 1.258 5.693 1.00 0.46 H new ATOM 0 HG22 ILE A 147 8.045 0.332 4.349 1.00 0.46 H new ATOM 0 HG23 ILE A 147 7.413 -0.518 5.779 1.00 0.46 H new ATOM 0 HD11 ILE A 147 9.361 1.998 9.211 1.00 0.70 H new ATOM 0 HD12 ILE A 147 10.514 2.228 7.874 1.00 0.70 H new ATOM 0 HD13 ILE A 147 8.812 2.710 7.675 1.00 0.70 H new ATOM 1642 N VAL A 148 10.196 -0.346 3.353 1.00 0.29 N ATOM 1643 CA VAL A 148 9.964 -0.632 1.946 1.00 0.30 C ATOM 1644 C VAL A 148 10.420 -2.046 1.610 1.00 0.30 C ATOM 1645 O VAL A 148 9.798 -2.736 0.804 1.00 0.30 O ATOM 1646 CB VAL A 148 10.705 0.372 1.042 1.00 0.31 C ATOM 1647 CG1 VAL A 148 11.328 -0.337 -0.152 1.00 0.35 C ATOM 1648 CG2 VAL A 148 9.761 1.474 0.584 1.00 0.35 C ATOM 0 H VAL A 148 10.662 0.544 3.531 1.00 0.29 H new ATOM 0 HA VAL A 148 8.893 -0.541 1.764 1.00 0.30 H new ATOM 0 HB VAL A 148 11.508 0.828 1.621 1.00 0.31 H new ATOM 0 HG11 VAL A 148 11.846 0.390 -0.777 1.00 0.35 H new ATOM 0 HG12 VAL A 148 12.039 -1.085 0.199 1.00 0.35 H new ATOM 0 HG13 VAL A 148 10.546 -0.824 -0.734 1.00 0.35 H new ATOM 0 HG21 VAL A 148 10.301 2.174 -0.053 1.00 0.35 H new ATOM 0 HG22 VAL A 148 8.935 1.036 0.024 1.00 0.35 H new ATOM 0 HG23 VAL A 148 9.370 2.002 1.453 1.00 0.35 H new ATOM 1658 N ALA A 149 11.509 -2.474 2.244 1.00 0.30 N ATOM 1659 CA ALA A 149 12.045 -3.810 2.022 1.00 0.31 C ATOM 1660 C ALA A 149 11.080 -4.869 2.539 1.00 0.31 C ATOM 1661 O ALA A 149 10.894 -5.912 1.914 1.00 0.32 O ATOM 1662 CB ALA A 149 13.403 -3.953 2.694 1.00 0.32 C ATOM 0 H ALA A 149 12.036 -1.914 2.914 1.00 0.30 H new ATOM 0 HA ALA A 149 12.171 -3.957 0.949 1.00 0.31 H new ATOM 0 HB1 ALA A 149 13.791 -4.956 2.520 1.00 0.32 H new ATOM 0 HB2 ALA A 149 14.094 -3.219 2.278 1.00 0.32 H new ATOM 0 HB3 ALA A 149 13.298 -3.786 3.766 1.00 0.32 H new ATOM 1668 N PHE A 150 10.461 -4.588 3.681 1.00 0.30 N ATOM 1669 CA PHE A 150 9.508 -5.513 4.282 1.00 0.30 C ATOM 1670 C PHE A 150 8.326 -5.754 3.351 1.00 0.29 C ATOM 1671 O PHE A 150 7.775 -6.854 3.303 1.00 0.33 O ATOM 1672 CB PHE A 150 9.020 -4.969 5.626 1.00 0.32 C ATOM 1673 CG PHE A 150 7.605 -5.347 5.953 1.00 0.36 C ATOM 1674 CD1 PHE A 150 7.304 -6.614 6.427 1.00 1.18 C ATOM 1675 CD2 PHE A 150 6.575 -4.433 5.792 1.00 1.34 C ATOM 1676 CE1 PHE A 150 6.002 -6.963 6.732 1.00 1.19 C ATOM 1677 CE2 PHE A 150 5.272 -4.777 6.097 1.00 1.47 C ATOM 1678 CZ PHE A 150 4.985 -6.043 6.568 1.00 0.71 C ATOM 0 H PHE A 150 10.603 -3.727 4.209 1.00 0.30 H new ATOM 0 HA PHE A 150 10.013 -6.465 4.448 1.00 0.30 H new ATOM 0 HB2 PHE A 150 9.676 -5.335 6.416 1.00 0.32 H new ATOM 0 HB3 PHE A 150 9.104 -3.882 5.620 1.00 0.32 H new ATOM 0 HD1 PHE A 150 8.096 -7.337 6.560 1.00 1.18 H new ATOM 0 HD2 PHE A 150 6.793 -3.441 5.424 1.00 1.34 H new ATOM 0 HE1 PHE A 150 5.780 -7.954 7.098 1.00 1.19 H new ATOM 0 HE2 PHE A 150 4.478 -4.056 5.967 1.00 1.47 H new ATOM 0 HZ PHE A 150 3.967 -6.313 6.808 1.00 0.71 H new ATOM 1688 N PHE A 151 7.944 -4.721 2.607 1.00 0.27 N ATOM 1689 CA PHE A 151 6.831 -4.826 1.673 1.00 0.26 C ATOM 1690 C PHE A 151 7.184 -5.759 0.520 1.00 0.25 C ATOM 1691 O PHE A 151 6.544 -6.792 0.325 1.00 0.26 O ATOM 1692 CB PHE A 151 6.457 -3.444 1.134 1.00 0.26 C ATOM 1693 CG PHE A 151 5.517 -2.686 2.028 1.00 0.27 C ATOM 1694 CD1 PHE A 151 5.991 -2.016 3.144 1.00 1.24 C ATOM 1695 CD2 PHE A 151 4.160 -2.645 1.751 1.00 1.07 C ATOM 1696 CE1 PHE A 151 5.128 -1.318 3.968 1.00 1.28 C ATOM 1697 CE2 PHE A 151 3.293 -1.949 2.571 1.00 1.05 C ATOM 1698 CZ PHE A 151 3.777 -1.285 3.681 1.00 0.34 C ATOM 0 H PHE A 151 8.389 -3.803 2.633 1.00 0.27 H new ATOM 0 HA PHE A 151 5.975 -5.240 2.206 1.00 0.26 H new ATOM 0 HB2 PHE A 151 7.366 -2.858 0.996 1.00 0.26 H new ATOM 0 HB3 PHE A 151 5.999 -3.558 0.152 1.00 0.26 H new ATOM 0 HD1 PHE A 151 7.046 -2.039 3.373 1.00 1.24 H new ATOM 0 HD2 PHE A 151 3.776 -3.163 0.885 1.00 1.07 H new ATOM 0 HE1 PHE A 151 5.509 -0.799 4.835 1.00 1.28 H new ATOM 0 HE2 PHE A 151 2.237 -1.924 2.344 1.00 1.05 H new ATOM 0 HZ PHE A 151 3.101 -0.741 4.324 1.00 0.34 H new ATOM 1708 N GLU A 152 8.209 -5.386 -0.241 1.00 0.25 N ATOM 1709 CA GLU A 152 8.655 -6.188 -1.375 1.00 0.25 C ATOM 1710 C GLU A 152 8.791 -7.656 -0.984 1.00 0.26 C ATOM 1711 O GLU A 152 8.436 -8.549 -1.753 1.00 0.28 O ATOM 1712 CB GLU A 152 9.992 -5.663 -1.901 1.00 0.27 C ATOM 1713 CG GLU A 152 10.046 -5.543 -3.414 1.00 0.95 C ATOM 1714 CD GLU A 152 10.914 -6.609 -4.053 1.00 1.57 C ATOM 1715 OE1 GLU A 152 11.944 -6.976 -3.449 1.00 2.24 O ATOM 1716 OE2 GLU A 152 10.564 -7.078 -5.156 1.00 2.25 O ATOM 0 H GLU A 152 8.747 -4.532 -0.092 1.00 0.25 H new ATOM 0 HA GLU A 152 7.905 -6.109 -2.162 1.00 0.25 H new ATOM 0 HB2 GLU A 152 10.188 -4.685 -1.460 1.00 0.27 H new ATOM 0 HB3 GLU A 152 10.790 -6.328 -1.569 1.00 0.27 H new ATOM 0 HG2 GLU A 152 9.035 -5.613 -3.817 1.00 0.95 H new ATOM 0 HG3 GLU A 152 10.429 -4.559 -3.683 1.00 0.95 H new ATOM 1723 N PHE A 153 9.307 -7.899 0.217 1.00 0.25 N ATOM 1724 CA PHE A 153 9.487 -9.259 0.709 1.00 0.27 C ATOM 1725 C PHE A 153 8.159 -10.009 0.724 1.00 0.28 C ATOM 1726 O PHE A 153 8.034 -11.083 0.136 1.00 0.32 O ATOM 1727 CB PHE A 153 10.093 -9.241 2.113 1.00 0.29 C ATOM 1728 CG PHE A 153 9.467 -10.235 3.050 1.00 0.28 C ATOM 1729 CD1 PHE A 153 9.598 -11.596 2.825 1.00 1.13 C ATOM 1730 CD2 PHE A 153 8.748 -9.808 4.155 1.00 0.86 C ATOM 1731 CE1 PHE A 153 9.024 -12.513 3.685 1.00 1.15 C ATOM 1732 CE2 PHE A 153 8.171 -10.720 5.018 1.00 0.87 C ATOM 1733 CZ PHE A 153 8.310 -12.074 4.783 1.00 0.37 C ATOM 0 H PHE A 153 9.607 -7.172 0.866 1.00 0.25 H new ATOM 0 HA PHE A 153 10.170 -9.776 0.035 1.00 0.27 H new ATOM 0 HB2 PHE A 153 11.161 -9.444 2.041 1.00 0.29 H new ATOM 0 HB3 PHE A 153 9.986 -8.241 2.533 1.00 0.29 H new ATOM 0 HD1 PHE A 153 10.155 -11.944 1.968 1.00 1.13 H new ATOM 0 HD2 PHE A 153 8.637 -8.750 4.344 1.00 0.86 H new ATOM 0 HE1 PHE A 153 9.134 -13.571 3.499 1.00 1.15 H new ATOM 0 HE2 PHE A 153 7.612 -10.375 5.875 1.00 0.87 H new ATOM 0 HZ PHE A 153 7.861 -12.789 5.457 1.00 0.37 H new ATOM 1743 N GLY A 154 7.168 -9.433 1.398 1.00 0.30 N ATOM 1744 CA GLY A 154 5.862 -10.060 1.472 1.00 0.34 C ATOM 1745 C GLY A 154 5.281 -10.346 0.102 1.00 0.33 C ATOM 1746 O GLY A 154 4.585 -11.343 -0.090 1.00 0.37 O ATOM 0 H GLY A 154 7.246 -8.545 1.893 1.00 0.30 H new ATOM 0 HA2 GLY A 154 5.940 -10.992 2.032 1.00 0.34 H new ATOM 0 HA3 GLY A 154 5.181 -9.412 2.024 1.00 0.34 H new ATOM 1750 N GLY A 155 5.571 -9.470 -0.855 1.00 0.32 N ATOM 1751 CA GLY A 155 5.068 -9.651 -2.203 1.00 0.35 C ATOM 1752 C GLY A 155 5.659 -10.872 -2.879 1.00 0.35 C ATOM 1753 O GLY A 155 4.990 -11.540 -3.667 1.00 0.39 O ATOM 0 H GLY A 155 6.146 -8.638 -0.720 1.00 0.32 H new ATOM 0 HA2 GLY A 155 3.982 -9.745 -2.174 1.00 0.35 H new ATOM 0 HA3 GLY A 155 5.296 -8.765 -2.795 