USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1150 hydrogens (0 hets) HEADER DNA BINDING PROTEIN 20-JUL-05 2ADN TITLE SOLUTION STRUCTURE OF THE BACTERIAL ANTITOXIN CCDA: TITLE 2 IMPLICATIONS FOR DNA AND TOXIN BINDING COMPND MOL_ID: 1; COMPND 2 MOLECULE: CCDA; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: CCDA CONFORMER B, LETA CONFORMER B; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 562; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: SG22622; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PKK-/CCDAR70K/ KEYWDS RIBBON-HELIX-HELIX, DNA BINDING PROTEIN EXPDTA SOLUTION NMR AUTHOR T.MADL,L.VANMELDEREN,M.OBERER,W.KELLER,L.KHATAI,K.ZANGGER REVDAT 3 24-FEB-09 2ADN 1 VERSN REVDAT 2 10-APR-07 2ADN 1 JRNL REVDAT 1 22-AUG-06 2ADN 0 JRNL AUTH T.MADL,L.VAN MELDEREN,N.MINE,M.RESPONDEK,M.OBERER, JRNL AUTH 2 W.KELLER,L.KHATAI,K.ZANGGER JRNL TITL STRUCTURAL BASIS FOR NUCLEIC ACID AND TOXIN JRNL TITL 2 RECOGNITION OF THE BACTERIAL ANTITOXIN CCDA JRNL REF J.MOL.BIOL. V. 364 170 2006 JRNL REFN ISSN 0022-2836 JRNL PMID 17007877 JRNL DOI 10.1016/J.JMB.2006.08.082 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU,READ, REMARK 3 RICE,SIMONSON,WARREN REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2ADN COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 22-JUL-05. REMARK 100 THE RCSB ID CODE IS RCSB033770. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 0.5MM CCDA U-15N,13C; 20MM REMARK 210 PHOSPHATE BUFFER; 0.5MM CCDA U REMARK 210 -15N,13C; 20MM PHOSPHATE BUFFER REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 3D_ REMARK 210 15N-SEPARATED_NOESY, HNHA, 2D REMARK 210 NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : CNS 1.1, NMRPIPE, VNMR, REMARK 210 NMRVIEW REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 200 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 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 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O MET B 132 N ALA B 136 2.14 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 THR A 8 94.84 -65.82 REMARK 500 VAL A 9 -120.73 -84.32 REMARK 500 ASP A 10 -32.74 75.27 REMARK 500 ASP A 21 62.78 168.25 REMARK 500 VAL A 22 69.62 -59.67 REMARK 500 ARG A 40 44.79 -167.30 REMARK 500 ALA A 41 -73.82 66.90 REMARK 500 LYS A 45 -74.75 -169.60 REMARK 500 VAL A 46 -69.70 67.01 REMARK 500 GLU A 47 111.11 -160.54 REMARK 500 GLN A 49 109.24 -179.34 REMARK 500 MET A 52 -77.15 63.76 REMARK 500 GLU A 54 -89.81 -131.42 REMARK 500 VAL A 55 25.62 -157.09 REMARK 500 ALA A 56 -71.84 -172.19 REMARK 500 ARG A 57 124.70 157.95 REMARK 500 PHE A 58 -99.46 -133.90 REMARK 500 ILE A 59 159.25 58.96 REMARK 500 ALA A 66 -108.60 -71.62 REMARK 500 ASP A 67 40.12 173.61 REMARK 500 LYS A 70 179.41 61.68 REMARK 500 THR B 108 91.25 -55.84 REMARK 500 VAL B 109 -108.79 -82.40 REMARK 500 ASP B 110 -41.44 73.44 REMARK 500 ASP B 121 62.37 169.78 REMARK 500 VAL B 122 69.43 -63.24 REMARK 500 ILE B 124 -33.71 -132.72 REMARK 500 LEU B 139 68.60 29.64 REMARK 500 ARG B 140 55.82 -151.33 REMARK 500 ALA B 141 -165.99 -56.64 REMARK 500 TRP B 144 79.29 -169.87 REMARK 500 GLU B 147 -72.97 -98.85 REMARK 500 MET B 152 93.31 -172.11 REMARK 500 GLU B 154 -95.81 -136.25 REMARK 500 VAL B 155 94.97 142.84 REMARK 500 ALA B 156 -65.84 -172.91 REMARK 500 ARG B 157 133.00 -177.18 REMARK 500 PHE B 158 71.30 -163.49 REMARK 500 SER B 164 -59.88 -168.71 REMARK 500 ALA B 166 -72.09 66.42 REMARK 500 ASP B 167 -40.48 -179.76 REMARK 500 GLU B 168 37.58 -147.68 REMARK 500 ASP B 171 -68.34 -133.86 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2ADL RELATED DB: PDB REMARK 900 CCDA CONFORMER A DBREF 2ADN A 1 72 UNP Q9S0Z5 Q9S0Z5_ECOLI 1 72 DBREF 2ADN B 101 172 UNP Q9S0Z5 Q9S0Z5_ECOLI 1 72 SEQADV 2ADN LYS A 70 UNP Q9S0Z5 ARG 70 ENGINEERED SEQADV 2ADN LYS B 170 UNP Q9S0Z5 ARG 70 ENGINEERED SEQRES 1 A 72 MET LYS GLN ARG ILE THR VAL THR VAL ASP SER ASP SER SEQRES 2 A 72 TYR GLN LEU LEU LYS ALA TYR ASP VAL ASN ILE SER GLY SEQRES 3 A 72 LEU VAL SER THR THR MET GLN ASN GLU ALA ARG ARG LEU SEQRES 4 A 72 ARG ALA GLU ARG TRP LYS VAL GLU ASN GLN GLU GLY MET SEQRES 5 A 72 VAL GLU VAL ALA ARG PHE ILE GLU MET ASN GLY SER PHE SEQRES 6 A 72 ALA ASP GLU ASN LYS ASP TRP SEQRES 1 B 72 MET LYS GLN ARG ILE THR VAL THR VAL ASP SER ASP SER SEQRES 2 B 72 TYR GLN LEU LEU LYS ALA TYR ASP VAL ASN ILE SER GLY SEQRES 3 B 72 LEU VAL SER THR THR MET GLN ASN GLU ALA ARG ARG LEU SEQRES 4 B 72 ARG ALA GLU ARG TRP LYS VAL GLU ASN GLN GLU GLY MET SEQRES 5 B 72 VAL GLU VAL ALA ARG PHE ILE GLU MET ASN GLY SER PHE SEQRES 6 B 72 ALA ASP GLU ASN LYS ASP TRP HELIX 1 1 SER A 13 TYR A 20 1 8 HELIX 2 2 ILE A 24 ARG A 38 1 15 HELIX 3 3 SER B 113 ALA B 119 1 7 HELIX 4 4 ILE B 124 ARG B 138 1 15 SHEET 1 A 2 ARG A 4 VAL A 9 0 SHEET 2 A 2 GLN B 103 THR B 108 -1 O VAL B 107 N ILE A 5 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 15 GLN : amide:sc= -8.36! C(o=-8.3!,f=-17!) USER MOD Set 1.2: A 18 LYS NZ :NH3+ 138:sc= 0.931 (180deg=0) USER MOD Set 1.3: B 103 GLN : amide:sc= -0.875 K(o=-8.3,f=-19!) USER MOD Set 2.1: A 31 THR OG1 : rot -140:sc= -0.0289 USER MOD Set 2.2: B 131 THR OG1 : rot 180:sc= -0.183 USER MOD Single : A 1 MET CE :methyl -152:sc= -0.382 (180deg=-1.44!) USER MOD Single : A 1 MET N :NH3+ 149:sc= 0.00888 (180deg=-0.209) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -0.1 K(o=-0.1,f=-1.4!) USER MOD Single : A 6 THR OG1 : rot 43:sc= -2.35! USER MOD Single : A 8 THR OG1 : rot 180:sc= 0.0694 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 90:sc= -2.22 USER MOD Single : A 14 TYR OH : rot 165:sc= -1.08 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.0686 K(o=-0.069,f=-1.7!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 150:sc= -0.835 USER MOD Single : A 30 THR OG1 : rot 68:sc= 0.479 USER MOD Single : A 32 MET CE :methyl -159:sc= -8.28! (180deg=-11!) USER MOD Single : A 33 GLN : amide:sc= -0.466 X(o=-0.47,f=-0.0043) USER MOD Single : A 34 ASN : amide:sc= 0.881 K(o=0.88,f=-8.1!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.277 X(o=-0.28,f=-0.018) USER MOD Single : A 49 GLN : amide:sc= -0.199 K(o=-0.2,f=-1.5!) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 SER OG : rot 28:sc= 0.00672 USER MOD Single : A 69 ASN : amide:sc= 0.104 K(o=0.1,f=-6.7!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 MET CE :methyl 178:sc= 0 (180deg=-0.00529) USER MOD Single : B 102 LYS NZ :NH3+ -115:sc= 0 (180deg=-1.11) USER MOD Single : B 106 THR OG1 : rot -90:sc= -2.38 USER MOD Single : B 108 THR OG1 : rot 130:sc= -0.738 USER MOD Single : B 111 SER OG : rot 180:sc= 0 USER MOD Single : B 113 SER OG : rot 98:sc= 0.498 USER MOD Single : B 114 TYR OH : rot 150:sc= -0.775 USER MOD Single : B 115 GLN : amide:sc= -7.05! C(o=-7!,f=-12!) USER MOD Single : B 118 LYS NZ :NH3+ 161:sc= -0.718 (180deg=-1.69!) USER MOD Single : B 120 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : B 125 SER OG : rot 180:sc= -0.543 USER MOD Single : B 129 SER OG : rot 15:sc= 0.658 USER MOD Single : B 130 THR OG1 : rot 69:sc= 0.0324 USER MOD Single : B 132 MET CE :methyl -145:sc= -6.76! (180deg=-9.87!) USER MOD Single : B 133 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 134 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 145 LYS NZ :NH3+ 152:sc= -0.0212 (180deg=-0.252) USER MOD Single : B 148 ASN : amide:sc= 0.245 K(o=0.24,f=-5.8!) USER MOD Single : B 149 GLN : amide:sc= -1.32 X(o=-1.3,f=-1.3) USER MOD Single : B 152 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 161 MET CE :methyl 146:sc= -1.82! (180deg=-2.23!) USER MOD Single : B 162 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 164 SER OG : rot 180:sc= 0 USER MOD Single : B 169 ASN : amide:sc= -0.626 K(o=-0.63,f=-2!) USER MOD Single : B 170 LYS NZ :NH3+ -134:sc= -1.19 (180deg=-3.45!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.708 -14.797 -11.679 1.00 0.00 N ATOM 2 CA MET A 1 8.749 -13.749 -11.515 1.00 0.00 C ATOM 3 C MET A 1 8.398 -12.794 -10.379 1.00 0.00 C ATOM 4 O MET A 1 7.409 -12.991 -9.673 1.00 0.00 O ATOM 5 CB MET A 1 8.878 -12.980 -12.832 1.00 0.00 C ATOM 6 CG MET A 1 7.549 -12.500 -13.390 1.00 0.00 C ATOM 7 SD MET A 1 7.749 -11.278 -14.700 1.00 0.00 S ATOM 8 CE MET A 1 8.638 -9.992 -13.828 1.00 0.00 C ATOM 0 H1 MET A 1 7.654 -15.079 -12.678 1.00 0.00 H new ATOM 0 H2 MET A 1 7.953 -15.624 -11.098 1.00 0.00 H new ATOM 0 H3 MET A 1 6.787 -14.422 -11.375 1.00 0.00 H new ATOM 0 HA MET A 1 9.697 -14.223 -11.262 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.530 -12.120 -12.678 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.363 -13.619 -13.570 1.00 0.00 H new ATOM 0 HG2 MET A 1 6.992 -13.353 -13.776 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.955 -12.069 -12.584 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.416 -9.025 -14.280 1.00 0.00 H new ATOM 0 HE2 MET A 1 8.331 -9.982 -12.782 1.00 0.00 H new ATOM 0 HE3 MET A 1 9.709 -10.184 -13.890 1.00 0.00 H new ATOM 20 N LYS A 2 9.216 -11.762 -10.207 1.00 0.00 N ATOM 21 CA LYS A 2 8.995 -10.776 -9.156 1.00 0.00 C ATOM 22 C LYS A 2 9.216 -9.362 -9.684 1.00 0.00 C ATOM 23 O LYS A 2 9.907 -9.168 -10.685 1.00 0.00 O ATOM 24 CB LYS A 2 9.934 -11.043 -7.980 1.00 0.00 C ATOM 25 CG LYS A 2 9.495 -12.201 -7.099 1.00 0.00 C ATOM 26 CD LYS A 2 10.645 -12.723 -6.250 1.00 0.00 C ATOM 27 CE LYS A 2 10.763 -14.238 -6.334 1.00 0.00 C ATOM 28 NZ LYS A 2 12.174 -14.675 -6.526 1.00 0.00 N ATOM 0 H LYS A 2 10.039 -11.586 -10.783 1.00 0.00 H new ATOM 0 HA LYS A 2 7.962 -10.862 -8.819 1.00 0.00 H new ATOM 0 HB2 LYS A 2 10.933 -11.248 -8.364 1.00 0.00 H new ATOM 0 HB3 LYS A 2 10.005 -10.142 -7.371 1.00 0.00 H new ATOM 0 HG2 LYS A 2 8.680 -11.878 -6.451 1.00 0.00 H new ATOM 0 HG3 LYS A 2 9.106 -13.007 -7.722 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.578 -12.266 -6.580 1.00 0.00 H new ATOM 0 HD3 LYS A 2 10.495 -12.426 -5.212 1.00 0.00 H new ATOM 0 HE2 LYS A 2 10.366 -14.684 -5.422 1.00 0.00 H new ATOM 0 HE3 LYS A 2 10.154 -14.604 -7.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 12.212 -15.713 -6.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 12.546 -14.270 -7.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 12.751 -14.347 -5.725 1.00 0.00 H new ATOM 42 N GLN A 3 8.637 -8.372 -9.007 1.00 0.00 N ATOM 43 CA GLN A 3 8.787 -6.987 -9.414 1.00 0.00 C ATOM 44 C GLN A 3 9.281 -6.167 -8.236 1.00 0.00 C ATOM 45 O GLN A 3 8.614 -6.096 -7.207 1.00 0.00 O ATOM 46 CB GLN A 3 7.447 -6.440 -9.918 1.00 0.00 C ATOM 47 CG GLN A 3 7.441 -4.939 -10.139 1.00 0.00 C ATOM 48 CD GLN A 3 7.993 -4.546 -11.495 1.00 0.00 C ATOM 49 OE1 GLN A 3 7.864 -5.287 -12.470 1.00 0.00 O ATOM 50 NE2 GLN A 3 8.613 -3.373 -11.564 1.00 0.00 N ATOM 0 H GLN A 3 8.062 -8.509 -8.176 1.00 0.00 H new ATOM 0 HA GLN A 3 9.513 -6.923 -10.224 1.00 0.00 H new ATOM 0 HB2 GLN A 3 7.192 -6.936 -10.854 1.00 0.00 H new ATOM 0 HB3 GLN A 3 6.668 -6.695 -9.199 1.00 0.00 H new ATOM 0 HG2 GLN A 3 6.421 -4.566 -10.044 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.030 -4.458 -9.358 1.00 0.00 H new ATOM 0 HE21 GLN A 3 8.697 -2.791 -10.731 1.00 0.00 H new ATOM 0 HE22 GLN A 3 9.005 -3.055 -12.450 1.00 0.00 H new ATOM 59 N ARG A 4 10.448 -5.553 -8.378 1.00 0.00 N ATOM 60 CA ARG A 4 10.995 -4.757 -7.293 1.00 0.00 C ATOM 61 C ARG A 4 10.480 -3.331 -7.333 1.00 0.00 C ATOM 62 O ARG A 4 11.001 -2.485 -8.061 1.00 0.00 O ATOM 63 CB ARG A 4 12.522 -4.751 -7.317 1.00 0.00 C ATOM 64 CG ARG A 4 13.138 -4.614 -5.932 1.00 0.00 C ATOM 65 CD ARG A 4 14.647 -4.795 -5.972 1.00 0.00 C ATOM 66 NE ARG A 4 15.213 -4.985 -4.637 1.00 0.00 N ATOM 67 CZ ARG A 4 16.494 -4.774 -4.337 1.00 0.00 C ATOM 68 NH1 ARG A 4 17.346 -4.372 -5.272 1.00 0.00 N ATOM 69 NH2 ARG A 4 16.924 -4.969 -3.098 1.00 0.00 N ATOM 0 H ARG A 4 11.024 -5.590 -9.219 1.00 0.00 H new ATOM 0 HA ARG A 4 10.661 -5.223 -6.366 1.00 0.00 H new ATOM 0 HB2 ARG A 4 12.876 -5.674 -7.777 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.867 -3.929 -7.945 1.00 0.00 H new ATOM 0 HG2 ARG A 4 12.899 -3.633 -5.522 1.00 0.00 H new ATOM 0 HG3 ARG A 4 12.699 -5.354 -5.263 1.00 0.00 H new ATOM 0 HD2 ARG A 4 14.892 -5.655 -6.595 1.00 0.00 H new ATOM 0 HD3 ARG A 4 15.104 -3.922 -6.439 1.00 0.00 H new ATOM 0 HE ARG A 4 14.591 -5.297 -3.892 1.00 0.00 H new ATOM 0 HH11 ARG A 4 17.022 -4.223 -6.227 1.00 0.00 H new ATOM 0 HH12 ARG A 4 18.325 -4.212 -5.035 1.00 0.00 H new ATOM 0 HH21 ARG A 4 16.274 -5.280 -2.376 1.00 0.00 H new ATOM 0 HH22 ARG A 4 17.904 -4.808 -2.867 1.00 0.00 H new ATOM 83 N ILE A 5 9.486 -3.062 -6.504 1.00 0.00 N ATOM 84 CA ILE A 5 8.928 -1.724 -6.392 1.00 0.00 C ATOM 85 C ILE A 5 9.533 -1.091 -5.158 1.00 0.00 C ATOM 