1.00 0.35 H new ATOM 1757 N VAL A 156 6.918 -11.165 -2.568 1.00 0.33 N ATOM 1758 CA VAL A 156 7.600 -12.315 -3.147 1.00 0.36 C ATOM 1759 C VAL A 156 7.008 -13.620 -2.627 1.00 0.36 C ATOM 1760 O VAL A 156 6.795 -14.564 -3.388 1.00 0.37 O ATOM 1761 CB VAL A 156 9.108 -12.289 -2.834 1.00 0.39 C ATOM 1762 CG1 VAL A 156 9.627 -13.696 -2.582 1.00 0.54 C ATOM 1763 CG2 VAL A 156 9.877 -11.624 -3.966 1.00 0.59 C ATOM 0 H VAL A 156 7.486 -10.621 -1.918 1.00 0.33 H new ATOM 0 HA VAL A 156 7.460 -12.258 -4.226 1.00 0.36 H new ATOM 0 HB VAL A 156 9.261 -11.703 -1.928 1.00 0.39 H new ATOM 0 HG11 VAL A 156 10.694 -13.656 -2.363 1.00 0.54 H new ATOM 0 HG12 VAL A 156 9.098 -14.132 -1.735 1.00 0.54 H new ATOM 0 HG13 VAL A 156 9.461 -14.309 -3.468 1.00 0.54 H new ATOM 0 HG21 VAL A 156 10.940 -11.615 -3.727 1.00 0.59 H new ATOM 0 HG22 VAL A 156 9.717 -12.180 -4.890 1.00 0.59 H new ATOM 0 HG23 VAL A 156 9.525 -10.600 -4.093 1.00 0.59 H new ATOM 1773 N MET A 157 6.742 -13.664 -1.326 1.00 0.36 N ATOM 1774 CA MET A 157 6.172 -14.852 -0.701 1.00 0.39 C ATOM 1775 C MET A 157 4.776 -15.135 -1.246 1.00 0.37 C ATOM 1776 O MET A 157 4.421 -16.285 -1.504 1.00 0.38 O ATOM 1777 CB MET A 157 6.114 -14.676 0.818 1.00 0.44 C ATOM 1778 CG MET A 157 5.206 -15.678 1.512 1.00 0.84 C ATOM 1779 SD MET A 157 5.779 -16.103 3.168 1.00 1.15 S ATOM 1780 CE MET A 157 4.819 -14.964 4.162 1.00 0.70 C ATOM 0 H MET A 157 6.912 -12.890 -0.683 1.00 0.36 H new ATOM 0 HA MET A 157 6.814 -15.701 -0.937 1.00 0.39 H new ATOM 0 HB2 MET A 157 7.121 -14.768 1.225 1.00 0.44 H new ATOM 0 HB3 MET A 157 5.769 -13.667 1.046 1.00 0.44 H new ATOM 0 HG2 MET A 157 4.198 -15.267 1.575 1.00 0.84 H new ATOM 0 HG3 MET A 157 5.144 -16.584 0.909 1.00 0.84 H new ATOM 0 HE1 MET A 157 5.311 -14.816 5.123 1.00 0.70 H new ATOM 0 HE2 MET A 157 4.739 -14.008 3.644 1.00 0.70 H new ATOM 0 HE3 MET A 157 3.822 -15.374 4.324 1.00 0.70 H new ATOM 1790 N CYS A 158 3.988 -14.079 -1.421 1.00 0.37 N ATOM 1791 CA CYS A 158 2.631 -14.214 -1.937 1.00 0.38 C ATOM 1792 C CYS A 158 2.641 -14.821 -3.336 1.00 0.37 C ATOM 1793 O CYS A 158 2.098 -15.904 -3.557 1.00 0.45 O ATOM 1794 CB CYS A 158 1.934 -12.852 -1.963 1.00 0.41 C ATOM 1795 SG CYS A 158 0.793 -12.633 -3.347 1.00 1.19 S ATOM 0 H CYS A 158 4.266 -13.120 -1.213 1.00 0.37 H new ATOM 0 HA CYS A 158 2.081 -14.882 -1.274 1.00 0.38 H new ATOM 0 HB2 CYS A 158 1.386 -12.718 -1.030 1.00 0.41 H new ATOM 0 HB3 CYS A 158 2.691 -12.069 -2.003 1.00 0.41 H new ATOM 0 HG CYS A 158 0.098 -11.549 -3.169 1.00 1.19 H new ATOM 1801 N VAL A 159 3.264 -14.119 -4.277 1.00 0.38 N ATOM 1802 CA VAL A 159 3.345 -14.591 -5.653 1.00 0.43 C ATOM 1803 C VAL A 159 3.806 -16.044 -5.702 1.00 0.45 C ATOM 1804 O VAL A 159 3.378 -16.813 -6.563 1.00 0.49 O ATOM 1805 CB VAL A 159 4.304 -13.718 -6.489 1.00 0.50 C ATOM 1806 CG1 VAL A 159 5.334 -14.573 -7.215 1.00 0.77 C ATOM 1807 CG2 VAL A 159 3.520 -12.866 -7.477 1.00 0.73 C ATOM 0 H VAL A 159 3.720 -13.222 -4.111 1.00 0.38 H new ATOM 0 HA VAL A 159 2.345 -14.519 -6.080 1.00 0.43 H new ATOM 0 HB VAL A 159 4.840 -13.057 -5.808 1.00 0.50 H new ATOM 0 HG11 VAL A 159 5.996 -13.931 -7.796 1.00 0.77 H new ATOM 0 HG12 VAL A 159 5.920 -15.134 -6.487 1.00 0.77 H new ATOM 0 HG13 VAL A 159 4.825 -15.268 -7.883 1.00 0.77 H new ATOM 0 HG21 VAL A 159 4.210 -12.256 -8.059 1.00 0.73 H new ATOM 0 HG22 VAL A 159 2.954 -13.513 -8.147 1.00 0.73 H new ATOM 0 HG23 VAL A 159 2.833 -12.218 -6.933 1.00 0.73 H new ATOM 1817 N GLU A 160 4.678 -16.414 -4.770 1.00 0.44 N ATOM 1818 CA GLU A 160 5.191 -17.776 -4.706 1.00 0.51 C ATOM 1819 C GLU A 160 4.056 -18.766 -4.472 1.00 0.49 C ATOM 1820 O GLU A 160 4.033 -19.851 -5.054 1.00 0.56 O ATOM 1821 CB GLU A 160 6.232 -17.902 -3.591 1.00 0.57 C ATOM 1822 CG GLU A 160 7.411 -18.788 -3.957 1.00 1.15 C ATOM 1823 CD GLU A 160 8.585 -18.617 -3.014 1.00 1.62 C ATOM 1824 OE1 GLU A 160 8.350 -18.395 -1.808 1.00 2.33 O ATOM 1825 OE2 GLU A 160 9.740 -18.706 -3.481 1.00 2.13 O ATOM 0 H GLU A 160 5.043 -15.790 -4.050 1.00 0.44 H new ATOM 0 HA GLU A 160 5.665 -18.007 -5.660 1.00 0.51 H new ATOM 0 HB2 GLU A 160 6.600 -16.909 -3.335 1.00 0.57 H new ATOM 0 HB3 GLU A 160 5.750 -18.303 -2.699 1.00 0.57 H new ATOM 0 HG2 GLU A 160 7.093 -19.831 -3.950 1.00 1.15 H new ATOM 0 HG3 GLU A 160 7.730 -18.559 -4.974 1.00 1.15 H new ATOM 1832 N SER A 161 3.113 -18.382 -3.618 1.00 0.45 N ATOM 1833 CA SER A 161 1.970 -19.230 -3.308 1.00 0.46 C ATOM 1834 C SER A 161 1.175 -19.549 -4.570 1.00 0.44 C ATOM 1835 O SER A 161 1.065 -20.707 -4.969 1.00 0.47 O ATOM 1836 CB SER A 161 1.068 -18.548 -2.278 1.00 0.48 C ATOM 1837 OG SER A 161 1.769 -17.536 -1.577 1.00 1.17 O ATOM 0 H SER A 161 3.119 -17.487 -3.128 1.00 0.45 H new ATOM 0 HA SER A 161 2.342 -20.165 -2.889 1.00 0.46 H new ATOM 0 HB2 SER A 161 0.202 -18.115 -2.779 1.00 0.48 H new ATOM 0 HB3 SER A 161 0.691 -19.289 -1.573 1.00 0.48 H new ATOM 0 HG SER A 161 1.684 -16.686 -2.058 1.00 1.17 H new ATOM 1843 N VAL A 162 0.631 -18.512 -5.199 1.00 0.42 N ATOM 1844 CA VAL A 162 -0.146 -18.687 -6.422 1.00 0.42 C ATOM 1845 C VAL A 162 0.641 -19.473 -7.469 1.00 0.41 C ATOM 1846 O VAL A 162 0.059 -20.121 -8.338 1.00 0.48 O ATOM 1847 CB VAL A 162 -0.573 -17.334 -7.023 1.00 0.46 C ATOM 1848 CG1 VAL A 162 0.469 -16.830 -8.009 1.00 0.73 C ATOM 1849 CG2 VAL A 162 -1.932 -17.457 -7.694 1.00 0.91 C ATOM 0 H VAL A 162 0.713 -17.545 -4.884 1.00 0.42 H new ATOM 0 HA VAL A 162 -1.039 -19.248 -6.147 1.00 0.42 H new ATOM 0 HB VAL A 162 -0.652 -16.608 -6.214 1.00 0.46 H new ATOM 0 HG11 VAL A 162 0.147 -15.874 -8.421 1.00 0.73 H new ATOM 0 HG12 VAL A 162 1.423 -16.702 -7.497 1.00 0.73 H new ATOM 0 HG13 VAL A 162 0.585 -17.553 -8.817 1.00 0.73 H new ATOM 0 HG21 VAL A 162 -2.219 -16.493 -8.113 1.00 0.91 H new ATOM 0 HG22 VAL A 162 -1.878 -18.198 -8.491 1.00 0.91 H new ATOM 0 HG23 VAL A 162 -2.674 -17.768 -6.959 1.00 0.91 H new ATOM 1859 N ASN A 163 1.968 -19.420 -7.375 1.00 0.48 N ATOM 1860 CA ASN A 163 2.828 -20.134 -8.310 1.00 0.51 C ATOM 1861 C ASN A 163 2.785 -21.635 -8.039 1.00 0.60 C ATOM 1862 O ASN A 163 2.737 -22.443 -8.967 1.00 0.96 O ATOM 1863 CB ASN A 163 4.266 -19.625 -8.205 1.00 0.56 C ATOM 1864 CG ASN A 163 4.895 -19.388 -9.564 1.00 0.96 C ATOM 1865 OD1 ASN A 163 4.819 -20.237 -10.453 1.00 1.65 O ATOM 1866 ND2 ASN A 163 5.522 -18.229 -9.732 1.00 1.36 N ATOM 0 H ASN A 163 2.468 -18.890 -6.661 1.00 0.48 H new ATOM 0 HA ASN A 163 2.462 -19.951 -9.320 1.00 0.51 H new ATOM 0 HB2 ASN A 163 4.279 -18.696 -7.634 1.00 0.56 H new ATOM 0 HB3 ASN A 163 4.865 -20.348 -7.651 1.00 0.56 H new ATOM 0 HD21 ASN A 163 5.965 -18.014 -10.625 1.00 1.36 H new ATOM 0 HD22 ASN A 163 5.560 -17.554 -8.968 1.00 1.36 H new ATOM 1873 N ARG A 164 2.810 -22.000 -6.760 1.00 