86 O ILE A 5 9.282 -1.533 -4.037 1.00 0.00 O ATOM 87 CB ILE A 5 7.371 -1.721 -6.331 1.00 0.00 C ATOM 88 CG1 ILE A 5 6.822 -0.731 -5.292 1.00 0.00 C ATOM 89 CG2 ILE A 5 6.834 -3.111 -6.048 1.00 0.00 C ATOM 90 CD1 ILE A 5 6.845 0.706 -5.753 1.00 0.00 C ATOM 0 H ILE A 5 9.047 -3.754 -5.897 1.00 0.00 H new ATOM 0 HA ILE A 5 9.176 -1.150 -7.285 1.00 0.00 H new ATOM 0 HB ILE A 5 7.028 -1.394 -7.313 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.797 -1.008 -5.045 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.405 -0.819 -4.375 1.00 0.00 H new ATOM 0 HG21 ILE A 5 5.745 -3.080 -6.011 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.151 -3.791 -6.839 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.220 -3.462 -5.091 1.00 0.00 H new ATOM 0 HD11 ILE A 5 6.443 1.346 -4.968 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.871 1.001 -5.972 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.238 0.809 -6.652 1.00 0.00 H new ATOM 102 N THR A 6 10.386 -0.104 -5.363 1.00 0.00 N ATOM 103 CA THR A 6 11.066 0.514 -4.247 1.00 0.00 C ATOM 104 C THR A 6 10.936 2.024 -4.226 1.00 0.00 C ATOM 105 O THR A 6 11.347 2.720 -5.154 1.00 0.00 O ATOM 106 CB THR A 6 12.535 0.121 -4.270 1.00 0.00 C ATOM 107 OG1 THR A 6 13.282 0.922 -3.373 1.00 0.00 O ATOM 108 CG2 THR A 6 13.171 0.242 -5.640 1.00 0.00 C ATOM 0 H THR A 6 10.620 0.280 -6.278 1.00 0.00 H new ATOM 0 HA THR A 6 10.585 0.150 -3.339 1.00 0.00 H new ATOM 0 HB THR A 6 12.557 -0.928 -3.974 1.00 0.00 H new ATOM 0 HG1 THR A 6 12.787 1.021 -2.533 1.00 0.00 H new ATOM 0 HG21 THR A 6 14.218 -0.054 -5.582 1.00 0.00 H new ATOM 0 HG22 THR A 6 12.648 -0.407 -6.342 1.00 0.00 H new ATOM 0 HG23 THR A 6 13.104 1.275 -5.982 1.00 0.00 H new ATOM 116 N VAL A 7 10.398 2.518 -3.123 1.00 0.00 N ATOM 117 CA VAL A 7 10.248 3.947 -2.915 1.00 0.00 C ATOM 118 C VAL A 7 11.390 4.425 -2.021 1.00 0.00 C ATOM 119 O VAL A 7 11.371 4.215 -0.811 1.00 0.00 O ATOM 120 CB VAL A 7 8.845 4.325 -2.319 1.00 0.00 C ATOM 121 CG1 VAL A 7 7.941 3.102 -2.209 1.00 0.00 C ATOM 122 CG2 VAL A 7 8.947 5.025 -0.960 1.00 0.00 C ATOM 0 H VAL A 7 10.056 1.944 -2.353 1.00 0.00 H new ATOM 0 HA VAL A 7 10.298 4.452 -3.879 1.00 0.00 H new ATOM 0 HB VAL A 7 8.402 5.033 -3.019 1.00 0.00 H new ATOM 0 HG11 VAL A 7 6.978 3.398 -1.793 1.00 0.00 H new ATOM 0 HG12 VAL A 7 7.792 2.670 -3.198 1.00 0.00 H new ATOM 0 HG13 VAL A 7 8.406 2.363 -1.557 1.00 0.00 H new ATOM 0 HG21 VAL A 7 7.947 5.262 -0.597 1.00 0.00 H new ATOM 0 HG22 VAL A 7 9.445 4.367 -0.248 1.00 0.00 H new ATOM 0 HG23 VAL A 7 9.522 5.945 -1.067 1.00 0.00 H new ATOM 132 N THR A 8 12.406 5.037 -2.622 1.00 0.00 N ATOM 133 CA THR A 8 13.547 5.510 -1.861 1.00 0.00 C ATOM 134 C THR A 8 13.110 6.629 -0.927 1.00 0.00 C ATOM 135 O THR A 8 13.013 7.789 -1.329 1.00 0.00 O ATOM 136 CB THR A 8 14.651 5.980 -2.804 1.00 0.00 C ATOM 137 OG1 THR A 8 14.103 6.566 -3.971 1.00 0.00 O ATOM 138 CG2 THR A 8 15.578 4.865 -3.236 1.00 0.00 C ATOM 0 H THR A 8 12.459 5.214 -3.625 1.00 0.00 H new ATOM 0 HA THR A 8 13.946 4.693 -1.259 1.00 0.00 H new ATOM 0 HB THR A 8 15.227 6.710 -2.235 1.00 0.00 H new ATOM 0 HG1 THR A 8 14.828 6.862 -4.560 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.340 5.264 -3.905 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.057 4.430 -2.359 1.00 0.00 H new ATOM 0 HG23 THR A 8 15.006 4.097 -3.756 1.00 0.00 H new ATOM 146 N VAL A 9 12.804 6.261 0.311 1.00 0.00 N ATOM 147 CA VAL A 9 12.324 7.218 1.295 1.00 0.00 C ATOM 148 C VAL A 9 13.457 7.965 2.007 1.00 0.00 C ATOM 149 O VAL A 9 14.214 8.686 1.358 1.00 0.00 O ATOM 150 CB VAL A 9 11.395 6.544 2.320 1.00 0.00 C ATOM 151 CG1 VAL A 9 10.675 7.597 3.146 1.00 0.00 C ATOM 152 CG2 VAL A 9 10.404 5.634 1.608 1.00 0.00 C ATOM 0 H VAL A 9 12.881 5.304 0.656 1.00 0.00 H new ATOM 0 HA VAL A 9 11.754 7.963 0.739 1.00 0.00 H new ATOM 0 HB VAL A 9 11.992 5.933 2.997 1.00 0.00 H new ATOM 0 HG11 VAL A 9 10.021 7.108 3.868 1.00 0.00 H new ATOM 0 HG12 VAL A 9 11.407 8.208 3.675 1.00 0.00 H new ATOM 0 HG13 VAL A 9 10.081 8.231 2.489 1.00 0.00 H new ATOM 0 HG21 VAL A 9 9.751 5.162 2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 9 9.804 6.222 0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 9 10.946 4.865 1.057 1.00 0.00 H new ATOM 162 N ASP A 10 13.538 7.853 3.344 1.00 0.00 N ATOM 163 CA ASP A 10 14.541 8.583 4.118 1.00 0.00 C ATOM 164 C ASP A 10 14.118 10.046 4.211 1.00 0.00 C ATOM 165 O ASP A 10 14.348 10.716 5.218 1.00 0.00 O ATOM 166 CB ASP A 10 15.933 8.457 3.497 1.00 0.00 C ATOM 167 CG ASP A 10 16.974 9.277 4.235 1.00 0.00 C ATOM 168 OD1 ASP A 10 16.833 10.517 4.276 1.00 0.00 O ATOM 169 OD2 ASP A 10 17.931 8.679 4.771 1.00 0.00 O ATOM 0 H ASP A 10 12.921 7.265 3.904 1.00 0.00 H new ATOM 0 HA ASP A 10 14.602 8.152 5.117 1.00 0.00 H new ATOM 0 HB2 ASP A 10 16.234 7.409 3.497 1.00 0.00 H new ATOM 0 HB3 ASP A 10 15.893 8.778 2.456 1.00 0.00 H new ATOM 174 N SER A 11 13.461 10.512 3.153 1.00 0.00 N ATOM 175 CA SER A 11 12.948 11.863 3.081 1.00 0.00 C ATOM 176 C SER A 11 11.425 11.820 3.143 1.00 0.00 C ATOM 177 O SER A 11 10.792 12.689 3.742 1.00 0.00 O ATOM 178 CB SER A 11 13.408 12.531 1.787 1.00 0.00 C ATOM 179 OG SER A 11 12.602 13.654 1.475 1.00 0.00 O ATOM 0 H SER A 11 13.272 9.954 2.320 1.00 0.00 H new ATOM 0 HA SER A 11 13.328 12.445 3.921 1.00 0.00 H new ATOM 0 HB2 SER A 11 14.448 12.843 1.885 1.00 0.00 H new ATOM 0 HB3 SER A 11 13.367 11.812 0.969 1.00 0.00 H new ATOM 0 HG SER A 11 12.919 14.063 0.643 1.00 0.00 H new ATOM 185 N ASP A 12 10.840 10.784 2.528 1.00 0.00 N ATOM 186 CA ASP A 12 9.394 10.615 2.528 1.00 0.00 C ATOM 187 C ASP A 12 8.926 10.062 3.877 1.00 0.00 C ATOM 188 O ASP A 12 9.742 9.715 4.731 1.00 0.00 O ATOM 189 CB ASP A 12 8.952 9.710 1.373 1.00 0.00 C ATOM 190 CG ASP A 12 9.836 9.851 0.147 1.00 0.00 C ATOM 191 OD1 ASP A 12 10.372 10.958 -0.073 1.00 0.00 O ATOM 192 OD2 ASP A 12 9.991 8.856 -0.591 1.00 0.00 O ATOM 0 H ASP A 12 11.350 10.056 2.027 1.00 0.00 H new ATOM 0 HA ASP A 12 8.929 11.589 2.380 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.962 8.672 1.706 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.923 9.948 1.103 1.00 0.00 H new ATOM 197 N SER A 13 7.614 10.036 4.080 1.00 0.00 N ATOM 198 CA SER A 13 7.030 9.589 5.347 1.00 0.00 C ATOM 199 C SER A 13 7.222 8.109 5.656 1.00 0.00 C ATOM 200 O SER A 13 7.088 7.705 6.810 1.00 0.00 O ATOM 201 CB SER A 13 5.553 9.972 5.429 1.00 0.00 C ATOM 202 OG SER A 13 5.324 10.894 6.480 1.00 0.00 O ATOM 0 H SER A 13 6.928 10.320 3.381 1.00 0.00 H new ATOM 0 HA SER A 13 7.591 10.116 6.119 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.234 10.408 4.482 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.950 9.078 5.587 1.00 0.00 H new ATOM 0 HG SER A 13 5.422 11.808 6.141 1.00 0.00 H new ATOM 208 N TYR A 14 7.532 7.305 4.658 1.00 0.00 N ATOM 209 CA TYR A 14 7.738 5.876 4.876 1.00 0.00 C ATOM 210 C TYR A 14 8.502 5.613 6.180 1.00 0.00 C ATOM 211 O TYR A 14 8.097 4.788 7.000 1.00 0.00 O ATOM 212 CB TYR A 14 8.562 5.336 3.754 1.00 0.00 C ATOM 213 CG TYR A 14 9.449 4.185 4.176 1.00 0.00 C ATOM 214 CD1 TYR A 14 8.991 2.876 4.157 1.00 0.00 C ATOM 215 CD2 TYR A 14 10.739 4.423 4.617 1.00 0.00 C ATOM 216 CE1 TYR A 14 9.802 1.832 4.565 1.00 0.00 C ATOM 217 CE2 TYR A 14 11.559 3.395 5.026 1.00 0.00 C ATOM 218 CZ TYR A 14 11.087 2.097 5.000 1.00 0.00 C ATOM 219 OH TYR A 14 11.899 1.063 5.406 1.00 0.00 O ATOM 0 H TYR A 14 7.648 7.609 3.691 1.00 0.00 H new ATOM 0 HA TYR A 14 6.761 5.397 4.931 1.00 0.00 H new ATOM 0 HB2 TYR A 14 7.902 5.005 2.952 1.00 0.00 H new ATOM 0 HB3 TYR A 14 9.181 6.135 3.347 1.00 0.00 H new ATOM 0 HD1 TYR A 14 7.987 2.669 3.819 1.00 0.00 H new ATOM 0 HD2 TYR A 14 11.111 5.437 4.641 1.00 0.00 H new ATOM 0 HE1 TYR A 14 9.434 0.817 4.544 1.00 0.00 H new ATOM 0 HE2 TYR A 14 12.563 3.602 5.365 1.00 0.00 H new ATOM 0 HH TYR A 14 12.827 1.374 5.451 1.00 0.00 H new ATOM 229 N GLN A 15 9.635 6.307 6.336 1.00 0.00 N ATOM 230 CA GLN A 15 10.493 6.141 7.504 1.00 0.00 C ATOM 231 C GLN A 15 9.705 6.250 8.805 1.00 0.00 C ATOM 232 O GLN A 15 9.956 5.511 9.749 1.00 0.00 O ATOM 233 CB GLN A 15 11.619 7.177 7.516 1.00 0.00 C ATOM 234 CG GLN A 15 12.467 7.197 6.258 1.00 0.00 C ATOM 235 CD GLN A 15 13.690 6.308 6.370 1.00 0.00 C ATOM 236 OE1 GLN A 15 13.886 5.400 5.563 1.00 0.00 O ATOM 237 NE2 GLN A 15 14.520 6.566 7.374 1.00 0.00 N ATOM 0 H GLN A 15 9.976 6.992 5.661 1.00 0.00 H new ATOM 0 HA GLN A 15 10.921 5.141 7.434 1.00 0.00 H new ATOM 0 HB2 GLN A 15 11.185 8.166 7.662 1.00 0.00 H new ATOM 0 HB3 GLN A 15 12.265 6.983 8.372 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.863 6.873 5.411 1.00 0.00 H new ATOM 0 HG3 GLN A 15 12.783 8.220 6.052 1.00 0.00 H new ATOM 0 HE21 GLN A 15 14.318 7.329 8.020 1.00 0.00 H new ATOM 0 HE22 GLN A 15 15.360 6.001 7.500 1.00 0.00 H new ATOM 246 N LEU A 16 8.763 7.183 8.856 1.00 0.00 N ATOM 247 CA LEU A 16 7.959 7.383 10.059 1.00 0.00 C ATOM 248 C LEU A 16 7.262 6.093 10.484 1.00 0.00 C ATOM 249 O LEU A 16 7.342 5.688 11.643 1.00 0.00 O ATOM 250 CB LEU A 16 6.925 8.486 9.833 1.00 0.00 C ATOM 251 CG LEU A 16 7.352 9.877 10.302 1.00 0.00 C ATOM 252 CD1 LEU A 16 6.528 10.950 9.608 1.00 0.00 C ATOM 253 CD2 LEU A 16 7.219 9.991 11.812 1.00 0.00 C ATOM 0 H LEU A 16 8.536 7.811 8.085 1.00 0.00 H new ATOM 0 HA LEU A 16 8.633 7.684 10.861 1.00 0.00 H new ATOM 0 HB2 LEU A 16 6.693 8.533 8.769 1.00 0.00 H new ATOM 0 HB3 LEU A 16 6.005 8.212 10.348 1.00 0.00 H new ATOM 0 HG LEU A 16 8.399 10.026 10.037 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.846 11.934 9.954 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.674 10.880 8.530 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.473 10.807 9.842 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.527 10.987 12.130 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.181 9.823 12.100 1.00 0.00 H new ATOM 0 HD23 LEU A 16 7.854 9.245 12.290 1.00 0.00 H new ATOM 265 N LEU A 17 6.572 5.456 9.543 1.00 0.00 N ATOM 266 CA LEU A 17 5.856 4.217 9.831 1.00 0.00 C ATOM 267 C LEU A 17 6.805 3.110 10.262 1.00 0.00 C ATOM 268 O LEU A 17 6.570 2.431 11.262 1.00 0.00 O ATOM 269 CB LEU A 17 5.072 3.752 8.608 1.00 0.00 C ATOM 270 CG LEU A 17 3.565 3.621 8.818 1.00 0.00 C ATOM 271 CD1 LEU A 17 3.260 2.467 9.762 1.00 0.00 C ATOM 272 CD2 LEU A 17 2.987 4.921 9.357 1.00 0.00 C ATOM 0 H LEU A 17 6.493 5.776 8.578 1.00 0.00 H new ATOM 0 HA LEU A 17 5.168 4.428 10.650 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.250 4.453 7.793 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.464 2.786 8.289 1.00 0.00 H new ATOM 0 HG LEU A 17 3.098 3.412 7.856 1.00 0.00 H new ATOM 0 HD11 LEU A 17 2.182 2.386 9.902 1.00 0.00 H new ATOM 0 HD12 LEU A 17 3.641 1.539 9.337 1.00 0.00 H new ATOM 0 HD13 LEU A 17 3.738 2.648 10.725 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.912 4.809 9.501 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.458 5.161 10.311 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.177 5.726 8.647 1.00 0.00 H new ATOM 284 N LYS A 18 7.873 2.926 9.499 1.00 0.00 N ATOM 285 CA LYS A 18 8.846 1.895 9.805 1.00 0.00 C ATOM 286 C LYS A 18 9.648 2.277 11.025 1.00 0.00 C ATOM 287 O LYS A 18 10.155 1.424 11.753 1.00 0.00 O ATOM 288 CB LYS A 18 9.758 1.623 8.607 1.00 0.00 C ATOM 289 CG LYS A 18 10.603 2.817 8.198 1.00 0.00 C ATOM 290 CD LYS A 18 12.087 2.492 8.257 1.00 0.00 C ATOM 291 CE LYS A 18 12.935 3.750 8.185 1.00 0.00 C ATOM 292 NZ LYS A 18 14.390 3.444 8.264 1.00 0.00 N ATOM 0 H LYS A 18 8.085 3.477 8.667 1.00 0.00 H new ATOM 0 HA LYS A 18 8.310 0.971 10.023 1.00 0.00 H new ATOM 0 HB2 LYS A 18 10.417 0.788 8.846 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.147 1.315 7.759 1.00 0.00 H new ATOM 0 HG2 LYS A 18 10.336 3.124 7.187 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.387 3.660 8.855 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.307 1.956 9.180 1.00 0.00 H new ATOM 0 HD3 LYS A 18 12.348 1.828 7.433 1.00 0.00 H new ATOM 0 HE2 LYS A 18 12.725 4.277 7.254 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.660 4.420 9.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 14.906 4.029 7.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.736 3.650 9.