0.54 N ATOM 1874 CA ARG A 164 2.780 -23.405 -6.362 1.00 0.61 C ATOM 1875 C ARG A 164 1.354 -23.887 -6.087 1.00 0.56 C ATOM 1876 O ARG A 164 1.153 -24.858 -5.359 1.00 0.65 O ATOM 1877 CB ARG A 164 3.646 -23.618 -5.119 1.00 0.74 C ATOM 1878 CG ARG A 164 5.108 -23.889 -5.434 1.00 1.40 C ATOM 1879 CD ARG A 164 5.639 -25.070 -4.638 1.00 1.61 C ATOM 1880 NE ARG A 164 6.635 -25.832 -5.387 1.00 2.47 N ATOM 1881 CZ ARG A 164 7.098 -27.023 -5.012 1.00 3.10 C ATOM 1882 NH1 ARG A 164 6.660 -27.596 -3.896 1.00 3.26 N ATOM 1883 NH2 ARG A 164 8.004 -27.644 -5.755 1.00 4.01 N ATOM 0 H ARG A 164 2.851 -21.343 -5.981 1.00 0.54 H new ATOM 0 HA ARG A 164 3.178 -23.990 -7.191 1.00 0.61 H new ATOM 0 HB2 ARG A 164 3.578 -22.735 -4.483 1.00 0.74 H new ATOM 0 HB3 ARG A 164 3.245 -24.455 -4.547 1.00 0.74 H new ATOM 0 HG2 ARG A 164 5.221 -24.087 -6.500 1.00 1.40 H new ATOM 0 HG3 ARG A 164 5.700 -23.002 -5.210 1.00 1.40 H new ATOM 0 HD2 ARG A 164 6.081 -24.711 -3.708 1.00 1.61 H new ATOM 0 HD3 ARG A 164 4.811 -25.725 -4.365 1.00 1.61 H new ATOM 0 HE ARG A 164 6.998 -25.427 -6.250 1.00 2.47 H new ATOM 0 HH11 ARG A 164 5.964 -27.123 -3.319 1.00 3.26 H new ATOM 0 HH12 ARG A 164 7.020 -28.508 -3.616 1.00 3.26 H new ATOM 0 HH21 ARG A 164 8.345 -27.209 -6.612 1.00 4.01 H new ATOM 0 HH22 ARG A 164 8.360 -28.556 -5.469 1.00 4.01 H new ATOM 1897 N GLU A 165 0.367 -23.213 -6.675 1.00 0.60 N ATOM 1898 CA GLU A 165 -1.031 -23.591 -6.488 1.00 0.63 C ATOM 1899 C GLU A 165 -1.499 -23.296 -5.066 1.00 0.53 C ATOM 1900 O GLU A 165 -2.334 -24.015 -4.516 1.00 0.64 O ATOM 1901 CB GLU A 165 -1.224 -25.076 -6.801 1.00 0.78 C ATOM 1902 CG GLU A 165 -2.352 -25.350 -7.783 1.00 1.48 C ATOM 1903 CD GLU A 165 -2.272 -26.737 -8.388 1.00 1.94 C ATOM 1904 OE1 GLU A 165 -2.041 -27.703 -7.631 1.00 2.49 O ATOM 1905 OE2 GLU A 165 -2.439 -26.858 -9.620 1.00 2.57 O ATOM 0 H GLU A 165 0.509 -22.406 -7.282 1.00 0.60 H new ATOM 0 HA GLU A 165 -1.633 -22.996 -7.175 1.00 0.63 H new ATOM 0 HB2 GLU A 165 -0.295 -25.477 -7.207 1.00 0.78 H new ATOM 0 HB3 GLU A 165 -1.424 -25.611 -5.873 1.00 0.78 H new ATOM 0 HG2 GLU A 165 -3.309 -25.234 -7.274 1.00 1.48 H new ATOM 0 HG3 GLU A 165 -2.323 -24.607 -8.580 1.00 1.48 H new ATOM 1912 N MET A 166 -0.957 -22.237 -4.475 1.00 0.47 N ATOM 1913 CA MET A 166 -1.320 -21.849 -3.117 1.00 0.44 C ATOM 1914 C MET A 166 -1.847 -20.415 -3.083 1.00 0.44 C ATOM 1915 O MET A 166 -1.456 -19.616 -2.233 1.00 0.59 O ATOM 1916 CB MET A 166 -0.110 -21.991 -2.189 1.00 0.49 C ATOM 1917 CG MET A 166 -0.032 -23.342 -1.499 1.00 0.87 C ATOM 1918 SD MET A 166 0.027 -24.717 -2.664 1.00 1.06 S ATOM 1919 CE MET A 166 1.591 -25.470 -2.222 1.00 0.90 C ATOM 0 H MET A 166 -0.264 -21.632 -4.915 1.00 0.47 H new ATOM 0 HA MET A 166 -2.113 -22.511 -2.771 1.00 0.44 H new ATOM 0 HB2 MET A 166 0.801 -21.833 -2.766 1.00 0.49 H new ATOM 0 HB3 MET A 166 -0.148 -21.207 -1.433 1.00 0.49 H new ATOM 0 HG2 MET A 166 0.854 -23.371 -0.865 1.00 0.87 H new ATOM 0 HG3 MET A 166 -0.896 -23.462 -0.845 1.00 0.87 H new ATOM 0 HE1 MET A 166 1.770 -26.338 -2.857 1.00 0.90 H new ATOM 0 HE2 MET A 166 2.395 -24.747 -2.361 1.00 0.90 H new ATOM 0 HE3 MET A 166 1.562 -25.784 -1.179 1.00 0.90 H new ATOM 1929 N SER A 167 -2.741 -20.096 -4.013 1.00 0.40 N ATOM 1930 CA SER A 167 -3.323 -18.760 -4.088 1.00 0.43 C ATOM 1931 C SER A 167 -3.875 -18.321 -2.734 1.00 0.42 C ATOM 1932 O SER A 167 -3.529 -17.253 -2.230 1.00 0.45 O ATOM 1933 CB SER A 167 -4.433 -18.723 -5.140 1.00 0.51 C ATOM 1934 OG SER A 167 -5.654 -18.272 -4.578 1.00 1.41 O ATOM 0 H SER A 167 -3.078 -20.744 -4.725 1.00 0.40 H new ATOM 0 HA SER A 167 -2.533 -18.067 -4.376 1.00 0.43 H new ATOM 0 HB2 SER A 167 -4.141 -18.065 -5.958 1.00 0.51 H new ATOM 0 HB3 SER A 167 -4.570 -19.718 -5.564 1.00 0.51 H new ATOM 0 HG SER A 167 -5.796 -17.332 -4.815 1.00 1.41 H new ATOM 1940 N PRO A 168 -4.747 -19.142 -2.126 1.00 0.45 N ATOM 1941 CA PRO A 168 -5.350 -18.833 -0.826 1.00 0.52 C ATOM 1942 C PRO A 168 -4.323 -18.378 0.206 1.00 0.49 C ATOM 1943 O PRO A 168 -4.644 -17.618 1.120 1.00 0.52 O ATOM 1944 CB PRO A 168 -5.974 -20.163 -0.406 1.00 0.63 C ATOM 1945 CG PRO A 168 -6.284 -20.855 -1.688 1.00 0.51 C ATOM 1946 CD PRO A 168 -5.214 -20.435 -2.661 1.00 0.48 C ATOM 0 HA PRO A 168 -6.061 -18.010 -0.894 1.00 0.52 H new ATOM 0 HB2 PRO A 168 -5.286 -20.748 0.204 1.00 0.63 H new ATOM 0 HB3 PRO A 168 -6.874 -20.008 0.189 1.00 0.63 H new ATOM 0 HG2 PRO A 168 -6.287 -21.937 -1.556 1.00 0.51 H new ATOM 0 HG3 PRO A 168 -7.273 -20.576 -2.052 1.00 0.51 H new ATOM 0 HD2 PRO A 168 -4.406 -21.165 -2.708 1.00 0.48 H new ATOM 0 HD3 PRO A 168 -5.609 -20.332 -3.672 1.00 0.48 H new ATOM 1954 N LEU A 169 -3.089 -18.849 0.059 1.00 0.45 N ATOM 1955 CA LEU A 169 -2.019 -18.491 0.984 1.00 0.47 C ATOM 1956 C LEU A 169 -1.702 -17.000 0.908 1.00 0.40 C ATOM 1957 O LEU A 169 -1.288 -16.394 1.897 1.00 0.38 O ATOM 1958 CB LEU A 169 -0.762 -19.309 0.684 1.00 0.54 C ATOM 1959 CG LEU A 169 -0.171 -20.053 1.884 1.00 0.82 C ATOM 1960 CD1 LEU A 169 0.962 -20.965 1.441 1.00 1.27 C ATOM 1961 CD2 LEU A 169 0.316 -19.067 2.935 1.00 1.64 C ATOM 0 H LEU A 169 -2.805 -19.479 -0.691 1.00 0.45 H new ATOM 0 HA LEU A 169 -2.359 -18.717 1.995 1.00 0.47 H new ATOM 0 HB2 LEU A 169 -0.997 -20.035 -0.094 1.00 0.54 H new ATOM 0 HB3 LEU A 169 -0.001 -18.642 0.279 1.00 0.54 H new ATOM 0 HG LEU A 169 -0.954 -20.669 2.327 1.00 0.82 H new ATOM 0 HD11 LEU A 169 1.370 -21.486 2.307 1.00 1.27 H new ATOM 0 HD12 LEU A 169 0.583 -21.694 0.725 1.00 1.27 H new ATOM 0 HD13 LEU A 169 1.746 -20.370 0.973 1.00 1.27 H new ATOM 0 HD21 LEU A 169 0.733 -19.613 3.781 1.00 1.64 H new ATOM 0 HD22 LEU A 169 1.084 -18.425 2.503 1.00 1.64 H new ATOM 0 HD23 LEU A 169 -0.520 -18.455 3.275 1.00 1.64 H new ATOM 1973 N VAL A 170 -1.898 -16.413 -0.268 1.00 0.38 N ATOM 1974 CA VAL A 170 -1.630 -14.992 -0.465 1.00 0.36 C ATOM 1975 C VAL A 170 -2.497 -14.134 0.454 1.00 0.30 C ATOM 1976 O VAL A 170 -2.110 -13.027 0.829 1.00 0.29 O ATOM 1977 CB VAL A 170 -1.873 -14.562 -1.925 1.00 0.39 C ATOM 1978 CG1 VAL A 170 -1.309 -15.590 -2.894 1.00 0.93 C ATOM 1979 CG2 VAL A 170 -3.357 -14.338 -2.174 1.00 1.04 C ATOM 0 H VAL A 170 -2.241 -16.897 -1.098 1.00 0.38 H new ATOM 0 HA VAL A 170 -0.579 -14.838 -0.222 1.00 0.36 H new ATOM 0 HB VAL A 170 -1.352 -13.620 -2.096 1.00 0.39 H new ATOM 0 HG11 VAL A 170 -1.493 -15.264 -3.918 1.00 0.93 H new ATOM 0 HG12 VAL A 170 -0.236 -15.692 -2.733 1.00 0.93 H new ATOM 0 HG13 VAL A 170 -1.794 -16.552 -2.727 1.00 0.93 H new ATOM 0 HG21 VAL A 170 -3.510 -14.035 -3.210 1.00 1.04 H new ATOM 0 HG22 VAL A 170 -3.902 -15.262 -1.982 1.00 1.04 H new ATOM 0 HG23 VAL A 170 -3.724 -13.556 -1.509 1.00 1.04 H new ATOM 1989 N ASP A 171 -3.669 -14.650 0.814 1.00 0.27 N ATOM 1990 CA ASP A 171 -4.585 -13.927 1.689 1.00 0.25 C ATOM 1991 C ASP A 171 -4.020 -13.826 3.102 1.00 0.23 C ATOM 1992 O ASP A 171 -3.966 -12.743 3.684 1.00 0.23 O ATOM 1993 CB ASP A 171 -5.948 -14.620 1.721 1.00 0.27 C ATOM 1994 CG ASP A 171 -7.018 -13.761 2.366 1.00 0.92 C ATOM 1995 OD1 ASP A 171 -6.902 -13.479 3.577 1.00 1.75 O ATOM 1996 OD2 ASP A 171 -7.971 -13.371 1.660 1.00 1.59 O ATOM 0 H ASP A 171 -4.006 -15.565 0.514 1.00 0.27 H new ATOM 0 HA ASP A 171 -4.707 -12.919 1.292 1.00 0.25 H new ATOM 0 HB2 ASP A 171 -6.250 -14.869 0.704 1.00 0.27 H new ATOM 0 HB3 ASP A 171 -5.862 -15.560 2.267 1.00 0.27 H new ATOM 2001 N ASN A 172 -3.597 -14.962 3.646 1.00 0.25 N ATOM 2002 CA ASN A 172 -3.034 -15.001 4.990 1.00 0.27 C ATOM 2003 C ASN A 172 -1.797 -14.114 5.085 1.00 0.24 C ATOM 2004 O ASN A 172 -1.523 -13.522 6.129 1.00 0.29 O ATOM 2005 CB ASN A 172 -2.677 -16.438 5.375 1.00 0.32 C ATOM 2006 CG ASN A 172 -3.505 -16.947 6.538 1.00 0.74 C ATOM 2007 OD1 ASN A 172 -3.941 -16.173 7.390 1.00 1.69 O ATOM 2008 ND2 ASN A 172 -3.726 -18.255 6.579 1.00 1.20 N ATOM 0 H ASN A 172 -3.633 -15.867 3.177 1.00 0.25 H new ATOM 0 HA ASN A 172 -3.785 -14.623 5.684 1.00 0.27 H new ATOM 0 HB2 ASN A 172 -2.826 -17.090 4.514 1.00 0.32 H new ATOM 0 HB3 ASN A 172 -1.620 -16.490 5.635 1.00 0.32 H new ATOM 0 HD21 ASN A 172 -4.277 -18.656 7.338 1.00 1.20 H new ATOM 0 HD22 ASN A 172 -3.345 -18.860 5.851 1.00 1.20 H new ATOM 2015 N ILE A 173 -1.054 -14.025 3.986 1.00 0.22 N ATOM 2016 CA ILE A 173 0.152 -13.208 3.944 1.00 0.21 C ATOM 2017 C ILE A 173 -0.180 -11.733 4.142 1.00 0.20 C ATOM 2018 O ILE A 173 0.268 -11.109 5.104 1.00 0.20 O ATOM 2019 CB ILE A 173 0.902 -13.378 2.609 1.00 0.23 C ATOM 2020 CG1 ILE A 173 1.855 -14.573 2.682 1.00 0.41 C ATOM 2021 CG2 ILE A 173 1.662 -12.107 2.262 1.00 0.32 C ATOM 2022 CD1 ILE A 173 1.675 -15.559 1.548 1.00 0.47 C ATOM 0 H ILE A 173 -1.267 -14.509 3.114 1.00 0.22 H new ATOM 0 HA ILE A 173 0.793 -13.548 4.757 1.00 0.21 H new ATOM 0 HB ILE A 173 0.172 -13.567 1.822 1.00 0.23 H new ATOM 0 HG12 ILE A 173 2.882 -14.209 2.677 1.00 0.41 H new ATOM 0 HG13 ILE A 173 1.705 -15.090 3.630 1.00 0.41 H new ATOM 0 HG21 ILE A 173 2.186 -12.243 1.316 1.00 0.32 H new ATOM 0 HG22 ILE A 173 0.961 -11.277 2.172 1.00 0.32 H new ATOM 0 HG23 ILE A 173 2.384 -11.888 3.049 1.00 0.32 H new ATOM 0 HD11 ILE A 173 2.383 -16.380 1.664 1.00 0.47 H new ATOM 0 HD12 ILE A 173 0.658 -15.951 1.565 1.00 0.47 H new ATOM 0 HD13 ILE A 173 1.854 -15.057 0.597 1.00 0.47 H new ATOM 2034 N ALA A 174 -0.972 -11.183 3.227 1.00 0.20 N ATOM 2035 CA ALA A 174 -1.368 -9.782 3.303 1.00 0.23 C ATOM 2036 C ALA A 174 -1.885 -9.435 4.694 1.00 0.21 C ATOM 2037 O ALA A 174 -1.686 -8.323 5.182 1.00 0.22 O ATOM 2038 CB ALA A 174 -2.424 -9.475 2.252 1.00 0.26 C ATOM 0 H ALA A 174 -1.352 -11.686 2.425 1.00 0.20 H new ATOM 0 HA ALA A 174 -0.489 -9.168 3.107 1.00 0.23 H new ATOM 0 HB1 ALA A 174 -2.711 -8.426 2.320 1.00 0.26 H new ATOM 0 HB2 ALA A 174 -2.020 -9.677 1.260 1.00 0.26 H new ATOM 0 HB3 ALA A 174 -3.299 -10.102 2.422 1.00 0.26 H new ATOM 2044 N LEU A 175 -2.548 -10.396 5.330 1.00 0.21 N ATOM 2045 CA LEU A 175 -3.091 -10.192 6.668 1.00 0.22 C ATOM 2046 C LEU A 175 -1.967 -10.037 7.688 1.00 0.21 C ATOM 2047 O LEU A 175 -1.845 -8.997 8.335 1.00 0.20 O ATOM 2048 CB LEU A 175 -3.996 -11.362 7.059 1.00 0.25 C ATOM 2049 CG LEU A 175 -4.314 -11.465 8.552 1.00 0.28 C ATOM 2050 CD1 LEU A 175 -5.807 -11.657 8.767 1.00 0.92 C ATOM 2051 CD2 LEU A 175 -3.531 -12.606 9.185 1.00 0.84 C ATOM 0 H LEU A 175 -2.722 -11.323 4.941 1.00 0.21 H new ATOM 0 HA LEU A 175 -3.681 -9.276 6.660 1.00 0.22 H new ATOM 0 HB2 LEU A 175 -4.933 -11.276 6.509 1.00 0.25 H new ATOM 0 HB3 LEU A 175 -3.522 -12.290 6.739 1.00 0.25 H new ATOM 0 HG LEU A 175 -4.015 -10.534 9.034 1.00 0.28 H new ATOM 0 HD11 LEU A 175 -6.015 -11.728 9.835 1.00 0.92 H new ATOM 0 HD12 LEU A 175 -6.347 -10.808 8.348 1.00 0.92 H new ATOM 0 HD13 LEU A 175 -6.131 -12.573 8.272 1.00 0.92 H new ATOM 0 HD21 LEU A 175 -3.769 -12.665 10.247 1.00 0.84 H new ATOM 0 HD22 LEU A 175 -3.799 -13.545 8.700 1.00 0.84 H new ATOM 0 HD23 LEU A 175 -2.463 -12.427 9.062 1.00 0.84 H new ATOM 2063 N TRP A 176 -1.153 -11.082 7.822 1.00 0.21 N ATOM 2064 CA TRP A 176 -0.033 -11.071 8.761 1.00 0.22 C ATOM 2065 C TRP A 176 0.745 -9.763 8.661 1.00 0.21 C ATOM 2066 O TRP A 176 0.995 -9.098 9.667 1.00 0.21 O ATOM 2067 CB TRP A 176 0.902 -12.251 8.488 1.00 0.25 C ATOM 2068 CG TRP A 176 0.233 -13.586 8.614 1.00 0.26 C ATOM 2069 CD1 TRP A 176 -0.739 -13.935 9.505 1.00 0.31 C ATOM 2070 CD2 TRP A 176 0.491 -14.750 7.822 1.00 0.27 C ATOM 2071 NE1 TRP A 176 -1.104 -15.247 9.315 1.00 0.35 N ATOM 2072 CE2 TRP A 176 -0.363 -15.769 8.287 1.00 0.32 C ATOM 2073 CE3 TRP A 176 1.360 -15.031 6.763 1.00 0.28 C ATOM 2074 CZ2 TRP A 176 -0.372 -17.045 7.730 1.00 0.36 C ATOM 2075 CZ3 TRP A 176 1.350 -16.298 6.211 1.00 0.32 C ATOM 2076 CH2 TRP A 176 0.489 -17.291 6.695 1.00 0.35 C ATOM 0 H TRP A 176 -1.248 -11.948 7.292 1.00 0.21 H new ATOM 0 HA TRP A 176 -0.437 -11.161 9.769 1.00 0.22 H new ATOM 0 HB2 TRP A 176 1.314 -12.153 7.483 1.00 0.25 H new ATOM 0 HB3 TRP A 176 1.741 -12.207 9.182 1.00 0.25 H new ATOM 0 HD1 TRP A 176 -1.160 -13.277 10.251 1.00 0.31 H new ATOM 0 HE1 TRP A 176 -1.811 -15.750 9.852 1.00 0.35 H new ATOM 0 HE3 TRP A 176 2.027 -14.271 6.383 1.00 0.28 H new ATOM 0 HZ2 TRP A 176 -1.034 -17.813 8.101 1.00 0.36 H new ATOM 0 HZ3 TRP A 176 2.017 -16.526 5.393 1.00 0.32 H new ATOM 0 HH2 TRP A 176 0.505 -18.271 6.242 1.00 0.35 H new ATOM 2087 N MET A 177 1.120 -9.399 7.439 1.00 0.20 N ATOM 2088 CA MET A 177 1.865 -8.169 7.202 1.00 0.20 C ATOM 2089 C MET A 177 1.149 -6.974 7.823 1.00 0.19 C ATOM 2090 O MET A 177 1.740 -6.210 8.585 1.00 0.20 O ATOM 2091 CB MET A 177 2.050 -7.945 5.700 1.00 0.20 C ATOM 2092 CG MET A 177 2.797 -9.071 5.005 1.00 0.97 C ATOM 2093 SD MET A 177 2.860 -8.861 3.215 1.00 1.50 S ATOM 2094 CE MET A 177 3.996 -7.485 3.076 1.00 0.87 C ATOM 0 H MET A 177 0.920 -9.939 6.597 1.00 0.20 H new ATOM 0 HA MET A 177 2.844 -8.267 7.671 1.00 0.20 H new ATOM 0 HB2 MET A 177 1.071 -7.828 5.235 1.00 0.20 H new ATOM 0 HB3 MET A 177 2.590 -7.011 5.544 1.00 0.20 H new ATOM 0 HG2 MET A 177 3.813 -9.124 5.397 1.00 0.97 H new ATOM 0 HG3 MET A 177 2.315 -10.020 5.239 1.00 0.97 H new ATOM 0 HE1 MET A 177 4.276 -7.349 2.032 1.00 0.87 H new ATOM 0 HE2 MET A 177 3.516 -6.578 3.444 1.00 0.87 H new ATOM 0 HE3 MET A 177 4.888 -7.689 3.668 1.00 0.87 H new ATOM 2104 N THR A 178 -0.129 -6.821 7.490 1.00 0.21 N ATOM 2105 CA THR A 178 -0.929 -5.720 8.015 1.00 0.22 C ATOM 2106 C THR A 178 -0.797 -5.629 9.532 1.00 0.22 C ATOM 2107 O THR A 178 -0.629 -4.543 10.087 1.00 0.22 O ATOM 2108 CB