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 14.546 2.439 8.048 1.00 0.00 H new ATOM 306 N ALA A 19 9.724 3.567 11.253 1.00 0.00 N ATOM 307 CA ALA A 19 10.425 4.091 12.403 1.00 0.00 C ATOM 308 C ALA A 19 9.688 3.694 13.673 1.00 0.00 C ATOM 309 O ALA A 19 10.254 3.724 14.763 1.00 0.00 O ATOM 310 CB ALA A 19 10.561 5.604 12.317 1.00 0.00 C ATOM 0 H ALA A 19 9.306 4.278 10.653 1.00 0.00 H new ATOM 0 HA ALA A 19 11.429 3.668 12.423 1.00 0.00 H new ATOM 0 HB1 ALA A 19 11.092 5.972 13.195 1.00 0.00 H new ATOM 0 HB2 ALA A 19 11.118 5.869 11.418 1.00 0.00 H new ATOM 0 HB3 ALA A 19 9.570 6.057 12.276 1.00 0.00 H new ATOM 316 N TYR A 20 8.417 3.315 13.509 1.00 0.00 N ATOM 317 CA TYR A 20 7.578 2.898 14.614 1.00 0.00 C ATOM 318 C TYR A 20 6.886 1.575 14.312 1.00 0.00 C ATOM 319 O TYR A 20 5.990 1.165 15.050 1.00 0.00 O ATOM 320 CB TYR A 20 6.511 3.954 14.916 1.00 0.00 C ATOM 321 CG TYR A 20 7.062 5.345 15.109 1.00 0.00 C ATOM 322 CD1 TYR A 20 8.303 5.531 15.696 1.00 0.00 C ATOM 323 CD2 TYR A 20 6.347 6.469 14.701 1.00 0.00 C ATOM 324 CE1 TYR A 20 8.828 6.790 15.873 1.00 0.00 C ATOM 325 CE2 TYR A 20 6.866 7.738 14.876 1.00 0.00 C ATOM 326 CZ TYR A 20 8.107 7.894 15.462 1.00 0.00 C ATOM 327 OH TYR A 20 8.629 9.155 15.636 1.00 0.00 O ATOM 0 H TYR A 20 7.950 3.292 12.603 1.00 0.00 H new ATOM 0 HA TYR A 20 8.227 2.774 15.481 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.789 3.970 14.099 1.00 0.00 H new ATOM 0 HB3 TYR A 20 5.969 3.661 15.815 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.869 4.671 16.021 1.00 0.00 H new ATOM 0 HD2 TYR A 20 5.377 6.347 14.243 1.00 0.00 H new ATOM 0 HE1 TYR A 20 9.798 6.915 16.331 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.304 8.603 14.556 1.00 0.00 H new ATOM 0 HH TYR A 20 7.997 9.821 15.293 1.00 0.00 H new ATOM 337 N ASP A 21 7.280 0.905 13.224 1.00 0.00 N ATOM 338 CA ASP A 21 6.659 -0.356 12.858 1.00 0.00 C ATOM 339 C ASP A 21 7.087 -0.736 11.458 1.00 0.00 C ATOM 340 O ASP A 21 6.268 -0.820 10.545 1.00 0.00 O ATOM 341 CB ASP A 21 5.129 -0.259 12.937 1.00 0.00 C ATOM 342 CG ASP A 21 4.565 -1.024 14.118 1.00 0.00 C ATOM 343 OD1 ASP A 21 5.017 -2.163 14.358 1.00 0.00 O ATOM 344 OD2 ASP A 21 3.671 -0.484 14.803 1.00 0.00 O ATOM 0 H ASP A 21 8.018 1.217 12.593 1.00 0.00 H new ATOM 0 HA ASP A 21 6.982 -1.124 13.561 1.00 0.00 H new ATOM 0 HB2 ASP A 21 4.837 0.788 13.012 1.00 0.00 H new ATOM 0 HB3 ASP A 21 4.694 -0.646 12.015 1.00 0.00 H new ATOM 349 N VAL A 22 8.383 -0.948 11.307 1.00 0.00 N ATOM 350 CA VAL A 22 8.966 -1.315 10.029 1.00 0.00 C ATOM 351 C VAL A 22 8.366 -2.614 9.525 1.00 0.00 C ATOM 352 O VAL A 22 9.006 -3.664 9.466 1.00 0.00 O ATOM 353 CB VAL A 22 10.483 -1.405 10.162 1.00 0.00 C ATOM 354 CG1 VAL A 22 10.860 -2.271 11.355 1.00 0.00 C ATOM 355 CG2 VAL A 22 11.117 -1.911 8.869 1.00 0.00 C ATOM 0 H VAL A 22 9.060 -0.871 12.066 1.00 0.00 H new ATOM 0 HA VAL A 22 8.737 -0.546 9.291 1.00 0.00 H new ATOM 0 HB VAL A 22 10.877 -0.404 10.341 1.00 0.00 H new ATOM 0 HG11 VAL A 22 11.946 -2.325 11.436 1.00 0.00 H new ATOM 0 HG12 VAL A 22 10.449 -1.835 12.266 1.00 0.00 H new ATOM 0 HG13 VAL A 22 10.456 -3.274 11.219 1.00 0.00 H new ATOM 0 HG21 VAL A 22 12.199 -1.966 8.991 1.00 0.00 H new ATOM 0 HG22 VAL A 22 10.728 -2.902 8.636 1.00 0.00 H new ATOM 0 HG23 VAL A 22 10.878 -1.227 8.055 1.00 0.00 H new ATOM 365 N ASN A 23 7.110 -2.479 9.164 1.00 0.00 N ATOM 366 CA ASN A 23 6.282 -3.535 8.643 1.00 0.00 C ATOM 367 C ASN A 23 5.301 -2.870 7.717 1.00 0.00 C ATOM 368 O ASN A 23 4.097 -2.823 7.971 1.00 0.00 O ATOM 369 CB ASN A 23 5.547 -4.193 9.780 1.00 0.00 C ATOM 370 CG ASN A 23 5.124 -5.615 9.472 1.00 0.00 C ATOM 371 OD1 ASN A 23 5.356 -6.120 8.373 1.00 0.00 O ATOM 372 ND2 ASN A 23 4.497 -6.270 10.442 1.00 0.00 N ATOM 0 H ASN A 23 6.618 -1.588 9.230 1.00 0.00 H new ATOM 0 HA ASN A 23 6.865 -4.297 8.126 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.184 -4.194 10.664 1.00 0.00 H new ATOM 0 HB3 ASN A 23 4.664 -3.602 10.024 1.00 0.00 H new ATOM 0 HD21 ASN A 23 4.187 -7.230 10.291 1.00 0.00 H new ATOM 0 HD22 ASN A 23 4.325 -5.813 11.338 1.00 0.00 H new ATOM 379 N ILE A 24 5.846 -2.303 6.673 1.00 0.00 N ATOM 380 CA ILE A 24 5.078 -1.574 5.727 1.00 0.00 C ATOM 381 C ILE A 24 5.301 -2.089 4.337 1.00 0.00 C ATOM 382 O ILE A 24 4.417 -2.034 3.492 1.00 0.00 O ATOM 383 CB ILE A 24 5.388 -0.081 5.735 1.00 0.00 C ATOM 384 CG1 ILE A 24 6.797 0.163 5.233 1.00 0.00 C ATOM 385 CG2 ILE A 24 5.153 0.526 7.114 1.00 0.00 C ATOM 386 CD1 ILE A 24 7.827 -0.477 6.117 1.00 0.00 C ATOM 0 H ILE A 24 6.843 -2.341 6.463 1.00 0.00 H new ATOM 0 HA ILE A 24 4.039 -1.716 6.025 1.00 0.00 H new ATOM 0 HB ILE A 24 4.702 0.423 5.054 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.894 -0.229 4.221 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.982 1.236 5.179 1.00 0.00 H new ATOM 0 HG21 ILE A 24 5.383 1.591 7.087 1.00 0.00 H new ATOM 0 HG22 ILE A 24 4.110 0.387 7.400 1.00 0.00 H new ATOM 0 HG23 ILE A 24 5.798 0.034 7.843 1.00 0.00 H new ATOM 0 HD11 ILE A 24 8.822 -0.277 5.720 1.00 0.00 H new ATOM 0 HD12 ILE A 24 7.749 -0.066 7.124 1.00 0.00 H new ATOM 0 HD13 ILE A 24 7.659 -1.554 6.150 1.00 0.00 H new ATOM 398 N SER A 25 6.504 -2.574 4.095 1.00 0.00 N ATOM 399 CA SER A 25 6.832 -3.089 2.788 1.00 0.00 C ATOM 400 C SER A 25 5.665 -3.928 2.289 1.00 0.00 C ATOM 401 O SER A 25 5.156 -3.736 1.180 1.00 0.00 O ATOM 402 CB SER A 25 8.108 -3.913 2.829 1.00 0.00 C ATOM 403 OG SER A 25 8.121 -4.787 3.944 1.00 0.00 O ATOM 0 H SER A 25 7.259 -2.620 4.779 1.00 0.00 H new ATOM 0 HA SER A 25 7.007 -2.258 2.105 1.00 0.00 H new ATOM 0 HB2 SER A 25 8.199 -4.492 1.910 1.00 0.00 H new ATOM 0 HB3 SER A 25 8.971 -3.249 2.875 1.00 0.00 H new ATOM 0 HG SER A 25 8.953 -5.305 3.944 1.00 0.00 H new ATOM 409 N GLY A 26 5.201 -4.816 3.164 1.00 0.00 N ATOM 410 CA GLY A 26 4.045 -5.628 2.840 1.00 0.00 C ATOM 411 C GLY A 26 2.814 -4.751 2.764 1.00 0.00 C ATOM 412 O GLY A 26 1.969 -4.908 1.883 1.00 0.00 O ATOM 0 H GLY A 26 5.603 -4.986 4.086 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.201 -6.137 1.889 1.00 0.00 H new ATOM 0 HA3 GLY A 26 3.907 -6.401 3.596 1.00 0.00 H new ATOM 416 N LEU A 27 2.752 -3.792 3.688 1.00 0.00 N ATOM 417 CA LEU A 27 1.676 -2.825 3.755 1.00 0.00 C ATOM 418 C LEU A 27 1.516 -2.112 2.430 1.00 0.00 C ATOM 419 O LEU A 27 0.401 -1.880 1.972 1.00 0.00 O ATOM 420 CB LEU A 27 2.025 -1.799 4.812 1.00 0.00 C ATOM 421 CG LEU A 27 1.000 -0.700 5.046 1.00 0.00 C ATOM 422 CD1 LEU A 27 0.078 -1.086 6.188 1.00 0.00 C ATOM 423 CD2 LEU A 27 1.713 0.620 5.333 1.00 0.00 C ATOM 0 H LEU A 27 3.458 -3.670 4.414 1.00 0.00 H new ATOM 0 HA LEU A 27 0.746 -3.341 3.995 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.189 -2.321 5.755 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.971 -1.332 4.537 1.00 0.00 H new ATOM 0 HG LEU A 27 0.393 -0.572 4.150 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.653 -0.294 6.349 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.440 -2.013 5.940 1.00 0.00 H new ATOM 0 HD13 LEU A 27 0.664 -1.229 7.096 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.974 1.404 5.500 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.335 0.512 6.222 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.340 0.887 4.482 1.00 0.00 H new ATOM 435 N VAL A 28 2.645 -1.755 1.815 1.00 0.00 N ATOM 436 CA VAL A 28 2.614 -1.060 0.541 1.00 0.00 C ATOM 437 C VAL A 28 1.659 -1.773 -0.400 1.00 0.00 C ATOM 438 O VAL A 28 0.688 -1.190 -0.859 1.00 0.00 O ATOM 439 CB VAL A 28 4.031 -0.989 -0.067 1.00 0.00 C ATOM 440 CG1 VAL A 28 3.994 -0.590 -1.538 1.00 0.00 C ATOM 441 CG2 VAL A 28 4.892 -0.032 0.750 1.00 0.00 C ATOM 0 H VAL A 28 3.580 -1.936 2.180 1.00 0.00 H new ATOM 0 HA VAL A 28 2.263 -0.040 0.695 1.00 0.00 H new ATOM 0 HB VAL A 28 4.476 -1.983 -0.026 1.00 0.00 H new ATOM 0 HG11 VAL A 28 5.010 -0.551 -1.930 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.416 -1.324 -2.100 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.529 0.391 -1.637 1.00 0.00 H new ATOM 0 HG21 VAL A 28 5.892 0.016 0.319 1.00 0.00 H new ATOM 0 HG22 VAL A 28 4.443 0.961 0.738 1.00 0.00 H new ATOM 0 HG23 VAL A 28 4.957 -0.389 1.778 1.00 0.00 H new ATOM 451 N SER A 29 1.928 -3.048 -0.635 1.00 0.00 N ATOM 452 CA SER A 29 1.085 -3.879 -1.480 1.00 0.00 C ATOM 453 C SER A 29 -0.301 -4.090 -0.861 1.00 0.00 C ATOM 454 O SER A 29 -1.245 -4.442 -1.558 1.00 0.00 O ATOM 455 CB SER A 29 1.757 -5.233 -1.699 1.00 0.00 C ATOM 456 OG SER A 29 3.168 -5.118 -1.646 1.00 0.00 O ATOM 0 H SER A 29 2.735 -3.535 -0.246 1.00 0.00 H new ATOM 0 HA SER A 29 0.955 -3.366 -2.433 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.418 -5.938 -0.940 1.00 0.00 H new ATOM 0 HB3 SER A 29 1.458 -5.638 -2.666 1.00 0.00 H new ATOM 0 HG SER A 29 3.552 -5.955 -1.312 1.00 0.00 H new ATOM 462 N THR A 30 -0.430 -3.875 0.448 1.00 0.00 N ATOM 463 CA THR A 30 -1.714 -4.051 1.116 1.00 0.00 C ATOM 464 C THR A 30 -2.583 -2.832 0.886 1.00 0.00 C ATOM 465 O THR A 30 -3.750 -2.945 0.514 1.00 0.00 O ATOM 466 CB THR A 30 -1.525 -4.279 2.618 1.00 0.00 C ATOM 467 OG1 THR A 30 -0.807 -5.477 2.857 1.00 0.00 O ATOM 468 CG2 THR A 30 -2.833 -4.369 3.382 1.00 0.00 C ATOM 0 H THR A 30 0.332 -3.582 1.060 1.00 0.00 H new ATOM 0 HA THR A 30 -2.201 -4.931 0.696 1.00 0.00 H new ATOM 0 HB THR A 30 -0.974 -3.409 2.974 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.116 -5.373 2.545 1.00 0.00 H new ATOM 0 HG21 THR A 30 -2.626 -4.531 4.440 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.391 -3.441 3.259 1.00 0.00 H new ATOM 0 HG23 THR A 30 -3.423 -5.200 2.996 1.00 0.00 H new ATOM 476 N THR A 31 -1.996 -1.662 1.097 1.00 0.00 N ATOM 477 CA THR A 31 -2.709 -0.418 0.899 1.00 0.00 C ATOM 478 C THR A 31 -3.255 -0.349 -0.523 1.00 0.00 C ATOM 479 O THR A 31 -4.231 0.347 -0.798 1.00 0.00 O ATOM 480 CB THR A 31 -1.800 0.782 1.196 1.00 0.00 C ATOM 481 OG1 THR A 31 -2.569 1.955 1.407 1.00 0.00 O ATOM 482 CG2 THR A 31 -0.803 1.079 0.096 1.00 0.00 C ATOM 0 H THR A 31 -1.030 -1.553 1.405 1.00 0.00 H new ATOM 0 HA THR A 31 -3.548 -0.381 1.594 1.00 0.00 H new ATOM 0 HB THR A 31 -1.247 0.502 2.092 1.00 0.00 H new ATOM 0 HG1 THR A 31 -2.124 2.718 0.983 1.00 0.00 H new ATOM 0 HG21 THR A 31 -0.196 1.940 0.378 1.00 0.00 H new ATOM 0 HG22 THR A 31 -0.158 0.213 -0.054 1.00 0.00 H new ATOM 0 HG23 THR A 31 -1.336 1.298 -0.829 1.00 0.00 H new ATOM 490 N MET A 32 -2.621 -1.105 -1.413 1.00 0.00 N ATOM 491 CA MET A 32 -3.041 -1.165 -2.804 1.00 0.00 C ATOM 492 C MET A 32 -4.239 -2.086 -2.928 1.00 0.00 C ATOM 493 O MET A 32 -5.201 -1.764 -3.606 1.00 0.00 O ATOM 494 CB MET A 32 -1.921 -1.668 -3.727 1.00 0.00 C ATOM 495 CG MET A 32 -0.513 -1.479 -3.191 1.00 0.00 C ATOM 496 SD MET A 32 0.019 0.239 -3.193 1.00 0.00 S ATOM 497 CE MET A 32 1.450 0.129 -4.264 1.00 0.00 C ATOM 0 H MET A 32 -1.812 -1.686 -1.192 1.00 0.00 H new ATOM 0 HA MET A 32 -3.299 -0.152 -3.114 1.00 0.00 H new ATOM 0 HB2 MET A 32 -2.080 -2.729 -3.921 1.00 0.00 H new ATOM 0 HB3 MET A 32 -2.001 -1.153 -4.684 1.00 0.00 H new ATOM 0 HG2 MET A 32 -0.463 -1.867 -2.174 1.00 0.00 H new ATOM 0 HG3 MET A 32 0.180 -2.068 -3.792 1.00 0.00 H new ATOM 0 HE1 MET A 32 2.104 0.983 -4.086 1.00 0.00 H new ATOM 0 HE2 MET A 32 1.992 -0.793 -4.054 1.00 0.00 H new ATOM 0 HE3 MET A 32 1.126 0.130 -5.305 1.00 0.00 H new ATOM 507 N GLN A 33 -4.174 -3.235 -2.258 1.00 0.00 N ATOM 508 CA GLN A 33 -5.267 -4.202 -2.291 1.00 0.00 C ATOM 509 C GLN A 33 -6.592 -3.515 -1.985 1.00 0.00 C ATOM 510 O GLN A 33 -7.621 -3.832 -2.582 1.00 0.00 O ATOM 511 CB GLN A 33 -5.013 -5.327 -1.290 1.00 0.00 C ATOM 512 CG GLN A 33 -5.999 -6.478 -1.404 1.00 0.00 C ATOM 513 CD GLN A 33 -5.649 -7.437 -2.526 1.00 0.00 C ATOM 514 OE1 GLN A 33 -5.095 -8.511 -2.290 1.00 0.00 O ATOM 515 NE2 GLN A 33 -5.973 -7.054 -3.756 1.00 0.00 N ATOM 0 H GLN A 33 -3.377 -3.518 -1.687 1.00 0.00 H new ATOM 0 HA GLN A 33 -5.319 -4.631 -3.292 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -4.003 -5.710 -1.435 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -5.058 -4.920 -0.280 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -6.026 -7.023 -0.460 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -7.000 -6.079 -1.571 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -6.431 -6.155 -3.906 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -5.763 -7.659 -4.550 1.00 0.00 H new ATOM 524 N ASN A 34 -6.552 -2.555 -1.065 1.00 0.00 N ATOM 525 CA ASN A 34 -7.744 -1.803 -0.698 1.00 0.00 C ATOM 526 C ASN A 34 -8.094 -0.837 -1.816 1.00 0.00 C ATOM 527 O ASN A 34 -9.232 -0.798 -2.285 1.00 0.00 O ATOM 528 CB ASN A 34 -7.509 -1.057 0.618 1.00 0.00 C ATOM 529 CG ASN A 34 -8.716 -0.251 1.056 1.00 0.00 C ATOM 530 OD1 ASN A 34 -9.857 -0.691 0.914 1.00 0.00 O ATOM 531 ND2 ASN A 34 -8.468 0.939 1.592 1.00 0.00 N ATOM 0 H ASN A 34 -5.708 -2.281 -0.562 1.00 0.00 H new ATOM 0 HA ASN A 34 -8.580 -2.487 -0.553 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -7.254 -1.775 1.398 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -6.653 -0.391 0.506 