THR A 178 -2.398 -5.899 7.629 1.00 0.24 C ATOM 2109 OG1 THR A 178 -2.603 -5.567 6.267 1.00 0.42 O ATOM 2110 CG2 THR A 178 -3.341 -5.052 8.455 1.00 0.39 C ATOM 0 H THR A 178 -0.632 -7.445 6.860 1.00 0.21 H new ATOM 0 HA THR A 178 -0.557 -4.793 7.579 1.00 0.22 H new ATOM 0 HB THR A 178 -2.620 -6.949 7.817 1.00 0.24 H new ATOM 0 HG1 THR A 178 -3.548 -5.690 6.039 1.00 0.42 H new ATOM 0 HG21 THR A 178 -4.367 -5.227 8.130 1.00 0.39 H new ATOM 0 HG22 THR A 178 -3.243 -5.319 9.507 1.00 0.39 H new ATOM 0 HG23 THR A 178 -3.093 -3.999 8.324 1.00 0.39 H new ATOM 2118 N GLU A 179 -0.875 -6.778 10.195 1.00 0.24 N ATOM 2119 CA GLU A 179 -0.765 -6.831 11.648 1.00 0.26 C ATOM 2120 C GLU A 179 0.512 -6.146 12.121 1.00 0.23 C ATOM 2121 O GLU A 179 0.463 -5.094 12.755 1.00 0.33 O ATOM 2122 CB GLU A 179 -0.788 -8.283 12.129 1.00 0.33 C ATOM 2123 CG GLU A 179 -2.113 -8.697 12.748 1.00 0.60 C ATOM 2124 CD GLU A 179 -1.955 -9.790 13.787 1.00 1.46 C ATOM 2125 OE1 GLU A 179 -1.404 -9.503 14.871 1.00 2.08 O ATOM 2126 OE2 GLU A 179 -2.382 -10.932 13.518 1.00 2.25 O ATOM 0 H GLU A 179 -1.014 -7.685 9.749 1.00 0.24 H new ATOM 0 HA GLU A 179 -1.618 -6.302 12.072 1.00 0.26 H new ATOM 0 HB2 GLU A 179 -0.569 -8.940 11.287 1.00 0.33 H new ATOM 0 HB3 GLU A 179 0.007 -8.427 12.861 1.00 0.33 H new ATOM 0 HG2 GLU A 179 -2.582 -7.828 13.209 1.00 0.60 H new ATOM 0 HG3 GLU A 179 -2.785 -9.042 11.962 1.00 0.60 H new ATOM 2133 N TYR A 180 1.653 -6.752 11.810 1.00 0.26 N ATOM 2134 CA TYR A 180 2.947 -6.202 12.203 1.00 0.25 C ATOM 2135 C TYR A 180 3.031 -4.713 11.880 1.00 0.23 C ATOM 2136 O TYR A 180 3.591 -3.930 12.648 1.00 0.23 O ATOM 2137 CB TYR A 180 4.076 -6.955 11.494 1.00 0.30 C ATOM 2138 CG TYR A 180 5.463 -6.526 11.922 1.00 0.33 C ATOM 2139 CD1 TYR A 180 5.967 -5.280 11.570 1.00 0.73 C ATOM 2140 CD2 TYR A 180 6.268 -7.370 12.678 1.00 0.68 C ATOM 2141 CE1 TYR A 180 7.234 -4.888 11.958 1.00 0.77 C ATOM 2142 CE2 TYR A 180 7.536 -6.984 13.070 1.00 0.70 C ATOM 2143 CZ TYR A 180 8.014 -5.743 12.708 1.00 0.45 C ATOM 2144 OH TYR A 180 9.276 -5.355 13.097 1.00 0.52 O ATOM 0 H TYR A 180 1.709 -7.625 11.286 1.00 0.26 H new ATOM 0 HA TYR A 180 3.054 -6.324 13.281 1.00 0.25 H new ATOM 0 HB2 TYR A 180 3.962 -8.022 11.683 1.00 0.30 H new ATOM 0 HB3 TYR A 180 3.977 -6.809 10.418 1.00 0.30 H new ATOM 0 HD1 TYR A 180 5.359 -4.607 10.984 1.00 0.73 H new ATOM 0 HD2 TYR A 180 5.897 -8.343 12.964 1.00 0.68 H new ATOM 0 HE1 TYR A 180 7.612 -3.917 11.675 1.00 0.77 H new ATOM 0 HE2 TYR A 180 8.149 -7.652 13.657 1.00 0.70 H new ATOM 0 HH TYR A 180 9.625 -4.694 12.463 1.00 0.52 H new ATOM 2154 N LEU A 181 2.477 -4.332 10.734 1.00 0.23 N ATOM 2155 CA LEU A 181 2.492 -2.939 10.296 1.00 0.24 C ATOM 2156 C LEU A 181 1.967 -2.002 11.382 1.00 0.24 C ATOM 2157 O LEU A 181 2.591 -0.989 11.695 1.00 0.26 O ATOM 2158 CB LEU A 181 1.658 -2.780 9.024 1.00 0.27 C ATOM 2159 CG LEU A 181 2.300 -1.926 7.930 1.00 0.42 C ATOM 2160 CD1 LEU A 181 1.386 -1.835 6.719 1.00 0.82 C ATOM 2161 CD2 LEU A 181 2.624 -0.539 8.462 1.00 0.37 C ATOM 0 H LEU A 181 2.010 -4.970 10.089 1.00 0.23 H new ATOM 0 HA LEU A 181 3.527 -2.667 10.090 1.00 0.24 H new ATOM 0 HB2 LEU A 181 1.452 -3.770 8.617 1.00 0.27 H new ATOM 0 HB3 LEU A 181 0.697 -2.339 9.291 1.00 0.27 H new ATOM 0 HG LEU A 181 3.230 -2.402 7.621 1.00 0.42 H new ATOM 0 HD11 LEU A 181 1.859 -1.223 5.951 1.00 0.82 H new ATOM 0 HD12 LEU A 181 1.203 -2.835 6.325 1.00 0.82 H new ATOM 0 HD13 LEU A 181 0.439 -1.381 7.011 1.00 0.82 H new ATOM 0 HD21 LEU A 181 3.080 0.057 7.671 1.00 0.37 H new ATOM 0 HD22 LEU A 181 1.707 -0.055 8.798 1.00 0.37 H new ATOM 0 HD23 LEU A 181 3.317 -0.623 9.299 1.00 0.37 H new ATOM 2173 N ASN A 182 0.809 -2.331 11.941 1.00 0.24 N ATOM 2174 CA ASN A 182 0.202 -1.501 12.976 1.00 0.27 C ATOM 2175 C ASN A 182 0.723 -1.861 14.367 1.00 0.27 C ATOM 2176 O ASN A 182 0.717 -1.031 15.275 1.00 0.29 O ATOM 2177 CB ASN A 182 -1.320 -1.643 12.941 1.00 0.30 C ATOM 2178 CG ASN A 182 -2.029 -0.315 13.116 1.00 0.90 C ATOM 2179 OD1 ASN A 182 -1.512 0.734 12.731 1.00 1.64 O ATOM 2180 ND2 ASN A 182 -3.221 -0.353 13.701 1.00 1.59 N ATOM 0 H ASN A 182 0.272 -3.163 11.697 1.00 0.24 H new ATOM 0 HA ASN A 182 0.477 -0.466 12.771 1.00 0.27 H new ATOM 0 HB2 ASN A 182 -1.619 -2.089 11.992 1.00 0.30 H new ATOM 0 HB3 ASN A 182 -1.636 -2.327 13.728 1.00 0.30 H new ATOM 0 HD21 ASN A 182 -3.745 0.510 13.847 1.00 1.59 H new ATOM 0 HD22 ASN A 182 -3.612 -1.245 14.005 1.00 1.59 H new ATOM 2187 N ARG A 183 1.144 -3.107 14.540 1.00 0.25 N ATOM 2188 CA ARG A 183 1.635 -3.573 15.832 1.00 0.26 C ATOM 2189 C ARG A 183 2.931 -2.878 16.249 1.00 0.26 C ATOM 2190 O ARG A 183 2.932 -2.048 17.158 1.00 0.29 O ATOM 2191 CB ARG A 183 1.853 -5.086 15.793 1.00 0.26 C ATOM 2192 CG ARG A 183 1.084 -5.841 16.865 1.00 0.53 C ATOM 2193 CD ARG A 183 1.228 -7.345 16.697 1.00 0.44 C ATOM 2194 NE ARG A 183 0.642 -8.080 17.815 1.00 1.01 N ATOM 2195 CZ ARG A 183 0.600 -9.409 17.891 1.00 1.34 C ATOM 2196 NH1 ARG A 183 1.109 -10.157 16.918 1.00 1.82 N ATOM 2197 NH2 ARG A 183 0.047 -9.994 18.945 1.00 2.01 N ATOM 0 H ARG A 183 1.156 -3.813 13.804 1.00 0.25 H new ATOM 0 HA ARG A 183 0.876 -3.323 16.573 1.00 0.26 H new ATOM 0 HB2 ARG A 183 1.558 -5.462 14.813 1.00 0.26 H new ATOM 0 HB3 ARG A 183 2.917 -5.294 15.907 1.00 0.26 H new ATOM 0 HG2 ARG A 183 1.447 -5.547 17.850 1.00 0.53 H new ATOM 0 HG3 ARG A 183 0.030 -5.568 16.819 1.00 0.53 H new ATOM 0 HD2 ARG A 183 0.747 -7.654 15.769 1.00 0.44 H new ATOM 0 HD3 ARG A 183 2.284 -7.600 16.609 1.00 0.44 H new ATOM 0 HE ARG A 183 0.241 -7.543 18.584 1.00 1.01 H new ATOM 0 HH11 ARG A 183 1.536 -9.714 16.105 1.00 1.82 H new ATOM 0 HH12 ARG A 183 1.073 -11.174 16.984 1.00 1.82 H new ATOM 0 HH21 ARG A 183 -0.345 -9.426 19.696 1.00 2.01 H new ATOM 0 HH22 ARG A 183 0.014 -11.012 19.005 1.00 2.01 H new ATOM 2211 N HIS A 184 4.037 -3.240 15.603 1.00 0.25 N ATOM 2212 CA HIS A 184 5.340 -2.667 15.937 1.00 0.26 C ATOM 2213 C HIS A 184 5.695 -1.463 15.068 1.00 0.24 C ATOM 2214 O HIS A 184 6.295 -0.500 15.546 1.00 0.25 O ATOM 2215 CB HIS A 184 6.428 -3.732 15.802 1.00 0.28 C ATOM 2216 CG HIS A 184 5.965 -5.109 16.167 1.00 0.33 C ATOM 2217 ND1 HIS A 184 6.219 -5.688 17.392 1.00 0.39 N ATOM 2218 CD2 HIS A 184 5.259 -6.023 15.460 1.00 0.35 C ATOM 2219 CE1 HIS A 184 5.690 -6.899 17.423 1.00 0.43 C ATOM 2220 NE2 HIS A 184 5.102 -7.125 16.263 1.00 0.41 N ATOM 0 H HIS A 184 4.058 -3.925 14.848 1.00 0.25 H new ATOM 0 HA HIS A 184 5.278 -2.318 16.968 1.00 0.26 H new ATOM 0 HB2 HIS A 184 6.792 -3.740 14.775 1.00 0.28 H new ATOM 0 HB3 HIS A 184 7.272 -3.461 16.437 1.00 0.28 H new ATOM 0 HD2 HIS A 184 4.889 -5.907 14.452 1.00 0.35 H new ATOM 0 HE1 HIS A 184 5.732 -7.586 18.255 1.00 0.43 H new ATOM 0 HE2 HIS A 184 4.610 -7.981 16.005 1.00 0.41 H new ATOM 2228 N LEU A 185 5.351 -1.530 13.788 1.00 0.24 N ATOM 2229 CA LEU A 185 5.668 -0.453 12.856 1.00 0.24 C ATOM 2230 C LEU A 185 4.937 0.843 13.203 1.00 0.25 C ATOM 2231 O LEU A 185 5.486 1.932 13.036 1.00 0.27 O ATOM 2232 CB LEU A 185 5.336 -0.881 11.427 1.00 0.27 C ATOM 2233 CG LEU A 185 6.542 -1.273 10.574 1.00 0.32 C ATOM 2234 CD1 LEU A 185 6.099 -1.657 9.171 1.00 0.30 C ATOM 2235 CD2 LEU A 185 7.555 -0.140 10.525 1.00 0.56 C ATOM 0 H LEU A 185 4.853 -2.317 13.371 1.00 0.24 H new ATOM 0 HA LEU A 185 6.737 -0.254 12.937 1.00 0.24 H new ATOM 0 HB2 LEU A 185 4.648 -1.726 11.467 1.00 0.27 H new ATOM 0 HB3 LEU A 185 4.810 -0.065 10.932 1.00 0.27 H new ATOM 0 HG LEU A 185 7.021 -2.138 11.032 1.00 0.32 H new ATOM 0 HD11 LEU A 185 6.970 -1.933 8.577 1.00 0.30 H new ATOM 0 HD12 LEU A 185 5.413 -2.503 9.225 1.00 0.30 H new ATOM 0 HD13 LEU A 185 5.595 -0.811 8.704 1.00 0.30 H new ATOM 0 HD21 LEU A 185 8.406 -0.439 9.913 1.00 0.56 H new ATOM 0 HD22 LEU A 185 7.090 0.746 10.092 1.00 0.56 H new ATOM 0 HD23 LEU A 185 7.896 0.087 11.535 1.00 0.56 H new ATOM 2247 N HIS A 186 3.700 0.727 13.675 1.00 0.25 N ATOM 2248 CA HIS A 186 2.909 1.903 14.030 1.00 0.29 C ATOM 2249 C HIS A 186 3.711 2.870 14.897 1.00 0.30 C ATOM 2250 O HIS A 186 3.871 4.041 14.551 1.00 0.32 O ATOM 2251 CB HIS A 186 1.634 1.489 14.764 1.00 0.32 C ATOM 2252 CG HIS A 186 0.779 2.646 15.178 1.00 0.55 C ATOM 2253 ND1 HIS A 186 -0.500 2.845 14.703 1.00 1.23 N ATOM 2254 CD2 HIS A 186 1.025 3.670 16.030 1.00 0.50 C ATOM 2255 CE1 HIS A 186 -1.003 3.941 15.243 1.00 1.59 C ATOM 2256 NE2 HIS A 186 -0.098 4.459 16.052 1.00 1.14 N ATOM 0 H HIS A 186 3.224 -0.164 13.820 1.00 0.25 H new ATOM 0 HA HIS A 186 2.642 2.412 13.104 1.00 0.29 H new ATOM 0 HB2 HIS A 186 1.052 0.830 14.120 1.00 0.32 H new ATOM 0 HB3 HIS A 186 1.905 0.913 15.649 1.00 0.32 H new ATOM 0 HD1 HIS A 186 -0.983 2.240 14.038 1.00 1.23 H new ATOM 0 HD2 HIS A 186 1.935 3.835 16.588 1.00 0.50 H new ATOM 0 HE1 HIS A 186 -1.987 4.344 15.054 1.00 1.59 H new ATOM 2264 N THR A 187 4.206 2.378 16.026 1.00 0.30 N ATOM 2265 CA THR A 187 4.985 3.204 16.941 1.00 0.32 C ATOM 2266 C THR A 187 6.066 3.984 16.198 1.00 0.31 C ATOM 2267 O THR A 187 6.136 5.209 16.294 1.00 0.31 O ATOM 2268 CB THR A 187 5.624 2.334 18.025 1.00 0.34 C ATOM 2269 OG1 THR A 187 4.634 1.624 18.747 1.00 1.16 O ATOM 2270 CG2 THR A 187 6.442 3.125 19.022 1.00 1.13 C ATOM 0 H THR A 187 4.082 1.412 16.330 1.00 0.30 H new ATOM 0 HA THR A 187 4.307 3.919 17.406 1.00 0.32 H new ATOM 0 HB THR A 187 6.289 1.653 17.494 1.00 0.34 H new ATOM 0 HG1 THR A 187 5.063 1.072 19.434 1.00 1.16 H new ATOM 0 HG21 THR A 187 6.867 2.448 19.763 1.00 1.13 H new ATOM 0 HG22 THR A 187 7.247 3.645 18.502 1.00 1.13 H new ATOM 0 HG23 THR A 187 5.803 3.853 19.521 1.00 1.13 H new ATOM 2278 N TRP A 188 6.912 3.267 15.466 1.00 0.31 N ATOM 2279 CA TRP A 188 7.995 3.893 14.717 1.00 0.31 C ATOM 2280 C TRP A 188 7.463 4.823 13.630 1.00 0.33 C ATOM 2281 O TRP A 188 8.014 5.901 13.403 1.00 0.35 O ATOM 2282 CB TRP A 188 8.892 2.828 14.088 1.00 0.33 C ATOM 2283 CG TRP A 188 10.027 3.410 13.306 1.00 0.34 C ATOM 2284 CD1 TRP A 188 11.326 3.523 13.708 1.00 0.37 C ATOM 2285 CD2 TRP A 188 9.964 3.968 11.989 1.00 0.48 C ATOM 2286 NE1 TRP A 188 12.075 4.118 12.722 1.00 0.48 N ATOM 2287 CE2 TRP A 188 11.261 4.400 11.656 1.00 0.55 C ATOM 2288 CE3 TRP A 188 8.936 4.143 11.058 1.00 0.63 C ATOM 2289 CZ2 TRP A 188 11.556 4.997 10.434 1.00 0.72 C ATOM 2290 CZ3 TRP A 188 9.231 4.736 9.845 1.00 0.79 C ATOM 2291 CH2 TRP A 188 10.531 5.156 9.542 1.00 0.83 C ATOM 0 H TRP A 188 6.868 2.252 15.376 1.00 0.31 H new ATOM 0 HA TRP A 188 8.576 4.489 15.420 1.00 0.31 H new ATOM 0 HB2 TRP A 188 9.290 2.186 14.873 1.00 0.33 H new ATOM 0 HB3 TRP A 188 8.292 2.196 13.433 1.00 0.33 H new ATOM 0 HD1 TRP A 188 11.709 3.193 14.662 1.00 0.37 H new ATOM 0 HE1 TRP A 188 13.074 4.317 12.775 1.00 0.48 H new ATOM 0 HE3 TRP A 188 7.930 3.821 11.282 1.00 0.63 H new ATOM 0 HZ2 TRP A 188 12.558 5.323 10.198 1.00 0.72 H new ATOM 0 HZ3 TRP A 188 8.445 4.878 9.118 1.00 0.79 H new ATOM 0 HH2 TRP A 188 10.729 5.615 8.585 1.00 0.83 H new ATOM 2302 N ILE A 189 6.399 4.398 12.955 1.00 0.36 N ATOM 2303 CA ILE A 189 5.803 5.193 11.885 1.00 0.41 C ATOM 2304 C ILE A 189 5.627 6.647 12.307 1.00 0.42 C ATOM 2305 O ILE A 189 6.159 7.555 11.669 1.00 0.46 O ATOM 2306 CB ILE A 189 4.437 4.627 11.451 1.00 0.48 C ATOM 2307 CG1 ILE A 189 4.628 3.456 10.485 1.00 0.60 C ATOM 2308 CG2 ILE A 189 3.594 5.719 10.809 1.00 0.43 C ATOM 2309 CD1 ILE A 189 3.335 2.770 10.102 1.00 0.57 C ATOM 0 H ILE A 189 5.932 3.508 13.129 1.00 0.36 H new ATOM 0 HA ILE A 189 6.491 5.144 11.041 1.00 0.41 H new ATOM 0 HB ILE A 189 3.914 4.261 12.334 1.00 0.48 H new ATOM 0 HG12 ILE A 189 5.119 3.817 9.582 1.00 0.60 H new ATOM 0 HG13 ILE A 189 5.296 2.725 10.941 1.00 0.60 H new ATOM 0 HG21 ILE A 189 2.632 5.306 10.507 1.00 0.43 H new ATOM 0 HG22 ILE A 189 3.434 6.524 11.526 1.00 0.43 H new ATOM 0 HG23 ILE A 189 4.111 6.111 9.933 1.00 0.43 H new ATOM 0 HD11 ILE A 189 3.547 1.950 9.416 1.00 0.57 H new ATOM 0 HD12 ILE A 189 2.852 2.378 10.997 1.00 0.57 H new ATOM 0 HD13 ILE A 189 2.673 3.487 9.617 1.00 0.57 H new ATOM 2321 N GLN A 190 4.880 6.862 13.384 1.00 0.48 N ATOM 2322 CA GLN A 190 4.638 8.210 13.888 1.00 0.54 C ATOM 2323 C GLN A 190 5.921 8.831 14.433 1.00 0.46 C ATOM 2324 O GLN A 190 6.094 10.050 14.399 1.00 0.50 O ATOM 2325 CB GLN A 190 3.566 8.182 14.980 1.00 0.68 C ATOM 2326 CG GLN A 190 2.155 8.020 14.441 1.00 1.12 C ATOM 2327 CD GLN A 190 1.109 8.639 15.348 1.00 1.73 C ATOM 2328 OE1 GLN A 190 1.069 9.857 15.527 1.00 2.42 O ATOM 2329 NE2 GLN A 190 0.256 7.802 15.926 1.00 2.21 N ATOM 0 H GLN A 190 4.432 6.122 13.925 1.00 0.48 H new ATOM 0 HA GLN A 190 4.287 8.823 13.057 1.00 0.54 H new ATOM 0 HB2 GLN A 190 3.780 7.363 15.667 1.00 0.68 H new ATOM 0 HB3 GLN A 190 3.622 9.105 15.557 1.00 0.68 H new ATOM 0 HG2 GLN A 190 2.092 8.479 13.454 1.00 1.12 H new ATOM 0 HG3 GLN A 190 1.938 6.959 14.314 1.00 1.12 H new ATOM 0 HE21 GLN A 190 0.326 6.800 15.749 1.00 2.21 H new ATOM 0 HE22 GLN A 190 -0.469 8.161 16.547 1.00 2.21 H new ATOM 2338 N ASP A 191 6.817 7.988 14.936 1.00 0.44 N ATOM 2339 CA ASP A 191 8.083 8.456 15.489 1.00 0.45 C ATOM 2340 C ASP A 191 8.952 9.098 14.411 1.00 0.42 C ATOM 2341 O ASP A 191 9.527 10.166 14.619 1.00 0.90 O ATOM 2342 CB ASP A 191 8.836 7.296 16.142 1.00 0.66 C ATOM 2343 CG ASP A 191 9.716 7.751 17.290 1.00 1.27 C ATOM 2344 OD1 ASP A 191 10.844 8.217 17.025 1.00 1.96 O ATOM 2345 OD2 ASP A 191 9.276 7.641 18.454 1.00 1.95 O ATOM 0 H ASP A 191 6.690 6.977 14.972 1.00 0.44 H new ATOM 0 HA ASP A 191 7.861 9.211 16.243 1.00 0.45 