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -9.240 1.528 1.905 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -7.506 1.264 1.690 1.00 0.00 H new ATOM 538 N GLU A 35 -7.097 -0.092 -2.275 1.00 0.00 N ATOM 539 CA GLU A 35 -7.295 0.831 -3.379 1.00 0.00 C ATOM 540 C GLU A 35 -7.441 0.034 -4.674 1.00 0.00 C ATOM 541 O GLU A 35 -7.857 0.561 -5.705 1.00 0.00 O ATOM 542 CB GLU A 35 -6.120 1.804 -3.484 1.00 0.00 C ATOM 543 CG GLU A 35 -6.197 2.957 -2.497 1.00 0.00 C ATOM 544 CD GLU A 35 -5.134 4.009 -2.745 1.00 0.00 C ATOM 545 OE1 GLU A 35 -3.951 3.635 -2.891 1.00 0.00 O ATOM 546 OE2 GLU A 35 -5.484 5.207 -2.794 1.00 0.00 O ATOM 0 H GLU A 35 -6.148 -0.110 -1.901 1.00 0.00 H new ATOM 0 HA GLU A 35 -8.200 1.413 -3.204 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.191 1.258 -3.321 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.080 2.205 -4.497 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -7.182 3.419 -2.560 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.091 2.570 -1.483 1.00 0.00 H new ATOM 553 N ALA A 36 -7.100 -1.255 -4.595 1.00 0.00 N ATOM 554 CA ALA A 36 -7.190 -2.156 -5.727 1.00 0.00 C ATOM 555 C ALA A 36 -8.590 -2.737 -5.809 1.00 0.00 C ATOM 556 O ALA A 36 -9.255 -2.645 -6.841 1.00 0.00 O ATOM 557 CB ALA A 36 -6.159 -3.270 -5.608 1.00 0.00 C ATOM 0 H ALA A 36 -6.755 -1.695 -3.742 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.983 -1.597 -6.640 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.242 -3.936 -6.467 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.159 -2.838 -5.579 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.337 -3.834 -4.693 1.00 0.00 H new ATOM 563 N ARG A 37 -9.056 -3.310 -4.701 1.00 0.00 N ATOM 564 CA ARG A 37 -10.398 -3.865 -4.657 1.00 0.00 C ATOM 565 C ARG A 37 -11.378 -2.820 -5.107 1.00 0.00 C ATOM 566 O ARG A 37 -12.164 -3.021 -6.033 1.00 0.00 O ATOM 567 CB ARG A 37 -10.781 -4.261 -3.249 1.00 0.00 C ATOM 568 CG ARG A 37 -11.100 -5.737 -3.091 1.00 0.00 C ATOM 569 CD ARG A 37 -12.256 -6.155 -3.986 1.00 0.00 C ATOM 570 NE ARG A 37 -13.034 -7.247 -3.404 1.00 0.00 N ATOM 571 CZ ARG A 37 -12.674 -8.528 -3.462 1.00 0.00 C ATOM 572 NH1 ARG A 37 -11.548 -8.882 -4.069 1.00 0.00 N ATOM 573 NH2 ARG A 37 -13.442 -9.457 -2.910 1.00 0.00 N ATOM 0 H ARG A 37 -8.528 -3.399 -3.833 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.417 -4.742 -5.304 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.965 -4.001 -2.574 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -11.648 -3.677 -2.941 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -10.218 -6.329 -3.334 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -11.349 -5.947 -2.051 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.908 -5.299 -4.160 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -11.869 -6.463 -4.957 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.904 -7.014 -2.925 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -10.953 -8.171 -4.494 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -11.278 -9.865 -4.110 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -14.308 -9.191 -2.441 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -13.167 -10.438 -2.954 1.00 0.00 H new ATOM 587 N ARG A 38 -11.327 -1.699 -4.409 1.00 0.00 N ATOM 588 CA ARG A 38 -12.214 -0.604 -4.696 1.00 0.00 C ATOM 589 C ARG A 38 -11.996 -0.075 -6.118 1.00 0.00 C ATOM 590 O ARG A 38 -12.862 0.600 -6.675 1.00 0.00 O ATOM 591 CB ARG A 38 -12.022 0.522 -3.679 1.00 0.00 C ATOM 592 CG ARG A 38 -12.613 0.215 -2.312 1.00 0.00 C ATOM 593 CD ARG A 38 -12.129 1.202 -1.262 1.00 0.00 C ATOM 594 NE ARG A 38 -11.967 0.573 0.047 1.00 0.00 N ATOM 595 CZ ARG A 38 -12.978 0.300 0.869 1.00 0.00 C ATOM 596 NH1 ARG A 38 -14.224 0.598 0.522 1.00 0.00 N ATOM 597 NH2 ARG A 38 -12.743 -0.272 2.042 1.00 0.00 N ATOM 0 H ARG A 38 -10.678 -1.531 -3.641 1.00 0.00 H new ATOM 0 HA ARG A 38 -13.237 -0.974 -4.623 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -10.956 0.722 -3.568 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.479 1.432 -4.067 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -13.701 0.247 -2.369 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.339 -0.797 -2.015 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.178 1.631 -1.578 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.839 2.025 -1.183 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.024 0.329 0.349 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -14.411 1.039 -0.379 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.994 0.386 1.156 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -11.788 -0.503 2.315 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.518 -0.481 2.672 1.00 0.00 H new ATOM 611 N LEU A 39 -10.832 -0.382 -6.700 1.00 0.00 N ATOM 612 CA LEU A 39 -10.503 0.065 -8.049 1.00 0.00 C ATOM 613 C LEU A 39 -11.433 -0.585 -9.072 1.00 0.00 C ATOM 614 O LEU A 39 -11.617 -1.803 -9.078 1.00 0.00 O ATOM 615 CB LEU A 39 -9.015 -0.217 -8.351 1.00 0.00 C ATOM 616 CG LEU A 39 -8.716 -1.129 -9.538 1.00 0.00 C ATOM 617 CD1 LEU A 39 -8.410 -0.305 -10.777 1.00 0.00 C ATOM 618 CD2 LEU A 39 -7.577 -2.077 -9.200 1.00 0.00 C ATOM 0 H LEU A 39 -10.104 -0.939 -6.253 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.655 1.142 -8.119 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.516 0.737 -8.521 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.565 -0.658 -7.462 1.00 0.00 H new ATOM 0 HG LEU A 39 -9.598 -1.732 -9.753 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.199 -0.971 -11.614 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -9.269 0.321 -11.019 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.542 0.327 -10.589 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.374 -2.722 -10.055 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -6.683 -1.501 -8.960 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -7.856 -2.689 -8.342 1.00 0.00 H new ATOM 630 N ARG A 40 -12.027 0.242 -9.926 1.00 0.00 N ATOM 631 CA ARG A 40 -12.947 -0.240 -10.947 1.00 0.00 C ATOM 632 C ARG A 40 -13.234 0.854 -11.972 1.00 0.00 C ATOM 633 O ARG A 40 -14.382 1.073 -12.357 1.00 0.00 O ATOM 634 CB ARG A 40 -14.253 -0.709 -10.300 1.00 0.00 C ATOM 635 CG ARG A 40 -14.773 -2.025 -10.856 1.00 0.00 C ATOM 636 CD ARG A 40 -16.223 -2.261 -10.462 1.00 0.00 C ATOM 637 NE ARG A 40 -16.370 -2.496 -9.027 1.00 0.00 N ATOM 638 CZ ARG A 40 -16.152 -3.671 -8.441 1.00 0.00 C ATOM 639 NH1 ARG A 40 -15.774 -4.720 -9.160 1.00 0.00 N ATOM 640 NH2 ARG A 40 -16.311 -3.797 -7.130 1.00 0.00 N ATOM 0 H ARG A 40 -11.886 1.252 -9.930 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.482 -1.082 -11.460 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.099 -0.814 -9.226 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -15.013 0.060 -10.439 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -14.686 -2.022 -11.942 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -14.157 -2.846 -10.489 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -16.822 -1.398 -10.751 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -16.613 -3.118 -11.011 1.00 0.00 H new ATOM 0 HE ARG A 40 -16.657 -1.713 -8.440 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -15.649 -4.629 -10.168 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -15.609 -5.618 -8.705 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -16.600 -2.994 -6.572 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -16.144 -4.697 -6.680 1.00 0.00 H new ATOM 654 N ALA A 41 -12.179 1.539 -12.407 1.00 0.00 N ATOM 655 CA ALA A 41 -12.309 2.615 -13.384 1.00 0.00 C ATOM 656 C ALA A 41 -13.070 3.801 -12.797 1.00 0.00 C ATOM 657 O ALA A 41 -12.481 4.836 -12.487 1.00 0.00 O ATOM 658 CB ALA A 41 -12.996 2.111 -14.646 1.00 0.00 C ATOM 0 H ALA A 41 -11.223 1.367 -12.097 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.307 2.954 -13.646 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -13.084 2.927 -15.363 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.407 1.305 -15.084 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -13.990 1.739 -14.396 1.00 0.00 H new ATOM 664 N GLU A 42 -14.382 3.644 -12.649 1.00 0.00 N ATOM 665 CA GLU A 42 -15.220 4.700 -12.103 1.00 0.00 C ATOM 666 C GLU A 42 -15.110 4.755 -10.582 1.00 0.00 C ATOM 667 O GLU A 42 -15.270 3.742 -9.902 1.00 0.00 O ATOM 668 CB GLU A 42 -16.678 4.488 -12.515 1.00 0.00 C ATOM 669 CG GLU A 42 -17.014 5.060 -13.883 1.00 0.00 C ATOM 670 CD GLU A 42 -18.430 5.595 -13.959 1.00 0.00 C ATOM 671 OE1 GLU A 42 -19.347 4.805 -14.268 1.00 0.00 O ATOM 672 OE2 GLU A 42 -18.623 6.803 -13.711 1.00 0.00 O ATOM 0 H GLU A 42 -14.886 2.794 -12.901 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.870 5.650 -12.507 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -16.895 3.420 -12.514 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -17.328 4.946 -11.769 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -16.314 5.861 -14.120 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -16.881 4.286 -14.639 1.00 0.00 H new ATOM 679 N ARG A 43 -14.839 5.945 -10.056 1.00 0.00 N ATOM 680 CA ARG A 43 -14.712 6.132 -8.615 1.00 0.00 C ATOM 681 C ARG A 43 -15.089 7.556 -8.217 1.00 0.00 C ATOM 682 O ARG A 43 -14.502 8.523 -8.702 1.00 0.00 O ATOM 683 CB ARG A 43 -13.283 5.824 -8.162 1.00 0.00 C ATOM 684 CG ARG A 43 -12.231 6.697 -8.827 1.00 0.00 C ATOM 685 CD ARG A 43 -10.833 6.126 -8.643 1.00 0.00 C ATOM 686 NE ARG A 43 -9.943 7.065 -7.963 1.00 0.00 N ATOM 687 CZ ARG A 43 -9.338 8.085 -8.568 1.00 0.00 C ATOM 688 NH1 ARG A 43 -9.526 8.304 -9.863 1.00 0.00 N ATOM 689 NH2 ARG A 43 -8.544 8.889 -7.875 1.00 0.00 N ATOM 0 H ARG A 43 -14.703 6.794 -10.605 1.00 0.00 H new ATOM 0 HA ARG A 43 -15.397 5.442 -8.122 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -13.218 5.951 -7.081 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -13.061 4.778 -8.374 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -12.451 6.787 -9.891 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.273 7.702 -8.407 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -10.892 5.201 -8.069 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.415 5.870 -9.617 1.00 0.00 H new ATOM 0 HE ARG A 43 -9.775 6.931 -6.966 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.137 7.689 -10.401 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.060 9.087 -10.321 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -8.397 8.726 -6.879 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.080 9.671 -8.338 1.00 0.00 H new ATOM 703 N TRP A 44 -16.074 7.677 -7.332 1.00 0.00 N ATOM 704 CA TRP A 44 -16.531 8.983 -6.870 1.00 0.00 C ATOM 705 C TRP A 44 -16.084 9.243 -5.435 1.00 0.00 C ATOM 706 O TRP A 44 -15.457 8.392 -4.804 1.00 0.00 O ATOM 707 CB TRP A 44 -18.055 9.074 -6.965 1.00 0.00 C ATOM 708 CG TRP A 44 -18.544 9.476 -8.322 1.00 0.00 C ATOM 709 CD1 TRP A 44 -18.476 10.718 -8.883 1.00 0.00 C ATOM 710 CD2 TRP A 44 -19.177 8.631 -9.290 1.00 0.00 C ATOM 711 NE1 TRP A 44 -19.029 10.698 -10.141 1.00 0.00 N ATOM 712 CE2 TRP A 44 -19.466 9.429 -10.414 1.00 0.00 C ATOM 713 CE3 TRP A 44 -19.527 7.278 -9.317 1.00 0.00 C ATOM 714 CZ2 TRP A 44 -20.087 8.917 -11.550 1.00 0.00 C ATOM 715 CZ3 TRP A 44 -20.144 6.772 -10.445 1.00 0.00 C ATOM 716 CH2 TRP A 44 -20.419 7.589 -11.548 1.00 0.00 C ATOM 0 H TRP A 44 -16.571 6.887 -6.921 1.00 0.00 H new ATOM 0 HA TRP A 44 -16.086 9.743 -7.512 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -18.486 8.108 -6.703 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -18.415 9.793 -6.230 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -18.050 11.589 -8.408 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -19.102 11.498 -10.769 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -19.319 6.639 -8.471 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -20.299 9.545 -12.402 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -20.419 5.728 -10.476 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -20.903 7.163 -12.415 1.00 0.00 H new ATOM 727 N LYS A 45 -16.414 10.426 -4.926 1.00 0.00 N ATOM 728 CA LYS A 45 -16.050 10.802 -3.564 1.00 0.00 C ATOM 729 C LYS A 45 -16.762 12.087 -3.149 1.00 0.00 C ATOM 730 O LYS A 45 -17.715 12.055 -2.371 1.00 0.00 O ATOM 731 CB LYS A 45 -14.533 10.977 -3.448 1.00 0.00 C ATOM 732 CG LYS A 45 -13.916 10.185 -2.307 1.00 0.00 C ATOM 733 CD LYS A 45 -13.689 11.058 -1.082 1.00 0.00 C ATOM 734 CE LYS A 45 -12.368 11.805 -1.167 1.00 0.00 C ATOM 735 NZ LYS A 45 -12.482 13.196 -0.648 1.00 0.00 N ATOM 0 H LYS A 45 -16.933 11.141 -5.436 1.00 0.00 H new ATOM 0 HA LYS A 45 -16.364 10.002 -2.893 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -14.067 10.671 -4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -14.307 12.034 -3.310 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.569 9.352 -2.046 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -12.967 9.757 -2.631 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -14.507 11.772 -0.987 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -13.701 10.438 -0.185 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.609 11.267 -0.599 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.032 11.831 -2.