H new ATOM 0 HB2 ASP A 191 8.119 6.561 16.507 1.00 0.66 H new ATOM 0 HB3 ASP A 191 9.450 6.797 15.392 1.00 0.66 H new ATOM 2350 N ASN A 192 9.048 8.437 13.262 1.00 0.56 N ATOM 2351 CA ASN A 192 9.852 8.943 12.155 1.00 0.53 C ATOM 2352 C ASN A 192 9.187 10.139 11.471 1.00 0.53 C ATOM 2353 O ASN A 192 9.844 10.889 10.749 1.00 0.84 O ATOM 2354 CB ASN A 192 10.104 7.835 11.131 1.00 0.60 C ATOM 2355 CG ASN A 192 11.441 7.992 10.432 1.00 0.93 C ATOM 2356 OD1 ASN A 192 11.509 8.466 9.298 1.00 1.86 O ATOM 2357 ND2 ASN A 192 12.513 7.595 11.108 1.00 1.04 N ATOM 0 H ASN A 192 8.580 7.551 13.073 1.00 0.56 H new ATOM 0 HA ASN A 192 10.803 9.278 12.569 1.00 0.53 H new ATOM 0 HB2 ASN A 192 10.069 6.867 11.630 1.00 0.60 H new ATOM 0 HB3 ASN A 192 9.306 7.840 10.389 1.00 0.60 H new ATOM 0 HD21 ASN A 192 13.439 7.677 10.689 1.00 1.04 H new ATOM 0 HD22 ASN A 192 12.410 7.208 12.046 1.00 1.04 H new ATOM 2364 N GLY A 193 7.886 10.321 11.698 1.00 0.53 N ATOM 2365 CA GLY A 193 7.184 11.436 11.087 1.00 0.56 C ATOM 2366 C GLY A 193 5.857 11.045 10.454 1.00 0.59 C ATOM 2367 O GLY A 193 5.134 11.907 9.954 1.00 1.14 O ATOM 0 H GLY A 193 7.311 9.721 12.289 1.00 0.53 H new ATOM 0 HA2 GLY A 193 7.005 12.201 11.843 1.00 0.56 H new ATOM 0 HA3 GLY A 193 7.823 11.884 10.326 1.00 0.56 H new ATOM 2371 N GLY A 194 5.524 9.755 10.474 1.00 0.37 N ATOM 2372 CA GLY A 194 4.271 9.308 9.895 1.00 0.32 C ATOM 2373 C GLY A 194 4.303 9.250 8.379 1.00 0.27 C ATOM 2374 O GLY A 194 5.308 9.595 7.753 1.00 0.27 O ATOM 0 H GLY A 194 6.098 9.016 10.880 1.00 0.37 H new ATOM 0 HA2 GLY A 194 4.029 8.319 10.285 1.00 0.32 H new ATOM 0 HA3 GLY A 194 3.472 9.979 10.210 1.00 0.32 H new ATOM 2378 N TRP A 195 3.196 8.808 7.791 1.00 0.28 N ATOM 2379 CA TRP A 195 3.091 8.701 6.340 1.00 0.28 C ATOM 2380 C TRP A 195 3.585 9.980 5.673 1.00 0.29 C ATOM 2381 O TRP A 195 4.348 9.932 4.708 1.00 0.28 O ATOM 2382 CB TRP A 195 1.647 8.408 5.930 1.00 0.31 C ATOM 2383 CG TRP A 195 1.236 6.993 6.200 1.00 0.30 C ATOM 2384 CD1 TRP A 195 0.216 6.574 7.004 1.00 0.32 C ATOM 2385 CD2 TRP A 195 1.842 5.808 5.668 1.00 0.34 C ATOM 2386 NE1 TRP A 195 0.150 5.201 7.005 1.00 0.35 N ATOM 2387 CE2 TRP A 195 1.137 4.708 6.193 1.00 0.36 C ATOM 2388 CE3 TRP A 195 2.910 5.569 4.799 1.00 0.40 C ATOM 2389 CZ2 TRP A 195 1.468 3.392 5.878 1.00 0.43 C ATOM 2390 CZ3 TRP A 195 3.236 4.262 4.487 1.00 0.47 C ATOM 2391 CH2 TRP A 195 2.517 3.188 5.025 1.00 0.47 C ATOM 0 H TRP A 195 2.359 8.518 8.297 1.00 0.28 H new ATOM 0 HA TRP A 195 3.720 7.875 6.008 1.00 0.28 H new ATOM 0 HB2 TRP A 195 0.979 9.083 6.466 1.00 0.31 H new ATOM 0 HB3 TRP A 195 1.527 8.619 4.867 1.00 0.31 H new ATOM 0 HD1 TRP A 195 -0.443 7.226 7.558 1.00 0.32 H new ATOM 0 HE1 TRP A 195 -0.524 4.640 7.526 1.00 0.35 H new ATOM 0 HE3 TRP A 195 3.471 6.391 4.379 1.00 0.40 H new ATOM 0 HZ2 TRP A 195 0.915 2.562 6.293 1.00 0.43 H new ATOM 0 HZ3 TRP A 195 4.060 4.066 3.817 1.00 0.47 H new ATOM 0 HH2 TRP A 195 2.796 2.179 4.761 1.00 0.47 H new ATOM 2402 N ASP A 196 3.154 11.124 6.201 1.00 0.32 N ATOM 2403 CA ASP A 196 3.566 12.415 5.662 1.00 0.36 C ATOM 2404 C ASP A 196 5.079 12.457 5.480 1.00 0.34 C ATOM 2405 O ASP A 196 5.589 13.088 4.553 1.00 0.35 O ATOM 2406 CB ASP A 196 3.119 13.547 6.590 1.00 0.41 C ATOM 2407 CG ASP A 196 2.635 14.764 5.826 1.00 1.30 C ATOM 2408 OD1 ASP A 196 2.134 14.595 4.694 1.00 1.85 O ATOM 2409 OD2 ASP A 196 2.756 15.887 6.360 1.00 2.16 O ATOM 0 H ASP A 196 2.522 11.182 6.999 1.00 0.32 H new ATOM 0 HA ASP A 196 3.092 12.549 4.690 1.00 0.36 H new ATOM 0 HB2 ASP A 196 2.320 13.187 7.239 1.00 0.41 H new ATOM 0 HB3 ASP A 196 3.949 13.833 7.236 1.00 0.41 H new ATOM 2414 N ALA A 197 5.792 11.763 6.364 1.00 0.32 N ATOM 2415 CA ALA A 197 7.246 11.704 6.292 1.00 0.32 C ATOM 2416 C ALA A 197 7.676 10.809 5.141 1.00 0.29 C ATOM 2417 O ALA A 197 8.629 11.113 4.424 1.00 0.31 O ATOM 2418 CB ALA A 197 7.828 11.198 7.602 1.00 0.31 C ATOM 0 H ALA A 197 5.386 11.235 7.136 1.00 0.32 H new ATOM 0 HA ALA A 197 7.626 12.711 6.116 1.00 0.32 H new ATOM 0 HB1 ALA A 197 8.915 11.161 7.527 1.00 0.31 H new ATOM 0 HB2 ALA A 197 7.542 11.870 8.411 1.00 0.31 H new ATOM 0 HB3 ALA A 197 7.445 10.199 7.809 1.00 0.31 H new ATOM 2424 N PHE A 198 6.953 9.709 4.963 1.00 0.27 N ATOM 2425 CA PHE A 198 7.246 8.772 3.887 1.00 0.30 C ATOM 2426 C PHE A 198 7.059 9.446 2.535 1.00 0.36 C ATOM 2427 O PHE A 198 8.003 9.576 1.755 1.00 0.57 O ATOM 2428 CB PHE A 198 6.337 7.546 3.986 1.00 0.34 C ATOM 2429 CG PHE A 198 6.992 6.269 3.541 1.00 0.42 C ATOM 2430 CD1 PHE A 198 8.109 6.292 2.721 1.00 1.10 C ATOM 2431 CD2 PHE A 198 6.489 5.044 3.946 1.00 1.22 C ATOM 2432 CE1 PHE A 198 8.712 5.117 2.314 1.00 1.16 C ATOM 2433 CE2 PHE A 198 7.087 3.865 3.542 1.00 1.28 C ATOM 2434 CZ PHE A 198 8.200 3.902 2.725 1.00 0.67 C ATOM 0 H PHE A 198 6.161 9.445 5.549 1.00 0.27 H new ATOM 0 HA PHE A 198 8.283 8.451 3.983 1.00 0.30 H new ATOM 0 HB2 PHE A 198 6.006 7.433 5.018 1.00 0.34 H new ATOM 0 HB3 PHE A 198 5.446 7.716 3.382 1.00 0.34 H new ATOM 0 HD1 PHE A 198 8.513 7.239 2.396 1.00 1.10 H new ATOM 0 HD2 PHE A 198 5.619 5.009 4.585 1.00 1.22 H new ATOM 0 HE1 PHE A 198 9.582 5.149 1.675 1.00 1.16 H new ATOM 0 HE2 PHE A 198 6.684 2.916 3.865 1.00 1.28 H new ATOM 0 HZ PHE A 198 8.669 2.982 2.408 1.00 0.67 H new ATOM 2444 N VAL A 199 5.830 9.873 2.268 1.00 0.35 N ATOM 2445 CA VAL A 199 5.504 10.539 1.011 1.00 0.40 C ATOM 2446 C VAL A 199 6.529 11.612 0.662 1.00 0.40 C ATOM 2447 O VAL A 199 7.032 11.651 -0.454 1.00 0.44 O ATOM 2448 CB VAL A 199 4.099 11.183 1.037 1.00 0.47 C ATOM 2449 CG1 VAL A 199 3.745 11.695 2.427 1.00 0.66 C ATOM 2450 CG2 VAL A 199 4.018 12.308 0.019 1.00 0.87 C ATOM 0 H VAL A 199 5.041 9.770 2.906 1.00 0.35 H new ATOM 0 HA VAL A 199 5.519 9.760 0.249 1.00 0.40 H new ATOM 0 HB VAL A 199 3.373 10.414 0.774 1.00 0.47 H new ATOM 0 HG11 VAL A 199 2.751 12.141 2.408 1.00 0.66 H new ATOM 0 HG12 VAL A 199 3.757 10.866 3.134 1.00 0.66 H new ATOM 0 HG13 VAL A 199 4.474 12.445 2.735 1.00 0.66 H new ATOM 0 HG21 VAL A 199 3.024 12.753 0.047 1.00 0.87 H new ATOM 0 HG22 VAL A 199 4.763 13.068 0.256 1.00 0.87 H new ATOM 0 HG23 VAL A 199 4.210 11.911 -0.978 1.00 0.87 H new ATOM 2460 N GLU A 200 6.828 12.487 1.615 1.00 0.41 N ATOM 2461 CA GLU A 200 7.789 13.560 1.385 1.00 0.45 C ATOM 2462 C GLU A 200 9.190 13.007 1.133 1.00 0.41 C ATOM 2463 O GLU A 200 9.945 13.546 0.324 1.00 0.43 O ATOM 2464 CB GLU A 200 7.814 14.511 2.582 1.00 0.48 C ATOM 2465 CG GLU A 200 8.607 15.784 2.334 1.00 1.32 C ATOM 2466 CD GLU A 200 8.308 16.865 3.354 1.00 1.68 C ATOM 2467 OE1 GLU A 200 8.638 16.667 4.542 1.00 2.23 O ATOM 2468 OE2 GLU A 200 7.744 17.909 2.965 1.00 2.21 O ATOM 0 H GLU A 200 6.421 12.475 2.550 1.00 0.41 H new ATOM 0 HA