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.560 13.671 -0.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -13.187 13.718 -1.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -12.778 13.171 0.349 1.00 0.00 H new ATOM 749 N VAL A 46 -16.294 13.215 -3.677 1.00 0.00 N ATOM 750 CA VAL A 46 -16.885 14.512 -3.365 1.00 0.00 C ATOM 751 C VAL A 46 -16.656 14.888 -1.903 1.00 0.00 C ATOM 752 O VAL A 46 -15.894 15.806 -1.601 1.00 0.00 O ATOM 753 CB VAL A 46 -18.397 14.529 -3.660 1.00 0.00 C ATOM 754 CG1 VAL A 46 -18.958 15.934 -3.500 1.00 0.00 C ATOM 755 CG2 VAL A 46 -18.673 13.993 -5.057 1.00 0.00 C ATOM 0 H VAL A 46 -15.506 13.256 -4.324 1.00 0.00 H new ATOM 0 HA VAL A 46 -16.391 15.244 -4.005 1.00 0.00 H new ATOM 0 HB VAL A 46 -18.896 13.880 -2.940 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -20.027 15.925 -3.713 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -18.794 16.277 -2.479 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -18.456 16.608 -4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -19.746 14.012 -5.249 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -18.162 14.614 -5.793 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -18.309 12.968 -5.132 1.00 0.00 H new ATOM 765 N GLU A 47 -17.322 14.174 -1.001 1.00 0.00 N ATOM 766 CA GLU A 47 -17.191 14.434 0.428 1.00 0.00 C ATOM 767 C GLU A 47 -17.647 13.226 1.242 1.00 0.00 C ATOM 768 O GLU A 47 -18.833 12.899 1.273 1.00 0.00 O ATOM 769 CB GLU A 47 -18.009 15.666 0.821 1.00 0.00 C ATOM 770 CG GLU A 47 -17.334 16.536 1.869 1.00 0.00 C ATOM 771 CD GLU A 47 -17.288 15.876 3.233 1.00 0.00 C ATOM 772 OE1 GLU A 47 -18.332 15.855 3.918 1.00 0.00 O ATOM 773 OE2 GLU A 47 -16.208 15.379 3.615 1.00 0.00 O ATOM 0 H GLU A 47 -17.958 13.411 -1.234 1.00 0.00 H new ATOM 0 HA GLU A 47 -16.139 14.621 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -18.198 16.265 -0.070 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -18.979 15.342 1.199 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.319 16.765 1.546 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -17.866 17.484 1.946 1.00 0.00 H new ATOM 780 N ASN A 48 -16.697 12.567 1.897 1.00 0.00 N ATOM 781 CA ASN A 48 -17.002 11.395 2.709 1.00 0.00 C ATOM 782 C ASN A 48 -16.388 11.519 4.100 1.00 0.00 C ATOM 783 O ASN A 48 -15.195 11.786 4.242 1.00 0.00 O ATOM 784 CB ASN A 48 -16.490 10.127 2.024 1.00 0.00 C ATOM 785 CG ASN A 48 -17.393 9.677 0.892 1.00 0.00 C ATOM 786 OD1 ASN A 48 -16.943 9.483 -0.237 1.00 0.00 O ATOM 787 ND2 ASN A 48 -18.676 9.510 1.190 1.00 0.00 N ATOM 0 H ASN A 48 -15.710 12.824 1.881 1.00 0.00 H new ATOM 0 HA ASN A 48 -18.085 11.331 2.815 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -15.487 10.306 1.636 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -16.409 9.327 2.760 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -19.332 9.209 0.469 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -19.006 9.682 2.140 1.00 0.00 H new ATOM 794 N GLN A 49 -17.213 11.321 5.124 1.00 0.00 N ATOM 795 CA GLN A 49 -16.754 11.409 6.506 1.00 0.00 C ATOM 796 C GLN A 49 -17.897 11.123 7.475 1.00 0.00 C ATOM 797 O GLN A 49 -18.817 11.928 7.618 1.00 0.00 O ATOM 798 CB GLN A 49 -16.169 12.794 6.786 1.00 0.00 C ATOM 799 CG GLN A 49 -17.114 13.935 6.443 1.00 0.00 C ATOM 800 CD GLN A 49 -17.318 14.894 7.600 1.00 0.00 C ATOM 801 OE1 GLN A 49 -17.197 14.514 8.765 1.00 0.00 O ATOM 802 NE2 GLN A 49 -17.631 16.145 7.283 1.00 0.00 N ATOM 0 H GLN A 49 -18.203 11.098 5.022 1.00 0.00 H new ATOM 0 HA GLN A 49 -15.977 10.659 6.653 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -15.901 12.860 7.841 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -15.248 12.912 6.215 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.720 14.483 5.587 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.078 13.525 6.142 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -17.721 16.416 6.304 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -17.782 16.835 8.019 1.00 0.00 H new ATOM 811 N GLU A 50 -17.835 9.971 8.136 1.00 0.00 N ATOM 812 CA GLU A 50 -18.870 9.583 9.088 1.00 0.00 C ATOM 813 C GLU A 50 -18.352 8.530 10.064 1.00 0.00 C ATOM 814 O GLU A 50 -18.079 7.393 9.679 1.00 0.00 O ATOM 815 CB GLU A 50 -20.097 9.048 8.348 1.00 0.00 C ATOM 816 CG GLU A 50 -19.762 8.037 7.264 1.00 0.00 C ATOM 817 CD GLU A 50 -19.244 8.689 5.998 1.00 0.00 C ATOM 818 OE1 GLU A 50 -19.862 9.674 5.542 1.00 0.00 O ATOM 819 OE2 GLU A 50 -18.219 8.217 5.463 1.00 0.00 O ATOM 0 H GLU A 50 -17.081 9.292 8.030 1.00 0.00 H new ATOM 0 HA GLU A 50 -19.152 10.469 9.657 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -20.772 8.585 9.068 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -20.634 9.884 7.900 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -19.014 7.340 7.641 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -20.652 7.453 7.029 1.00 0.00 H new ATOM 826 N GLY A 51 -18.226 8.917 11.329 1.00 0.00 N ATOM 827 CA GLY A 51 -17.748 7.995 12.344 1.00 0.00 C ATOM 828 C GLY A 51 -16.260 8.127 12.602 1.00 0.00 C ATOM 829 O GLY A 51 -15.787 7.828 13.698 1.00 0.00 O ATOM 0 H GLY A 51 -18.446 9.853 11.670 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.290 8.171 13.273 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.969 6.974 12.034 1.00 0.00 H new ATOM 833 N MET A 52 -15.521 8.576 11.591 1.00 0.00 N ATOM 834 CA MET A 52 -14.076 8.746 11.712 1.00 0.00 C ATOM 835 C MET A 52 -13.386 7.404 11.948 1.00 0.00 C ATOM 836 O MET A 52 -12.798 6.830 11.032 1.00 0.00 O ATOM 837 CB MET A 52 -13.745 9.718 12.848 1.00 0.00 C ATOM 838 CG MET A 52 -14.321 11.110 12.644 1.00 0.00 C ATOM 839 SD MET A 52 -16.028 11.243 13.208 1.00 0.00 S ATOM 840 CE MET A 52 -16.301 13.006 13.049 1.00 0.00 C ATOM 0 H MET A 52 -15.899 8.829 10.678 1.00 0.00 H new ATOM 0 HA MET A 52 -13.705 9.161 10.775 1.00 0.00 H new ATOM 0 HB2 MET A 52 -14.124 9.311 13.785 1.00 0.00 H new ATOM 0 HB3 MET A 52 -12.662 9.793 12.947 1.00 0.00 H new ATOM 0 HG2 MET A 52 -13.708 11.835 13.179 1.00 0.00 H new ATOM 0 HG3 MET A 52 -14.270 11.369 11.586 1.00 0.00 H new ATOM 0 HE1 MET A 52 -17.317 13.246 13.362 1.00 0.00 H new ATOM 0 HE2 MET A 52 -15.591 13.542 13.679 1.00 0.00 H new ATOM 0 HE3 MET A 52 -16.161 13.304 12.010 1.00 0.00 H new ATOM 850 N VAL A 53 -13.467 6.906 13.179 1.00 0.00 N ATOM 851 CA VAL A 53 -12.855 5.630 13.530 1.00 0.00 C ATOM 852 C VAL A 53 -13.923 4.585 13.841 1.00 0.00 C ATOM 853 O VAL A 53 -13.853 3.450 13.370 1.00 0.00 O ATOM 854 CB VAL A 53 -11.909 5.771 14.740 1.00 0.00 C ATOM 855 CG1 VAL A 53 -12.675 6.213 15.978 1.00 0.00 C ATOM 856 CG2 VAL A 53 -11.172 4.465 14.998 1.00 0.00 C ATOM 0 H VAL A 53 -13.951 7.367 13.949 1.00 0.00 H new ATOM 0 HA VAL A 53 -12.272 5.305 12.668 1.00 0.00 H new ATOM 0 HB VAL A 53 -11.172 6.540 14.508 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -11.987 6.305 16.818 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -13.148 7.177 15.789 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -13.440 5.474 16.216 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -10.509 4.584 15.855 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -11.894 3.675 15.204 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -10.584 4.199 14.119 1.00 0.00 H new ATOM 866 N GLU A 54 -14.917 4.983 14.629 1.00 0.00 N ATOM 867 CA GLU A 54 -16.010 4.091 14.997 1.00 0.00 C ATOM 868 C GLU A 54 -17.354 4.785 14.781 1.00 0.00 C ATOM 869 O GLU A 54 -17.932 4.706 13.697 1.00 0.00 O ATOM 870 CB GLU A 54 -15.864 3.637 16.452 1.00 0.00 C ATOM 871 CG GLU A 54 -15.059 2.357 16.612 1.00 0.00 C ATOM 872 CD GLU A 54 -15.890 1.111 16.377 1.00 0.00 C ATOM 873 OE1 GLU A 54 -16.580 0.671 17.320 1.00 0.00 O ATOM 874 OE2 GLU A 54 -15.850 0.575 15.250 1.00 0.00 O ATOM 0 H GLU A 54 -14.988 5.920 15.026 1.00 0.00 H new ATOM 0 HA GLU A 54 -15.970 3.208 14.359 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -15.386 4.431 17.025 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -16.856 3.488 16.879 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -14.223 2.369 15.913 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -14.635 2.322 17.616 1.00 0.00 H new ATOM 881 N VAL A 55 -17.845 5.477 15.809 1.00 0.00 N ATOM 882 CA VAL A 55 -19.106 6.190 15.719 1.00 0.00 C ATOM 883 C VAL A 55 -19.139 7.297 16.757 1.00 0.00 C ATOM 884 O VAL A 55 -20.204 7.704 17.222 1.00 0.00 O ATOM 885 CB VAL A 55 -20.318 5.258 15.939 1.00 0.00 C ATOM 886 CG1 VAL A 55 -21.361 5.477 14.856 1.00 0.00 C ATOM 887 CG2 VAL A 55 -19.884 3.800 15.984 1.00 0.00 C ATOM 0 H VAL A 55 -17.382 5.555 16.714 1.00 0.00 H new ATOM 0 HA VAL A 55 -19.177 6.604 14.713 1.00 0.00 H new ATOM 0 HB VAL A 55 -20.765 5.504 16.902 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -22.208 4.812 15.027 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -21.701 6.512 14.883 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -20.923 5.264 13.881 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -20.756 3.165 16.140 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -19.405 3.534 15.042 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -19.179 3.655 16.803 1.00 0.00 H new ATOM 897 N ALA A 56 -17.954 7.757 17.138 1.00 0.00 N ATOM 898 CA ALA A 56 -17.819 8.785 18.141 1.00 0.00 C ATOM 899 C ALA A 56 -16.373 9.207 18.196 1.00 0.00 C ATOM 900 O ALA A 56 -15.996 10.280 17.724 1.00 0.00 O ATOM 901 CB ALA A 56 -18.248 8.220 19.476 1.00 0.00 C ATOM 0 H ALA A 56 -17.068 7.424 16.758 1.00 0.00 H new ATOM 0 HA ALA A 56 -18.441 9.647 17.901 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -18.151 8.987 20.244 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -19.287 7.895 19.417 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -17.616 7.369 19.731 1.00 0.00 H new ATOM 907 N ARG A 57 -15.567 8.305 18.741 1.00 0.00 N ATOM 908 CA ARG A 57 -14.139 8.491 18.845 1.00 0.00 C ATOM 909 C ARG A 57 -13.565 7.608 19.950 1.00 0.00 C ATOM 910 O ARG A 57 -14.010 7.671 21.096 1.00 0.00 O ATOM 911 CB ARG A 57 -13.763 9.955 19.101 1.00 0.00 C ATOM 912 CG ARG A 57 -14.594 10.617 20.190 1.00 0.00 C ATOM 913 CD ARG A 57 -14.999 12.030 19.803 1.00 0.00 C ATOM 914 NE ARG A 57 -15.007 12.932 20.952 1.00 0.00 N ATOM 915 CZ ARG A 57 -15.179 14.248 20.861 1.00 0.00 C ATOM 916 NH1 ARG A 57 -15.358 14.820 19.676 1.00 0.00 N ATOM 917 NH2 ARG A 57 -15.173 14.996 21.956 1.00 0.00 N ATOM 0 H ARG A 57 -15.896 7.419 19.124 1.00 0.00 H new ATOM 0 HA ARG A 57 -13.709 8.201 17.887 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -12.710 10.008 19.377 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -13.878 10.518 18.175 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -15.487 10.021 20.380 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -14.024 10.643 21.119 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -14.311 12.410 19.048 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -15.990 12.012 19.350 1.00 0.00 H new ATOM 0 HE ARG A 57 -14.873 12.529 21.879 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -15.364 14.250 18.830 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -15.489 15.829 19.612 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -15.036 14.562 22.869 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -15.305 16.005 21.885 1.00 0.00 H new ATOM 931 N PHE A 58 -12.581 6.784 19.604 1.00 0.00 N ATOM 932 CA PHE A 58 -11.962 5.894 20.580 1.00 0.00 C ATOM 933 C PHE A 58 -10.433 5.933 20.475 1.00 0.00 C ATOM 934 O PHE A 58 -9.798 6.847 21.001 1.00 0.00 O ATOM 935 CB PHE A 58 -12.487 4.466 20.399 1.00 0.00 C ATOM 936 CG PHE A 58 -13.952 4.325 20.702 1.00 0.00 C ATOM 937 CD1 PHE A 58 -14.902 4.873 19.856 1.00 0.00 C ATOM 938 CD2 PHE A 58 -14.378 3.645 21.832 1.00 0.00 C ATOM 939 CE1 PHE A 58 -16.251 4.746 20.131 1.00 0.00 C ATOM 940 CE2 PHE A 58 -15.725 3.515 22.112 1.00 0.00 C ATOM 941 CZ PHE A 58 -16.662 4.066 21.261 1.00 0.00 C ATOM 0 H PHE A 58 -12.197 6.714 18.662 1.00 0.00 H new ATOM 0 HA PHE A 58 -12.231 6.240 21.578 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -12.304 