GLU A 200 7.474 14.106 0.496 1.00 0.45 H new ATOM 0 HB2 GLU A 200 6.790 14.777 2.845 1.00 0.48 H new ATOM 0 HB3 GLU A 200 8.239 13.990 3.440 1.00 0.48 H new ATOM 0 HG2 GLU A 200 9.672 15.554 2.355 1.00 1.32 H new ATOM 0 HG3 GLU A 200 8.382 16.159 1.336 1.00 1.32 H new ATOM 2475 N LEU A 201 9.537 11.940 1.844 1.00 0.37 N ATOM 2476 CA LEU A 201 10.854 11.324 1.715 1.00 0.36 C ATOM 2477 C LEU A 201 11.097 10.762 0.314 1.00 0.38 C ATOM 2478 O LEU A 201 12.061 11.140 -0.351 1.00 0.44 O ATOM 2479 CB LEU A 201 11.016 10.211 2.752 1.00 0.37 C ATOM 2480 CG LEU A 201 11.887 10.569 3.957 1.00 0.41 C ATOM 2481 CD1 LEU A 201 11.127 10.335 5.254 1.00 0.93 C ATOM 2482 CD2 LEU A 201 13.177 9.763 3.940 1.00 0.91 C ATOM 0 H LEU A 201 8.923 11.482 2.518 1.00 0.37 H new ATOM 0 HA LEU A 201 11.594 12.105 1.889 1.00 0.36 H new ATOM 0 HB2 LEU A 201 10.028 9.923 3.110 1.00 0.37 H new ATOM 0 HB3 LEU A 201 11.444 9.337 2.261 1.00 0.37 H new ATOM 0 HG LEU A 201 12.142 11.627 3.895 1.00 0.41 H new ATOM 0 HD11 LEU A 201 11.763 10.595 6.100 1.00 0.93 H new ATOM 0 HD12 LEU A 201 10.232 10.956 5.268 1.00 0.93 H new ATOM 0 HD13 LEU A 201 10.841 9.285 5.324 1.00 0.93 H new ATOM 0 HD21 LEU A 201 13.785 10.031 4.805 1.00 0.91 H new ATOM 0 HD22 LEU A 201 12.942 8.699 3.977 1.00 0.91 H new ATOM 0 HD23 LEU A 201 13.730 9.981 3.026 1.00 0.91 H new ATOM 2494 N TYR A 202 10.239 9.844 -0.122 1.00 0.37 N ATOM 2495 CA TYR A 202 10.396 9.223 -1.437 1.00 0.43 C ATOM 2496 C TYR A 202 9.468 9.833 -2.492 1.00 0.49 C ATOM 2497 O TYR A 202 9.352 9.300 -3.596 1.00 0.50 O ATOM 2498 CB TYR A 202 10.138 7.718 -1.338 1.00 0.48 C ATOM 2499 CG TYR A 202 11.022 7.016 -0.332 1.00 0.39 C ATOM 2500 CD1 TYR A 202 10.855 7.224 1.032 1.00 1.05 C ATOM 2501 CD2 TYR A 202 12.020 6.143 -0.745 1.00 1.03 C ATOM 2502 CE1 TYR A 202 11.659 6.582 1.955 1.00 1.04 C ATOM 2503 CE2 TYR A 202 12.828 5.497 0.171 1.00 1.05 C ATOM 2504 CZ TYR A 202 12.644 5.720 1.520 1.00 0.41 C ATOM 2505 OH TYR A 202 13.446 5.079 2.435 1.00 0.51 O ATOM 0 H TYR A 202 9.433 9.514 0.410 1.00 0.37 H new ATOM 0 HA TYR A 202 11.421 9.410 -1.757 1.00 0.43 H new ATOM 0 HB2 TYR A 202 9.095 7.554 -1.069 1.00 0.48 H new ATOM 0 HB3 TYR A 202 10.289 7.267 -2.319 1.00 0.48 H new ATOM 0 HD1 TYR A 202 10.085 7.898 1.376 1.00 1.05 H new ATOM 0 HD2 TYR A 202 12.167 5.966 -1.800 1.00 1.03 H new ATOM 0 HE1 TYR A 202 11.517 6.754 3.012 1.00 1.04 H new ATOM 0 HE2 TYR A 202 13.599 4.821 -0.167 1.00 1.05 H new ATOM 0 HH TYR A 202 14.087 4.507 1.964 1.00 0.51 H new ATOM 2515 N GLY A 203 8.807 10.938 -2.163 1.00 0.56 N ATOM 2516 CA GLY A 203 7.907 11.565 -3.115 1.00 0.67 C ATOM 2517 C GLY A 203 8.642 12.376 -4.167 1.00 0.71 C ATOM 2518 O GLY A 203 9.708 12.926 -3.893 1.00 0.89 O ATOM 0 H GLY A 203 8.877 11.408 -1.261 1.00 0.56 H new ATOM 0 HA2 GLY A 203 7.310 10.796 -3.606 1.00 0.67 H new ATOM 0 HA3 GLY A 203 7.213 12.214 -2.580 1.00 0.67 H new ATOM 2522 N PRO A 204 8.090 12.470 -5.389 1.00 0.75 N ATOM 2523 CA PRO A 204 8.710 13.231 -6.481 1.00 1.05 C ATOM 2524 C PRO A 204 8.928 14.696 -6.113 1.00 1.46 C ATOM 2525 O PRO A 204 8.969 15.052 -4.936 1.00 2.11 O ATOM 2526 CB PRO A 204 7.698 13.120 -7.626 1.00 1.14 C ATOM 2527 CG PRO A 204 6.874 11.922 -7.303 1.00 0.83 C ATOM 2528 CD PRO A 204 6.822 11.845 -5.804 1.00 0.71 C ATOM 0 HA PRO A 204 9.698 12.843 -6.731 1.00 1.05 H new ATOM 0 HB2 PRO A 204 7.081 14.016 -7.694 1.00 1.14 H new ATOM 0 HB3 PRO A 204 8.201 13.005 -8.586 1.00 1.14 H new ATOM 0 HG2 PRO A 204 5.873 12.013 -7.724 1.00 0.83 H new ATOM 0 HG3 PRO A 204 7.316 11.019 -7.725 1.00 0.83 H new ATOM 0 HD2 PRO A 204 5.960 12.379 -5.403 1.00 0.71 H new ATOM 0 HD3 PRO A 204 6.749 10.815 -5.456 1.00 0.71 H new ATOM 2536 N SER A 205 9.063 15.541 -7.129 1.00 1.82 N ATOM 2537 CA SER A 205 9.274 16.968 -6.913 1.00 2.25 C ATOM 2538 C SER A 205 8.131 17.783 -7.511 1.00 2.38 C ATOM 2539 O SER A 205 8.260 18.347 -8.597 1.00 2.68 O ATOM 2540 CB SER A 205 10.604 17.407 -7.527 1.00 2.82 C ATOM 2541 OG SER A 205 11.677 17.193 -6.626 1.00 3.57 O ATOM 0 H SER A 205 9.030 15.263 -8.110 1.00 1.82 H new ATOM 0 HA SER A 205 9.301 17.147 -5.838 1.00 2.25 H new ATOM 0 HB2 SER A 205 10.783 16.853 -8.449 1.00 2.82 H new ATOM 0 HB3 SER A 205 10.554 18.463 -7.794 1.00 2.82 H new ATOM 0 HG SER A 205 12.516 17.480 -7.043 1.00 3.57 H new ATOM 2547 N MET A 206 7.013 17.838 -6.795 1.00 2.76 N ATOM 2548 CA MET A 206 5.846 18.584 -7.255 1.00 3.29 C ATOM 2549 C MET A 206 5.211 17.908 -8.465 1.00 3.54 C ATOM 2550 O MET A 206 5.024 18.532 -9.510 1.00 4.25 O ATOM 2551 CB MET A 206 6.238 20.021 -7.605 1.00 4.29 C ATOM 2552 CG MET A 206 7.129 20.679 -6.565 1.00 4.97 C ATOM 2553 SD MET A 206 6.815 22.447 -6.401 1.00 6.23 S ATOM 2554 CE MET A 206 8.359 23.123 -7.009 1.00 6.74 C ATOM 0 H MET A 206 6.890 17.375 -5.894 1.00 2.76 H new ATOM 0 HA MET A 206 5.115 18.602 -6.447 1.00 3.29 H new ATOM 0 HB2 MET A 206 6.752 20.025 -8.566 1.00 4.29 H new ATOM 0 HB3 MET A 206 5.333 20.617 -7.725 1.00 4.29 H new ATOM 0 HG2 MET A 206 6.974 20.195 -5.601 1.00 4.97 H new ATOM 0 HG3 MET A 206 8.173 20.523 -6.836 1.00 4.97 H new ATOM 0 HE1 MET A 206 8.320 24.212 -6.970 1.00 6.74 H new ATOM 0 HE2 MET A 206 9.181 22.767 -6.388 1.00 6.74 H new ATOM 0 HE3 MET A 206 8.516 22.802 -8.039 1.00 6.74 H new ATOM 2564 N ARG A 207 4.882 16.629 -8.318 1.00 3.35 N ATOM 2565 CA ARG A 207 4.267 15.868 -9.399 1.00 4.05 C ATOM 2566 C ARG A 207 3.271 14.852 -8.852 1.00 4.49 C ATOM 2567 O ARG A 207 2.794 15.045 -7.713 1.00 4.94 O ATOM 2568 CB ARG A 207 5.341 15.155 -10.222 1.00 4.46 C ATOM 2569 CG ARG A 207 5.190 15.354 -11.722 1.00 5.13 C ATOM 2570 CD ARG A 207 5.417 16.804 -12.116 1.00 5.75 C ATOM 2571 NE ARG A 207 5.036 17.060 -13.503 1.00 6.27 N ATOM 2572 CZ ARG A 207 5.798 16.755 -14.552 1.00 6.82 C ATOM 2573 NH1 ARG A 207 6.984 16.181 -14.381 1.00 6.96 N ATOM 2574 NH2 ARG A 207 5.372 17.024 -15.779 1.00 7.51 N ATOM 2575 OXT ARG A 207 2.974 13.871 -9.566 1.00 4.76 O ATOM 0 H ARG A 207 5.031 16.098 -7.460 1.00 3.35 H new ATOM 0 HA ARG A 207 3.729 16.566 -10.041 1.00 4.05 H new ATOM 0 HB2 ARG A 207 6.322 15.515 -9.913 1.00 4.46 H new ATOM 0 HB3 ARG A 207 5.308 14.088 -10.000 1.00 4.46 H new ATOM 0 HG2 ARG A 207 5.901 14.717 -12.248 1.00 5.13 H new ATOM 0 HG3 ARG A 207 4.193 15.043 -12.033 1.00 5.13 H new ATOM 0 HD2 ARG A 207 4.842 17.453 -11.456 1.00 5.75 H new ATOM 0 HD3 ARG A 207 6.468 17.058 -11.976 1.00 5.75 H new ATOM 0 HE ARG A 207 4.132 17.499 -13.679 1.00 6.27 H new ATOM 0 HH11 ARG A 207 7.318 15.970 -13.440 1.00 6.96 H new ATOM 0 HH12 ARG A 207 7.561 15.951 -15.190 1.00 6.96 H new ATOM 0 HH21 ARG A 207 4.462 17.464 -15.918 1.00 7.51 H new ATOM 0 HH22 ARG A 207 5.954 16.791 -16.583 1.00 7.51 H new TER 2589 ARG A 207 END