4.147 19.373 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -11.923 3.795 21.047 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.585 5.406 18.971 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -13.649 3.212 22.501 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -16.982 5.178 19.464 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -16.044 2.983 22.996 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.715 3.966 21.478 1.00 0.00 H new ATOM 951 N ILE A 59 -9.843 4.945 19.801 1.00 0.00 N ATOM 952 CA ILE A 59 -8.394 4.887 19.646 1.00 0.00 C ATOM 953 C ILE A 59 -7.700 4.834 21.004 1.00 0.00 C ATOM 954 O ILE A 59 -8.277 5.214 22.023 1.00 0.00 O ATOM 955 CB ILE A 59 -7.863 6.099 18.855 1.00 0.00 C ATOM 956 CG1 ILE A 59 -8.654 6.276 17.557 1.00 0.00 C ATOM 957 CG2 ILE A 59 -6.379 5.932 18.560 1.00 0.00 C ATOM 958 CD1 ILE A 59 -9.622 7.439 17.593 1.00 0.00 C ATOM 0 H ILE A 59 -10.347 4.178 19.356 1.00 0.00 H new ATOM 0 HA ILE A 59 -8.170 3.976 19.090 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.993 6.995 19.462 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.956 6.420 16.732 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -9.207 5.360 17.350 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.020 6.796 18.001 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.828 5.852 19.497 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -6.225 5.029 17.970 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -10.148 7.504 16.640 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -10.343 7.287 18.396 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -9.073 8.364 17.769 1.00 0.00 H new ATOM 970 N GLU A 60 -6.458 4.359 21.013 1.00 0.00 N ATOM 971 CA GLU A 60 -5.691 4.257 22.249 1.00 0.00 C ATOM 972 C GLU A 60 -4.263 4.754 22.047 1.00 0.00 C ATOM 973 O GLU A 60 -3.560 4.302 21.144 1.00 0.00 O ATOM 974 CB GLU A 60 -5.674 2.811 22.748 1.00 0.00 C ATOM 975 CG GLU A 60 -5.129 1.822 21.730 1.00 0.00 C ATOM 976 CD GLU A 60 -5.997 0.587 21.593 1.00 0.00 C ATOM 977 OE1 GLU A 60 -6.779 0.304 22.526 1.00 0.00 O ATOM 978 OE2 GLU A 60 -5.896 -0.098 20.553 1.00 0.00 O ATOM 0 H GLU A 60 -5.963 4.040 20.180 1.00 0.00 H new ATOM 0 HA GLU A 60 -6.173 4.886 22.997 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -5.072 2.755 23.655 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.688 2.518 23.020 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -5.047 2.313 20.760 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -4.122 1.523 22.022 1.00 0.00 H new ATOM 985 N MET A 61 -3.842 5.687 22.896 1.00 0.00 N ATOM 986 CA MET A 61 -2.498 6.246 22.812 1.00 0.00 C ATOM 987 C MET A 61 -1.705 5.947 24.081 1.00 0.00 C ATOM 988 O MET A 61 -2.172 6.199 25.191 1.00 0.00 O ATOM 989 CB MET A 61 -2.565 7.757 22.584 1.00 0.00 C ATOM 990 CG MET A 61 -3.057 8.141 21.197 1.00 0.00 C ATOM 991 SD MET A 61 -4.692 8.902 21.222 1.00 0.00 S ATOM 992 CE MET A 61 -4.368 10.428 20.342 1.00 0.00 C ATOM 0 H MET A 61 -4.412 6.071 23.649 1.00 0.00 H new ATOM 0 HA MET A 61 -1.989 5.780 21.968 1.00 0.00 H new ATOM 0 HB2 MET A 61 -3.225 8.200 23.330 1.00 0.00 H new ATOM 0 HB3 MET A 61 -1.574 8.184 22.740 1.00 0.00 H new ATOM 0 HG2 MET A 61 -2.347 8.832 20.743 1.00 0.00 H new ATOM 0 HG3 MET A 61 -3.085 7.252 20.567 1.00 0.00 H new ATOM 0 HE1 MET A 61 -5.286 11.011 20.275 1.00 0.00 H new ATOM 0 HE2 MET A 61 -3.612 11.003 20.876 1.00 0.00 H new ATOM 0 HE3 MET A 61 -4.009 10.200 19.338 1.00 0.00 H new ATOM 1002 N ASN A 62 -0.503 5.407 23.907 1.00 0.00 N ATOM 1003 CA ASN A 62 0.355 5.072 25.038 1.00 0.00 C ATOM 1004 C ASN A 62 1.225 6.262 25.434 1.00 0.00 C ATOM 1005 O ASN A 62 1.599 6.409 26.597 1.00 0.00 O ATOM 1006 CB ASN A 62 1.238 3.870 24.696 1.00 0.00 C ATOM 1007 CG ASN A 62 1.379 2.908 25.859 1.00 0.00 C ATOM 1008 OD1 ASN A 62 0.713 1.873 25.908 1.00 0.00 O ATOM 1009 ND2 ASN A 62 2.249 3.244 26.804 1.00 0.00 N ATOM 0 H ASN A 62 -0.101 5.192 22.994 1.00 0.00 H new ATOM 0 HA ASN A 62 -0.284 4.816 25.883 1.00 0.00 H new ATOM 0 HB2 ASN A 62 0.814 3.343 23.841 1.00 0.00 H new ATOM 0 HB3 ASN A 62 2.225 4.221 24.397 1.00 0.00 H new ATOM 0 HD21 ASN A 62 2.386 2.635 27.611 1.00 0.00 H new ATOM 0 HD22 ASN A 62 2.780 4.111 26.723 1.00 0.00 H new ATOM 1016 N GLY A 63 1.542 7.108 24.459 1.00 0.00 N ATOM 1017 CA GLY A 63 2.365 8.273 24.728 1.00 0.00 C ATOM 1018 C GLY A 63 3.291 8.608 23.575 1.00 0.00 C ATOM 1019 O GLY A 63 2.850 9.120 22.546 1.00 0.00 O ATOM 0 H GLY A 63 1.244 7.008 23.489 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.722 9.129 24.934 1.00 0.00 H new ATOM 0 HA3 GLY A 63 2.957 8.096 25.626 1.00 0.00 H new ATOM 1023 N SER A 64 4.577 8.320 23.749 1.00 0.00 N ATOM 1024 CA SER A 64 5.567 8.595 22.715 1.00 0.00 C ATOM 1025 C SER A 64 6.665 7.536 22.716 1.00 0.00 C ATOM 1026 O SER A 64 7.706 7.706 23.351 1.00 0.00 O ATOM 1027 CB SER A 64 6.180 9.981 22.922 1.00 0.00 C ATOM 1028 OG SER A 64 5.475 10.965 22.185 1.00 0.00 O ATOM 0 H SER A 64 4.957 7.897 24.596 1.00 0.00 H new ATOM 0 HA SER A 64 5.063 8.568 21.749 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.164 10.235 23.982 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.225 9.970 22.613 1.00 0.00 H new ATOM 0 HG SER A 64 4.545 10.680 22.065 1.00 0.00 H new ATOM 1034 N PHE A 65 6.426 6.442 22.000 1.00 0.00 N ATOM 1035 CA PHE A 65 7.394 5.354 21.916 1.00 0.00 C ATOM 1036 C PHE A 65 7.947 5.227 20.501 1.00 0.00 C ATOM 1037 O PHE A 65 7.191 5.135 19.534 1.00 0.00 O ATOM 1038 CB PHE A 65 6.748 4.035 22.344 1.00 0.00 C ATOM 1039 CG PHE A 65 6.528 3.925 23.826 1.00 0.00 C ATOM 1040 CD1 PHE A 65 5.775 4.874 24.499 1.00 0.00 C ATOM 1041 CD2 PHE A 65 7.073 2.874 24.544 1.00 0.00 C ATOM 1042 CE1 PHE A 65 5.570 4.775 25.863 1.00 0.00 C ATOM 1043 CE2 PHE A 65 6.872 2.770 25.907 1.00 0.00 C ATOM 1044 CZ PHE A 65 6.119 3.721 26.567 1.00 0.00 C ATOM 0 H PHE A 65 5.569 6.285 21.469 1.00 0.00 H new ATOM 0 HA PHE A 65 8.219 5.582 22.590 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.791 3.927 21.834 1.00 0.00 H new ATOM 0 HB3 PHE A 65 7.379 3.208 22.017 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.344 5.700 23.952 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.662 2.127 24.033 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.982 5.521 26.377 1.00 0.00 H new ATOM 0 HE2 PHE A 65 7.303 1.946 26.456 1.00 0.00 H new ATOM 0 HZ PHE A 65 5.960 3.641 27.632 1.00 0.00 H new ATOM 1054 N ALA A 66 9.272 5.223 20.385 1.00 0.00 N ATOM 1055 CA ALA A 66 9.923 5.108 19.087 1.00 0.00 C ATOM 1056 C ALA A 66 9.771 3.692 18.521 1.00 0.00 C ATOM 1057 O ALA A 66 8.678 3.299 18.113 1.00 0.00 O ATOM 1058 CB ALA A 66 11.388 5.511 19.197 1.00 0.00 C ATOM 0 H ALA A 66 9.914 5.298 21.174 1.00 0.00 H new ATOM 0 HA ALA A 66 9.435 5.789 18.390 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.864 5.421 18.221 1.00 0.00 H new ATOM 0 HB2 ALA A 66 11.457 6.543 19.541 1.00 0.00 H new ATOM 0 HB3 ALA A 66 11.893 4.857 19.909 1.00 0.00 H new ATOM 1064 N ASP A 67 10.864 2.927 18.496 1.00 0.00 N ATOM 1065 CA ASP A 67 10.832 1.561 17.977 1.00 0.00 C ATOM 1066 C ASP A 67 12.238 0.972 17.919 1.00 0.00 C ATOM 1067 O ASP A 67 12.594 0.275 16.969 1.00 0.00 O ATOM 1068 CB ASP A 67 10.186 1.535 16.587 1.00 0.00 C ATOM 1069 CG ASP A 67 8.943 0.668 16.545 1.00 0.00 C ATOM 1070 OD1 ASP A 67 7.873 1.142 16.980 1.00 0.00 O ATOM 1071 OD2 ASP A 67 9.040 -0.487 16.078 1.00 0.00 O ATOM 0 H ASP A 67 11.779 3.230 18.828 1.00 0.00 H new ATOM 0 HA ASP A 67 10.233 0.951 18.653 1.00 0.00 H new ATOM 0 HB2 ASP A 67 9.927 2.551 16.290 1.00 0.00 H new ATOM 0 HB3 ASP A 67 10.909 1.165 15.860 1.00 0.00 H new ATOM 1076 N GLU A 68 13.033 1.256 18.947 1.00 0.00 N ATOM 1077 CA GLU A 68 14.401 0.757 19.019 1.00 0.00 C ATOM 1078 C GLU A 68 14.793 0.462 20.464 1.00 0.00 C ATOM 1079 O GLU A 68 14.366 1.155 21.387 1.00 0.00 O ATOM 1080 CB GLU A 68 15.370 1.773 18.408 1.00 0.00 C ATOM 1081 CG GLU A 68 15.882 1.373 17.034 1.00 0.00 C ATOM 1082 CD GLU A 68 16.820 0.184 17.085 1.00 0.00 C ATOM 1083 OE1 GLU A 68 17.964 0.349 17.559 1.00 0.00 O ATOM 1084 OE2 GLU A 68 16.412 -0.914 16.651 1.00 0.00 O ATOM 0 H GLU A 68 12.752 1.830 19.742 1.00 0.00 H new ATOM 0 HA GLU A 68 14.456 -0.171 18.450 1.00 0.00 H new ATOM 0 HB2 GLU A 68 14.871 2.739 18.334 1.00 0.00 H new ATOM 0 HB3 GLU A 68 16.219 1.903 19.080 1.00 0.00 H new ATOM 0 HG2 GLU A 68 15.035 1.136 16.390 1.00 0.00 H new ATOM 0 HG3 GLU A 68 16.399 2.220 16.582 1.00 0.00 H new ATOM 1091 N ASN A 69 15.608 -0.571 20.652 1.00 0.00 N ATOM 1092 CA ASN A 69 16.056 -0.958 21.985 1.00 0.00 C ATOM 1093 C ASN A 69 17.338 -0.223 22.367 1.00 0.00 C ATOM 1094 O ASN A 69 17.606 0.005 23.547 1.00 0.00 O ATOM 1095 CB ASN A 69 16.283 -2.469 22.051 1.00 0.00 C ATOM 1096 CG ASN A 69 17.360 -2.935 21.091 1.00 0.00 C ATOM 1097 OD1 ASN A 69 17.617 -2.296 20.071 1.00 0.00 O ATOM 1098 ND2 ASN A 69 17.996 -4.055 21.414 1.00 0.00 N ATOM 0 H ASN A 69 15.971 -1.155 19.899 1.00 0.00 H new ATOM 0 HA ASN A 69 15.276 -0.682 22.695 1.00 0.00 H new ATOM 0 HB2 ASN A 69 16.561 -2.748 23.067 1.00 0.00 H new ATOM 0 HB3 ASN A 69 15.350 -2.984 21.823 1.00 0.00 H new ATOM 0 HD21 ASN A 69 18.730 -4.418 20.806 1.00 0.00 H new ATOM 0 HD22 ASN A 69 17.750 -4.552 22.270 1.00 0.00 H new ATOM 1105 N LYS A 70 18.128 0.145 21.362 1.00 0.00 N ATOM 1106 CA LYS A 70 19.382 0.853 21.594 1.00 0.00 C ATOM 1107 C LYS A 70 20.342 0.004 22.421 1.00 0.00 C ATOM 1108 O LYS A 70 20.017 -1.117 22.811 1.00 0.00 O ATOM 1109 CB LYS A 70 19.120 2.184 22.302 1.00 0.00 C ATOM 1110 CG LYS A 70 18.375 3.193 21.444 1.00 0.00 C ATOM 1111 CD LYS A 70 17.932 4.398 22.259 1.00 0.00 C ATOM 1112 CE LYS A 70 18.832 5.599 22.014 1.00 0.00 C ATOM 1113 NZ LYS A 70 19.838 5.770 23.099 1.00 0.00 N ATOM 0 H LYS A 70 17.921 -0.036 20.380 1.00 0.00 H new ATOM 0 HA LYS A 70 19.842 1.050 20.626 1.00 0.00 H new ATOM 0 HB2 LYS A 70 18.546 1.997 23.209 1.00 0.00 H new ATOM 0 HB3 LYS A 70 20.072 2.615 22.611 1.00 0.00 H new ATOM 0 HG2 LYS A 70 19.017 3.521 20.627 1.00 0.00 H new ATOM 0 HG3 LYS A 70 17.504 2.717 20.994 1.00 0.00 H new ATOM 0 HD2 LYS A 70 16.904 4.654 22.002 1.00 0.00 H new ATOM 0 HD3 LYS A 70 17.942 4.145 23.319 1.00 0.00 H new ATOM 0 HE2 LYS A 70 19.344 5.480 21.059 1.00 0.00 H new ATOM 0 HE3 LYS A 70 18.223 6.500 21.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 20.432 6.599 22.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 19.350 5.909 24.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 20.436 4.921 23.155 1.00 0.00 H new ATOM 1127 N ASP A 71 21.526 0.547 22.684 1.00 0.00 N ATOM 1128 CA ASP A 71 22.535 -0.161 23.464 1.00 0.00 C ATOM 1129 C ASP A 71 22.433 0.202 24.942 1.00 0.00 C ATOM 1130 O ASP A 71 21.920 1.263 25.298 1.00 0.00 O ATOM 1131 CB ASP A 71 23.935 0.167 22.943 1.00 0.00 C ATOM 1132 CG ASP A 71 24.961 -0.876 23.342 1.00 0.00 C ATOM 1133 OD1 ASP A 71 24.792 -2.052 22.957 1.00 0.00 O ATOM 1134 OD2 ASP A 71 25.932 -0.516 24.040 1.00 0.00 O ATOM 0 H ASP A 71 21.810 1.474 22.369 1.00 0.00 H new ATOM 0 HA ASP A 71 22.356 -1.231 23.357 1.00 0.00 H new ATOM 0 HB2 ASP A 71 23.906 0.246 21.856 1.00 0.00 H new ATOM 0 HB3 ASP A 71 24.243 1.140 23.325 1.00 0.00 H new ATOM 1139 N TRP A 72 22.926 -0.686 25.799 1.00 0.00 N ATOM 1140 CA TRP A 72 22.891 -0.460 27.240 1.00 0.00 C ATOM 1141 C TRP A 72 23.952 -1.298 27.947 1.00 0.00 C ATOM 1142 O TRP A 72 23.754 -2.525 28.063 1.00 0.00 O ATOM 1143 CB TRP A 72 21.506 -0.794 27.796 1.00 0.00 C ATOM 1144 CG TRP A 72 21.292 -0.298 29.194 1.00 0.00 C ATOM 1145 CD1 TRP A 72 22.093 -0.526 30.276 1.00 0.00 C ATOM 1146 CD2 TRP A 72 20.206 0.510 29.660 1.00 0.00 C ATOM 1147 NE1 TRP A 72 21.570 0.091 31.387 1.00 0.00 N ATOM 1148 CE2 TRP A 72 20.412 0.733 31.035 1.00 0.00 C ATOM 1149 CE3 TRP A 72 19.079 1.067 29.049 1.00 0.00 C ATOM 1150 CZ2 TRP A 72 19.533 1.489 31.806 1.00 0.00 C ATOM 1151 CZ3 TRP A 72 18.207 1.817 29.816 1.00 0.00 C ATOM 1152 CH2 TRP A 72 18.439 2.022 31.182 1.00 0.00 C ATOM 1153 OXT TRP A 72 24.971 -0.719 28.379 1.00 0.00 O ATOM 0 H TRP A 72 23.355 -1.569 25.521 1.00 0.00 H new ATOM 0 HA TRP A 72 23.104 0.593 27.423 1.00 0.00 H new ATOM 0 HB2 TRP A 72 20.747 -0.361 27.144 1.00 0.00 H new ATOM 0 HB3 TRP A 72 21.365 -1.875 27.776 1.00 0.00 H new ATOM 0 HD1 TRP A 72 23.004 -1.106 30.261 1.00 0.00 H new ATOM 0 HE1 TRP A 72 21.978 0.074 32.322 1.00 0.00 H new ATOM 0 HE3 TRP A 72 18.893 0.914 27.996 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 19.709 1.649 32.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 17.333 2.252 29.354 1.00 0.00 H new ATOM 0 HH2 TRP A 72 17.739 2.613 31.754 1.00 0.00 H new TER 1164 TRP A 72 ATOM 1165 N MET B 101 21.580 9.593 3.506 1.00 0.00 N ATOM 1166 CA MET B 101 21.189 10.227 2.220 1.00 0.00 C ATOM 1167 C MET B 101 19.768 9.838 1.824 1.00 0.00 C ATOM 1168 O MET B 101 18.872 10.681 1.783 1.00 0.00 O ATOM 1169 CB MET B 101 22.178 9.787 1.139 1.00 0.00 C ATOM 1170 CG MET B 101 22.022 10.538 -0.173 1.00 0.00 C ATOM 1171 SD MET B 101 22.653 9.610 -1.584 1.00 0.00 S ATOM 1172 CE MET B 101 21.214 9.594 -2.650 1.00 0.00 C ATOM 0 HA MET B 101 21.213 11.311 2.333 1.00 0.00 H new ATOM 0 HB2 MET B 101 23.194 9.927 1.509 1.00 0.00 H new ATOM 0 HB3 MET B 101 22.050 8.720 0.954 1.00 0.00 H new ATOM 0 HG2 MET B 101 20.968 10.765 -0.334 1.00 0.00 H new ATOM 0 HG3 MET B 101 22.546 11.491 -0.106 1.00 0.00 H new ATOM 0 HE1 MET B 101 21.458 9.085 -3.582 1.00 0.00 H new ATOM 0 HE2 MET B 101 20.398 9.069 -2.152 1.00 0.00 H new ATOM 0 HE3 MET B 101 20.909 10.618 -2.865 1.00 0.00 H new ATOM 1184 N LYS B 102 19.569 8.557 1.532 1.00 0.00 N ATOM 1185 CA LYS B 102 18.256 8.057 1.139 1.00 0.00 C ATOM 1186 C LYS B 102 18.044 6.633 1.642 1.00 0.00 C ATOM 1187 O LYS B 102 19.005 5.918 1.927 1.00 0.00 O ATOM 1188 CB LYS B 102 18.106 8.099 -0.382 1.00 0.00 C ATOM 1189 CG LYS B 102 17.839 9.492 -0.927 1.00 0.00 C ATOM 1190 CD LYS B 102 16.499 10.027 -0.449 1.00 0.00 C ATOM 1191 CE LYS B 102 15.805 10.837 -1.532 1.00 0.00 C ATOM 1192 NZ LYS B 102 14.322 10.741 -1.432 1.00 0.00 N ATOM 0 H LYS B 102 20.300 7.846 1.560 1.00 0.00 H new ATOM 0 HA LYS B 102 17.500 8.700 1.590 1.00 0.00 H new ATOM 0 HB2 LYS B 102 19.014 7.706 -0.840 1.00 0.00 H new ATOM 0 HB3 LYS B 102 17.290 7.440 -0.677 1.00 0.00 H new ATOM 0 HG2 LYS B 102 18.635 10.166 -0.612 1.00 0.00 H new ATOM 0 HG3 LYS B 102 17.855 9.467 -2.017 1.00 0.00 H new ATOM 0 HD2 LYS B 102 15.860 9.196 -0.149 1.00 0.00 H new ATOM 0 HD3 LYS B 102 16.648 10.649 0.433 1.00 0.00 H new ATOM 0 HE2 LYS B 102 16.107 11.881 -1.454 1.00 0.00 H new ATOM 0 HE3 LYS B 102 16.127 10.484 -2.512 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 13.948 10.259 -2.274 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 14.066 10.201 -0.581 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 13.916 11.696 -1.371 1.00 0.00 H new ATOM 1206 N GLN B 103 16.782 6.219 1.744 1.00 0.00 N ATOM 1207 CA GLN B 103 16.459 4.880 2.205 1.00 0.00 C ATOM 1208 C GLN B 103 15.654 4.149 1.143 1.00 0.00 C ATOM 1209 O GLN B 103 14.573 4.590 0.765 1.00 0.00 O ATOM 1210 CB GLN B 103 15.669 4.946 3.515 1.00 0.00 C ATOM 1211 CG GLN B 103 15.123 3.602 3.961 1.00 0.00 C ATOM 1212 CD GLN B 103 15.567 3.222 5.360 1.00 0.00 C ATOM 1213 OE1 GLN B 103 16.001 4.072 6.138 1.00 0.00 O ATOM 1214 NE2 GLN B 103 15.461 1.940 5.686 1.00 0.00 N ATOM 0 H GLN B 103 15.972 6.794 1.513 1.00 0.00 H new ATOM 0 HA GLN B 103 17.386 4.335 2.386 1.00 0.00 H new ATOM 0 HB2 GLN B 103 16.313 5.346 4.298 1.00 0.00 H new ATOM 0 HB3 GLN B 103 14.841 5.644 3.396 1.00 0.00 H new ATOM 0 HG2 GLN B 103 14.034 3.627 3.925 1.00 0.00 H new ATOM 0 HG3 GLN B 103 15.447 2.833 3.260 1.00 0.00 H new ATOM 0 HE21 GLN B 103 15.096 1.270 5.009 1.00 0.00 H new ATOM 0 HE22 GLN B 103 15.745 1.624 6.614 1.00 0.00 H new ATOM 1223 N ARG B 104 16.186 3.038 0.656 1.00 0.00 N ATOM 1224 CA ARG B 104 15.504 2.274 -0.374 1.00 0.00 C ATOM 1225 C ARG B 104 14.617 1.190 0.213 1.00 0.00 C ATOM 1226 O ARG B 104 15.093 0.120 0.592 1.00 0.00 O ATOM 1227 CB ARG B 104 16.507 1.637 -1.331 1.00 0.00 C ATOM 1228 CG ARG B 104 15.943 1.396 -2.722 1.00 0.00 C ATOM 1229 CD ARG B 104 17.037 1.021 -3.708 1.00 0.00 C ATOM 1230 NE ARG B 104 16.798 1.588 -5.033 1.00 0.00 N ATOM 1231 CZ ARG B 104 17.740 1.714 -5.966 1.00 0.00 C ATOM 1232 NH1 ARG B 104 18.982 1.315 -5.723 1.00 0.00 N ATOM 1233 NH2 ARG B 104 17.438 2.241 -7.145 1.00 0.00 N ATOM 0 H ARG B 104 17.080 2.649 0.955 1.00 0.00 H new ATOM 0 HA ARG B 104 14.873 2.977 -0.918 1.00 0.00 H new ATOM 0 HB2 ARG B 104 17.383 2.280 -1.409 1.00 0.00 H new ATOM 0 HB3 ARG B 104 16.844 0.688 -0.914 1.00 0.00 H new ATOM 0 HG2 ARG B 104 15.199 0.600 -2.682 1.00 0.00 H new ATOM 0 HG3 ARG B 104 15.431 2.293 -3.069 1.00 0.00 H new ATOM 0 HD2 ARG B 104 17.999 1.370 -3.332 1.00 0.00 H new ATOM 0 HD3 ARG B 104 17.100 -0.065 -3.784 1.00 0.00 H new ATOM 0 HE ARG B 104 15.855 1.906 -5.257 1.00 0.00 H new ATOM 0 HH11 ARG B 104 19.219 0.909 -4.818 1.00 0.00 H new ATOM 0 HH12 ARG B 104 19.699 1.414 -6.441 1.00 0.00 H new ATOM 0 HH21 ARG B 104 16.485 2.549 -7.337 1.00 0.00 H new ATOM 0 HH22 ARG B 104 18.159 2.338 -7.860 1.00 0.00 H new ATOM 1247 N ILE B 105 13.320 1.453 0.236 1.00 0.00 N ATOM 1248 CA ILE B 105 12.365 0.474 0.720 1.00 0.00 C ATOM 1249 C ILE B 105 11.859 -0.286 -0.489 1.00 0.00 C ATOM 1250 O ILE B 105 11.175 0.275 -1.343 1.00 0.00 O ATOM 1251 CB ILE B 105 11.200 1.132 1.517 1.00 0.00 C ATOM 1252 CG1 ILE B 105 9.910 1.260 0.681 1.00 0.00 C ATOM 1253 CG2 ILE B 105 11.638 2.496 2.026 1.00 0.00 C ATOM 1254 CD1 ILE B 105 8.697 1.678 1.491 1.00 0.00 C ATOM 0 H ILE B 105 12.908 2.333 -0.074 1.00 0.00 H new ATOM 0 HA ILE B 105 12.847 -0.203 1.425 1.00 0.00 H new ATOM 0 HB ILE B 105 10.966 0.480 2.358 1.00 0.00 H new ATOM 0 HG12 ILE B 105 10.073 1.988 -0.114 1.00 0.00 H new ATOM 0 HG13 ILE B 105 9.703 0.304 0.200 1.00 0.00 H new ATOM 0 HG21 ILE B 105 10.822 2.956 2.584 1.00 0.00 H new ATOM 0 HG22 ILE B 105 12.503 2.380 2.679 1.00 0.00 H new ATOM 0 HG23 ILE B 105 11.903 3.132 1.181 1.00 0.00 H new ATOM 0 HD11 ILE B 105 7.828 1.747 0.836 1.00 0.00 H new ATOM 0 HD12 ILE B 105 8.507 0.939 2.269 1.00 0.00 H new ATOM 0 HD13 ILE B 105 8.883 2.649 1.950 1.00 0.00 H new ATOM 1266 N THR B 106 12.255 -1.542 -0.603 1.00 0.00 N ATOM 1267 CA THR B 106 11.879 -2.326 -1.763 1.00 0.00 C ATOM 1268 C THR B 106 10.969 -3.484 -1.425 1.00 0.00 C ATOM 1269 O THR B 106 11.385 -4.492 -0.853 1.00 0.00 O ATOM 1270 CB THR B 106 13.128 -2.817 -2.490 1.00 0.00 C ATOM 1271 OG1 THR B 106 12.832 -3.914 -3.339 1.00 0.00 O ATOM 1272 CG2 THR B 106 14.249 -3.236 -1.562 1.00 0.00 C ATOM 0 H THR B 106 12.828 -2.034 0.083 1.00 0.00 H new ATOM 0 HA THR B 106 11.309 -1.669 -2.420 1.00 0.00 H new ATOM 0 HB THR B 106 13.466 -1.958 -3.069 1.00 0.00 H new ATOM 0 HG1 THR B 106 12.940 -4.751 -2.841 1.00 0.00 H new ATOM 0 HG21 THR B 106 15.102 -3.573 -2.151 1.00 0.00 H new ATOM 0 HG22 THR B 106 14.546 -2.388 -0.944 1.00 0.00 H new ATOM 0 HG23 THR B 106 13.907 -4.049 -0.922 1.00 0.00 H new ATOM 1280 N VAL B 107 9.733 -3.338 -1.853 1.00 0.00 N ATOM 1281 CA VAL B 107 8.730 -4.372 -1.682 1.00 0.00 C ATOM 1282 C VAL B 107 8.581 -5.121 -2.996 1.00 0.00 C ATOM 1283 O VAL B 107 7.671 -4.842 -3.770 1.00 0.00 O ATOM 1284 CB VAL B 107 7.356 -3.800 -1.235 1.00 0.00 C ATOM 1285 CG1 VAL B 107 6.940 -2.617 -2.099 1.00 0.00 C ATOM 1286 CG2 VAL B 107 6.272 -4.879 -1.244 1.00 0.00 C ATOM 0 H VAL B 107 9.394 -2.502 -2.329 1.00 0.00 H new ATOM 0 HA VAL B 107 9.062 -5.043 -0.889 1.00 0.00 H new ATOM 0 HB VAL B 107 7.472 -3.447 -0.210 1.00 0.00 H new ATOM 0 HG11 VAL B 107 5.975 -2.240 -1.760 1.00 0.00 H new ATOM 0 HG12 VAL B 107 7.687 -1.827 -2.018 1.00 0.00 H new ATOM 0 HG13 VAL B 107 6.860 -2.936 -3.138 1.00 0.00 H new ATOM 0 HG21 VAL B 107 5.324 -4.445 -0.926 1.00 0.00 H new ATOM 0 HG22 VAL B 107 6.167 -5.281 -2.252 1.00 0.00 H new ATOM 0 HG23 VAL B 107 6.551 -5.681 -0.560 1.00 0.00 H new ATOM 1296 N THR B 108 9.481 -6.065 -3.257 1.00 0.00 N ATOM 1297 CA THR B 108 9.420 -6.826 -4.496 1.00 0.00 C ATOM 1298 C THR B 108 8.047 -7.482 -4.616 1.00 0.00 C ATOM 1299 O THR B 108 7.813 -8.577 -4.106 1.00 0.00 O ATOM 1300 CB THR B 108 10.573 -7.844 -4.563 1.00 0.00 C ATOM 1301 OG1 THR B 108 11.609 -7.357 -5.396 1.00 0.00 O ATOM 1302 CG2 THR B 108 10.181 -9.210 -5.091 1.00 0.00 C ATOM 0 H THR B 108 10.250 -6.317 -2.636 1.00 0.00 H new ATOM 0 HA THR B 108 9.547 -6.161 -5.350 1.00 0.00 H new ATOM 0 HB THR B 108 10.893 -7.965 -3.528 1.00 0.00 H new ATOM 0 HG1 THR B 108 12.467 -7.428 -4.927 1.00 0.00 H new ATOM 0 HG21 THR B 108 11.056 -9.860 -5.103 1.00 0.00 H new ATOM 0 HG22 THR B 108 9.415 -9.643 -4.447 1.00 0.00 H new ATOM 0 HG23 THR B 108 9.790 -9.110 -6.103 1.00 0.00 H new ATOM 1310 N VAL B 109 7.131 -6.766 -5.259 1.00 0.00 N ATOM 1311 CA VAL B 109 5.765 -7.231 -5.413 1.00 0.00 C ATOM 1312 C VAL B 109 5.608 -8.208 -6.586 1.00 0.00 C ATOM 1313 O VAL B 109 6.034 -9.357 -6.475 1.00 0.00 O ATOM 1314 CB VAL B 109 4.791 -6.035 -5.532 1.00 0.00 C ATOM 1315 CG1 VAL B 109 3.373 -6.504 -5.844 1.00 0.00 C ATOM 1316 CG2 VAL B 109 4.816 -5.215 -4.243 1.00 0.00 C ATOM 0 H VAL B 109 7.315 -5.857 -5.683 1.00 0.00 H new ATOM 0 HA VAL B 109 5.509 -7.790 -4.513 1.00 0.00 H new ATOM 0 HB VAL B 109 5.119 -5.406 -6.360 1.00 0.00 H new ATOM 0 HG11 VAL B 109 2.713 -5.640 -5.921 1.00 0.00 H new ATOM 0 HG12 VAL B 109 3.369 -7.049 -6.788 1.00 0.00 H new ATOM 0 HG13 VAL B 109 3.022 -7.158 -5.046 1.00 0.00 H new ATOM 0 HG21 VAL B 109 4.128 -4.374 -4.333 1.00 0.00 H new ATOM 0 HG22 VAL B 109 4.513 -5.844 -3.406 1.00 0.00 H new ATOM 0 HG23 VAL B 109 5.825 -4.841 -4.069 1.00 0.00 H new ATOM 1326 N ASP B 110 4.957 -7.791 -7.684 1.00 0.00 N ATOM 1327 CA ASP B 110 4.715 -8.688 -8.817 1.00 0.00 C ATOM 1328 C ASP B 110 3.625 -9.680 -8.430 1.00 0.00 C ATOM 1329 O ASP B 110 2.719 -9.976 -9.209 1.00 0.00 O ATOM 1330 CB ASP B 110 5.994 -9.419 -9.244 1.00 0.00 C ATOM 1331 CG ASP B 110 5.721 -10.616 -10.138 1.00 0.00 C ATOM 1332 OD1 ASP B 110 5.302 -11.668 -9.610 1.00 0.00 O ATOM 1333 OD2 ASP B 110 5.926 -10.500 -11.364 1.00 0.00 O ATOM 0 H ASP B 110 4.593 -6.846 -7.808 1.00 0.00 H new ATOM 0 HA ASP B 110 4.390 -8.098 -9.674 1.00 0.00 H new ATOM 0 HB2 ASP B 110 6.647 -8.722 -9.769 1.00 0.00 H new ATOM 0 HB3 ASP B 110 6.531 -9.751 -8.355 1.00 0.00 H new ATOM 1338 N SER B 111 3.719 -10.158 -7.199 1.00 0.00 N ATOM 1339 CA SER B 111 2.760 -11.083 -6.640 1.00 0.00 C ATOM 1340 C SER B 111 1.807 -10.322 -5.729 1.00 0.00 C ATOM 1341 O SER B 111 0.597 -10.547 -5.743 1.00 0.00 O ATOM 1342 CB SER B 111 3.502 -12.150 -5.850 1.00 0.00 C ATOM 1343 OG SER B 111 2.641 -12.813 -4.940 1.00 0.00 O ATOM 0 H SER B 111 4.472 -9.909 -6.558 1.00 0.00 H new ATOM 0 HA SER B 111 2.188 -11.560 -7.436 1.00 0.00 H new ATOM 0 HB2 SER B 111 3.937 -12.876 -6.536 1.00 0.00 H new ATOM 0 HB3 SER B 111 4.328 -11.693 -5.305 1.00 0.00 H new ATOM 0 HG SER B 111 3.146 -13.494 -4.448 1.00 0.00 H new ATOM 1349 N ASP B 112 2.373 -9.402 -4.947 1.00 0.00 N ATOM 1350 CA ASP B 112 1.590 -8.582 -4.037 1.00 0.00 C ATOM 1351 C ASP B 112 0.724 -7.592 -4.818 1.00 0.00 C ATOM 1352 O ASP B 112 0.829 -7.486 -6.040 1.00 0.00 O ATOM 1353 CB ASP B 112 2.494 -7.855 -3.038 1.00 0.00 C ATOM 1354 CG ASP B 112 3.623 -8.730 -2.527 1.00 0.00 C ATOM 1355 OD1 ASP B 112 4.380 -9.272 -3.359 1.00 0.00 O ATOM 1356 OD2 ASP B 112 3.749 -8.874 -1.293 1.00 0.00 O ATOM 0 H ASP B 112 3.375 -9.210 -4.930 1.00 0.00 H new ATOM 0 HA ASP B 112 0.929 -9.237 -3.469 1.00 0.00 H new ATOM 0 HB2 ASP B 112 2.913 -6.968 -3.512 1.00 0.00 H new ATOM 0 HB3 ASP B 112 1.895 -7.512 -2.194 1.00 0.00 H new ATOM 1361 N SER B 113 -0.166 -6.917 -4.106 1.00 0.00 N ATOM 1362 CA SER B 113 -1.111 -5.978 -4.711 1.00 0.00 C ATOM 1363 C SER B 113 -0.500 -4.714 -5.290 1.00 0.00 C ATOM 1364 O SER B 113 -1.147 -4.038 -6.089 1.00 0.00 O ATOM 1365 CB SER B 113 -2.212 -5.613 -3.723 1.00 0.00 C ATOM 1366 OG SER B 113 -2.213 -6.488 -2.608 1.00 0.00 O ATOM 0 H SER B 113 -0.257 -7.001 -3.094 1.00 0.00 H new ATOM 0 HA SER B 113 -1.520 -6.518 -5.565 1.00 0.00 H new ATOM 0 HB2 SER B 113 -2.073 -4.587 -3.383 1.00 0.00 H new ATOM 0 HB3 SER B 113 -3.180 -5.655 -4.222 1.00 0.00 H new ATOM 0 HG SER B 113 -1.733 -6.069 -1.863 1.00 0.00 H new ATOM 1372 N TYR B 114 0.713 -4.378 -4.904 1.00 0.00 N ATOM 1373 CA TYR B 114 1.351 -3.180 -5.418 1.00 0.00 C ATOM 1374 C TYR B 114 1.081 -3.033 -6.914 1.00 0.00 C ATOM 1375 O TYR B 114 0.598 -2.003 -7.384 1.00 0.00 O ATOM 1376 CB TYR B 114 2.828 -3.295 -5.220 1.00 0.00 C ATOM 1377 CG TYR B 114 3.597 -2.601 -6.313 1.00 0.00 C ATOM 1378 CD1 TYR B 114 3.747 -1.224 -6.328 1.00 0.00 C ATOM 1379 CD2 TYR B 114 4.114 -3.331 -7.360 1.00 0.00 C ATOM 1380 CE1 TYR B 114 4.401 -0.592 -7.365 1.00 0.00 C ATOM 1381 CE2 TYR B 114 4.775 -2.721 -8.402 1.00 0.00 C ATOM 1382 CZ TYR B 114 4.914 -1.345 -8.405 1.00 0.00 C ATOM 1383 OH TYR B 114 5.570 -0.722 -9.443 1.00 0.00 O ATOM 0 H TYR B 114 1.275 -4.912 -4.241 1.00 0.00 H new ATOM 0 HA TYR B 114 0.952 -2.315 -4.889 1.00 0.00 H new ATOM 0 HB2 TYR B 114 3.100 -2.865 -4.256 1.00 0.00 H new ATOM 0 HB3 TYR B 114 3.109 -4.348 -5.190 1.00 0.00 H new ATOM 0 HD1 TYR B 114 3.346 -0.636 -5.515 1.00 0.00 H new ATOM 0 HD2 TYR B 114 3.998 -4.405 -7.364 1.00 0.00 H new ATOM 0 HE1 TYR B 114 4.511 0.482 -7.365 1.00 0.00 H new ATOM 0 HE2 TYR B 114 5.181 -3.312 -9.210 1.00 0.00 H new ATOM 0 HH TYR B 114 6.250 -1.325 -9.809 1.00 0.00 H new ATOM 1393 N GLN B 115 1.430 -4.090 -7.649 1.00 0.00 N ATOM 1394 CA GLN B 115 1.270 -4.124 -9.093 1.00 0.00 C ATOM 1395 C GLN B 115 -0.139 -3.725 -9.516 1.00 0.00 C ATOM 1396 O GLN B 115 -0.331 -3.058 -10.531 1.00 0.00 O ATOM 1397 CB GLN B 115 1.584 -5.510 -9.630 1.00 0.00 C ATOM 1398 CG GLN B 115 3.009 -5.936 -9.379 1.00 0.00 C ATOM 1399 CD GLN B 115 3.725 -6.334 -10.656 1.00 0.00 C ATOM 1400 OE1 GLN B 115 4.823 -5.856 -10.940 1.00 0.00 O ATOM 1401 NE2 GLN B 115 3.104 -7.213 -11.434 1.00 0.00 N ATOM 0 H GLN B 115 1.830 -4.942 -7.256 1.00 0.00 H new ATOM 0 HA GLN B 115 1.970 -3.401 -9.511 1.00 0.00 H new ATOM 0 HB2 GLN B 115 0.909 -6.232 -9.170 1.00 0.00 H new ATOM 0 HB3 GLN B 115 1.389 -5.530 -10.702 1.00 0.00 H new ATOM 0 HG2 GLN B 115 3.551 -5.120 -8.901 1.00 0.00 H new ATOM 0 HG3 GLN B 115 3.018 -6.775 -8.684 1.00 0.00 H new ATOM 0 HE21 GLN B 115 2.194 -7.584 -11.160 1.00 0.00 H new ATOM 0 HE22 GLN B 115 3.537 -7.517 -12.306 1.00 0.00 H new ATOM 1410 N LEU B 116 -1.126 -4.151 -8.736 1.00 0.00 N ATOM 1411 CA LEU B 116 -2.520 -3.847 -9.035 1.00 0.00 C ATOM 1412 C LEU B 116 -2.740 -2.342 -9.149 1.00 0.00 C ATOM 1413 O LEU B 116 -3.505 -1.879 -9.995 1.00 0.00 O ATOM 1414 CB LEU B 116 -3.433 -4.432 -7.953 1.00 0.00 C ATOM 1415 CG LEU B 116 -4.516 -5.384 -8.465 1.00 0.00 C ATOM 1416 CD1 LEU B 116 -5.171 -6.118 -7.305 1.00 0.00 C ATOM 1417 CD2 LEU B 116 -5.555 -4.622 -9.272 1.00 0.00 C ATOM 0 H LEU B 116 -0.987 -4.707 -7.893 1.00 0.00 H new ATOM 0 HA LEU B 116 -2.768 -4.301 -9.994 1.00 0.00 H new ATOM 0 HB2 LEU B 116 -2.817 -4.963 -7.228 1.00 0.00 H new ATOM 0 HB3 LEU B 116 -3.914 -3.611 -7.422 1.00 0.00 H new ATOM 0 HG LEU B 116 -4.048 -6.122 -9.117 1.00 0.00 H new ATOM 0 HD11 LEU B 116 -5.939 -6.791 -7.687 1.00 0.00 H new ATOM 0 HD12 LEU B 116 -4.418 -6.695 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU B 116 -5.626 -5.395 -6.628 1.00 0.00 H new ATOM 0 HD21 LEU B 116 -6.318 -5.314 -9.629 1.00 0.00 H new ATOM 0 HD22 LEU B 116 -6.019 -3.863 -8.643 1.00 0.00 H new ATOM 0 HD23 LEU B 116 -5.074 -4.142 -10.124 1.00 0.00 H new ATOM 1429 N LEU B 117 -2.070 -1.583 -8.288 1.00 0.00 N ATOM 1430 CA LEU B 117 -2.202 -0.131 -8.293 1.00 0.00 C ATOM 1431 C LEU B 117 -1.405 0.503 -9.426 1.00 0.00 C ATOM 1432 O LEU B 117 -1.890 1.411 -10.099 1.00 0.00 O ATOM 1433 CB LEU B 117 -1.743 0.456 -6.959 1.00 0.00 C ATOM 1434 CG LEU B 117 -2.843 1.123 -6.134 1.00 0.00 C ATOM 1435 CD1 LEU B 117 -3.369 2.360 -6.847 1.00 0.00 C ATOM 1436 CD2 LEU B 117 -3.973 0.141 -5.862 1.00 0.00 C ATOM 0 H LEU B 117 -1.432 -1.948 -7.580 1.00 0.00 H new ATOM 0 HA LEU B 117 -3.257 0.095 -8.446 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -1.295 -0.340 -6.364 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -0.960 1.189 -7.152 1.00 0.00 H new ATOM 0 HG LEU B 117 -2.419 1.433 -5.179 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -4.152 2.822 -6.245 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -2.555 3.071 -6.991 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -3.778 2.075 -7.816 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -4.748 0.632 -5.273 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -4.396 -0.198 -6.808 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -3.586 -0.715 -5.310 1.00 0.00 H new ATOM 1448 N LYS B 118 -0.180 0.032 -9.629 1.00 0.00 N ATOM 1449 CA LYS B 118 0.669 0.576 -10.678 1.00 0.00 C ATOM 1450 C LYS B 118 0.194 0.122 -12.037 1.00 0.00 C ATOM 1451 O LYS B 118 0.410 0.790 -13.048 1.00 0.00 O ATOM 1452 CB LYS B 118 2.130 0.184 -10.465 1.00 0.00 C ATOM 1453 CG LYS B 118 2.336 -1.311 -10.318 1.00 0.00 C ATOM 1454 CD LYS B 118 3.394 -1.834 -11.280 1.00 0.00 C ATOM 1455 CE LYS B 118 2.960 -3.138 -11.930 1.00 0.00 C ATOM 1456 NZ LYS B 118 1.601 -3.036 -12.530 1.00 0.00 N ATOM 0 H LYS B 118 0.244 -0.720 -9.085 1.00 0.00 H new ATOM 0 HA LYS B 118 0.601 1.663 -10.631 1.00 0.00 H new ATOM 0 HB2 LYS B 118 2.722 0.544 -11.307 1.00 0.00 H new ATOM 0 HB3 LYS B 118 2.507 0.685 -9.573 1.00 0.00 H new ATOM 0 HG2 LYS B 118 2.632 -1.538 -9.294 1.00 0.00 H new ATOM 0 HG3 LYS B 118 1.393 -1.827 -10.499 1.00 0.00 H new ATOM 0 HD2 LYS B 118 3.587 -1.088 -12.051 1.00 0.00 H new ATOM 0 HD3 LYS B 118 4.331 -1.987 -10.744 1.00 0.00 H new ATOM 0 HE2 LYS B 118 3.678 -3.415 -12.702 1.00 0.00 H new ATOM 0 HE3 LYS B 118 2.969 -3.935 -11.186 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 1.469 -3.800 -13.223 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 0.884 -3.120 -11.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 1.500 -2.117 -13.006 1.00 0.00 H new ATOM 1470 N ALA B 119 -0.474 -1.007 -12.041 1.00 0.00 N ATOM 1471 CA ALA B 119 -1.017 -1.562 -13.263 1.00 0.00 C ATOM 1472 C ALA B 119 -2.061 -0.614 -13.836 1.00 0.00 C ATOM 1473 O ALA B 119 -2.306 -0.585 -15.040 1.00 0.00 O ATOM 1474 CB ALA B 119 -1.623 -2.934 -13.006 1.00 0.00 C ATOM 0 H ALA B 119 -0.657 -1.564 -11.207 1.00 0.00 H new ATOM 0 HA ALA B 119 -0.211 -1.681 -13.987 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -2.026 -3.334 -13.937 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -0.854 -3.606 -12.625 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -2.424 -2.846 -12.272 1.00 0.00 H new ATOM 1480 N TYR B 120 -2.670 0.169 -12.953 1.00 0.00 N ATOM 1481 CA TYR B 120 -3.680 1.124 -13.345 1.00 0.00 C ATOM 1482 C TYR B 120 -3.413 2.489 -12.726 1.00 0.00 C ATOM 1483 O TYR B 120 -4.314 3.326 -12.662 1.00 0.00 O ATOM 1484 CB TYR B 120 -5.069 0.649 -12.914 1.00 0.00 C ATOM 1485 CG TYR B 120 -5.264 -0.848 -12.980 1.00 0.00 C ATOM 1486 CD1 TYR B 120 -4.832 -1.580 -14.081 1.00 0.00 C ATOM 1487 CD2 TYR B 120 -5.894 -1.528 -11.944 1.00 0.00 C ATOM 1488 CE1 TYR B 120 -5.023 -2.945 -14.148 1.00 0.00 C ATOM 1489 CE2 TYR B 120 -6.086 -2.895 -12.006 1.00 0.00 C ATOM 1490 CZ TYR B 120 -5.650 -3.598 -13.109 1.00 0.00 C ATOM 1491 OH TYR B 120 -5.842 -4.959 -13.173 1.00 0.00 O ATOM 0 H TYR B 120 -2.474 0.154 -11.952 1.00 0.00 H new ATOM 0 HA TYR B 120 -3.642 1.209 -14.431 1.00 0.00 H new ATOM 0 HB2 TYR B 120 -5.253 0.983 -11.893 1.00 0.00 H new ATOM 0 HB3 TYR B 120 -5.816 1.129 -13.546 1.00 0.00 H new ATOM 0 HD1 TYR B 120 -4.339 -1.072 -14.897 1.00 0.00 H new ATOM 0 HD2 TYR B 120 -6.238 -0.980 -11.079 1.00 0.00 H new ATOM 0 HE1 TYR B 120 -4.683 -3.499 -15.010 1.00 0.00 H new ATOM 0 HE2 TYR B 120 -6.576 -3.411 -11.193 1.00 0.00 H new ATOM 0 HH TYR B 120 -6.297 -5.264 -12.360 1.00 0.00 H new ATOM 1501 N ASP B 121 -2.185 2.722 -12.259 1.00 0.00 N ATOM 1502 CA ASP B 121 -1.850 3.992 -11.642 1.00 0.00 C ATOM 1503 C ASP B 121 -0.490 3.899 -10.984 1.00 0.00 C ATOM 1504 O ASP B 121 -0.362 4.045 -9.770 1.00 0.00 O ATOM 1505 CB ASP B 121 -2.912 4.399 -10.610 1.00 0.00 C ATOM 1506 CG ASP B 121 -3.802 5.520 -11.111 1.00 0.00 C ATOM 1507 OD1 ASP B 121 -3.279 6.445 -11.766 1.00 0.00 O ATOM 1508 OD2 ASP B 121 -5.022 5.472 -10.847 1.00 0.00 O ATOM 0 H ASP B 121 -1.418 2.051 -12.299 1.00 0.00 H new ATOM 0 HA ASP B 121 -1.823 4.757 -12.418 1.00 0.00 H new ATOM 0 HB2 ASP B 121 -3.526 3.533 -10.363 1.00 0.00 H new ATOM 0 HB3 ASP B 121 -2.419 4.713 -9.690 1.00 0.00 H new ATOM 1513 N VAL B 122 0.521 3.653 -11.804 1.00 0.00 N ATOM 1514 CA VAL B 122 1.890 3.543 -11.332 1.00 0.00 C ATOM 1515 C VAL B 122 2.331 4.868 -10.742 1.00 0.00 C ATOM 1516 O VAL B 122 3.168 5.593 -11.280 1.00 0.00 O ATOM 1517 CB VAL B 122 2.798 3.086 -12.477 1.00 0.00 C ATOM 1518 CG1 VAL B 122 2.597 3.969 -13.698 1.00 0.00 C ATOM 1519 CG2 VAL B 122 4.258 3.046 -12.045 1.00 0.00 C ATOM 0 H VAL B 122 0.415 3.525 -12.810 1.00 0.00 H new ATOM 0 HA VAL B 122 1.958 2.793 -10.544 1.00 0.00 H new ATOM 0 HB VAL B 122 2.520 2.068 -12.749 1.00 0.00 H new ATOM 0 HG11 VAL B 122 3.250 3.631 -14.503 1.00 0.00 H new ATOM 0 HG12 VAL B 122 1.558 3.909 -14.023 1.00 0.00 H new ATOM 0 HG13 VAL B 122 2.839 5.001 -13.444 1.00 0.00 H new ATOM 0 HG21 VAL B 122 4.876 2.718 -12.881 1.00 0.00 H new ATOM 0 HG22 VAL B 122 4.572 4.041 -11.731 1.00 0.00 H new ATOM 0 HG23 VAL B 122 4.373 2.350 -11.214 1.00 0.00 H new ATOM 1529 N ASN B 123 1.710 5.138 -9.612 1.00 0.00 N ATOM 1530 CA ASN B 123 1.905 6.325 -8.817 1.00 0.00 C ATOM 1531 C ASN B 123 1.656 5.913 -7.391 1.00 0.00 C ATOM 1532 O ASN B 123 0.663 6.301 -6.773 1.00 0.00 O ATOM 1533 CB ASN B 123 0.887 7.366 -9.219 1.00 0.00 C ATOM 1534 CG ASN B 123 1.318 8.778 -8.876 1.00 0.00 C ATOM 1535 OD1 ASN B 123 1.464 9.128 -7.705 1.00 0.00 O ATOM 1536 ND2 ASN B 123 1.525 9.600 -9.899 1.00 0.00 N ATOM 0 H ASN B 123 1.023 4.502 -9.207 1.00 0.00 H new ATOM 0 HA ASN B 123 2.903 6.743 -8.950 1.00 0.00 H new ATOM 0 HB2 ASN B 123 0.709 7.297 -10.292 1.00 0.00 H new ATOM 0 HB3 ASN B 123 -0.060 7.151 -8.724 1.00 0.00 H new ATOM 0 HD21 ASN B 123 1.817 10.562 -9.729 1.00 0.00 H new ATOM 0 HD22 ASN B 123 1.392 9.269 -10.854 1.00 0.00 H new ATOM 1543 N ILE B 124 2.528 5.073 -6.895 1.00 0.00 N ATOM 1544 CA ILE B 124 2.367 4.544 -5.564 1.00 0.00 C ATOM 1545 C ILE B 124 3.623 4.618 -4.775 1.00 0.00 C ATOM 1546 O ILE B 124 3.587 4.777 -3.561 1.00 0.00 O ATOM 1547 CB ILE B 124 1.895 3.084 -5.534 1.00 0.00 C ATOM 1548 CG1 ILE B 124 1.657 2.587 -6.939 1.00 0.00 C ATOM 1549 CG2 ILE B 124 0.665 2.957 -4.671 1.00 0.00 C ATOM 1550 CD1 ILE B 124 2.929 2.593 -7.717 1.00 0.00 C ATOM 0 H ILE B 124 3.355 4.741 -7.391 1.00 0.00 H new ATOM 0 HA ILE B 124 1.597 5.177 -5.123 1.00 0.00 H new ATOM 0 HB ILE B 124 2.671 2.458 -5.093 1.00 0.00 H new ATOM 0 HG12 ILE B 124 1.247 1.578 -6.909 1.00 0.00 H new ATOM 0 HG13 ILE B 124 0.918 3.217 -7.434 1.00 0.00 H new ATOM 0 HG21 ILE B 124 0.337 1.918 -4.656 1.00 0.00 H new ATOM 0 HG22 ILE B 124 0.898 3.279 -3.656 1.00 0.00 H new ATOM 0 HG23 ILE B 124 -0.130 3.582 -5.077 1.00 0.00 H new ATOM 0 HD11 ILE B 124 2.739 2.232 -8.728 1.00 0.00 H new ATOM 0 HD12 ILE B 124 3.323 3.608 -7.763 1.00 0.00 H new ATOM 0 HD13 ILE B 124 3.656 1.943 -7.230 1.00 0.00 H new ATOM 1562 N SER B 125 4.739 4.462 -5.447 1.00 0.00 N ATOM 1563 CA SER B 125 5.988 4.483 -4.742 1.00 0.00 C ATOM 1564 C SER B 125 6.030 5.698 -3.816 1.00 0.00 C ATOM 1565 O SER B 125 6.208 5.575 -2.599 1.00 0.00 O ATOM 1566 CB SER B 125 7.161 4.499 -5.708 1.00 0.00 C ATOM 1567 OG SER B 125 8.209 3.657 -5.259 1.00 0.00 O ATOM 0 H SER B 125 4.804 4.323 -6.455 1.00 0.00 H new ATOM 0 HA SER B 125 6.070 3.575 -4.144 1.00 0.00 H new ATOM 0 HB2 SER B 125 6.828 4.174 -6.694 1.00 0.00 H new ATOM 0 HB3 SER B 125 7.532 5.518 -5.817 1.00 0.00 H new ATOM 0 HG SER B 125 8.949 3.686 -5.900 1.00 0.00 H new ATOM 1573 N GLY B 126 5.803 6.870 -4.401 1.00 0.00 N ATOM 1574 CA GLY B 126 5.759 8.083 -3.613 1.00 0.00 C ATOM 1575 C GLY B 126 4.572 8.048 -2.674 1.00 0.00 C ATOM 1576 O GLY B 126 4.629 8.560 -1.556 1.00 0.00 O ATOM 0 H GLY B 126 5.650 6.999 -5.401 1.00 0.00 H new ATOM 0 HA2 GLY B 126 6.682 8.189 -3.042 1.00 0.00 H new ATOM 0 HA3 GLY B 126 5.688 8.950 -4.269 1.00 0.00 H new ATOM 1580 N LEU B 127 3.498 7.410 -3.139 1.00 0.00 N ATOM 1581 CA LEU B 127 2.288 7.254 -2.369 1.00 0.00 C ATOM 1582 C LEU B 127 2.570 6.461 -1.110 1.00 0.00 C ATOM 1583 O LEU B 127 2.131 6.831 -0.022 1.00 0.00 O ATOM 1584 CB LEU B 127 1.285 6.508 -3.218 1.00 0.00 C ATOM 1585 CG LEU B 127 -0.173 6.656 -2.828 1.00 0.00 C ATOM 1586 CD1 LEU B 127 -1.044 6.286 -4.016 1.00 0.00 C ATOM 1587 CD2 LEU B 127 -0.480 5.780 -1.625 1.00 0.00 C ATOM 0 H LEU B 127 3.454 6.989 -4.067 1.00 0.00 H new ATOM 0 HA LEU B 127 1.900 8.232 -2.085 1.00 0.00 H new ATOM 0 HB2 LEU B 127 1.398 6.840 -4.250 1.00 0.00 H new ATOM 0 HB3 LEU B 127 1.539 5.448 -3.194 1.00 0.00 H new ATOM 0 HG LEU B 127 -0.382 7.689 -2.549 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -2.094 6.390 -3.743 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -0.819 6.948 -4.852 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -0.845 5.254 -4.306 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -1.529 5.892 -1.351 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -0.279 4.738 -1.873 1.00 0.00 H new ATOM 0 HD23 LEU B 127 0.148 6.081 -0.786 1.00 0.00 H new ATOM 1599 N VAL B 128 3.308 5.359 -1.269 1.00 0.00 N ATOM 1600 CA VAL B 128 3.658 4.506 -0.144 1.00 0.00 C ATOM 1601 C VAL B 128 4.004 5.350 1.075 1.00 0.00 C ATOM 1602 O VAL B 128 3.376 5.221 2.120 1.00 0.00 O ATOM 1603 CB VAL B 128 4.847 3.602 -0.530 1.00 0.00 C ATOM 1604 CG1 VAL B 128 5.651 3.144 0.687 1.00 0.00 C ATOM 1605 CG2 VAL B 128 4.335 2.424 -1.343 1.00 0.00 C ATOM 0 H VAL B 128 3.672 5.042 -2.168 1.00 0.00 H new ATOM 0 HA VAL B 128 2.802 3.879 0.108 1.00 0.00 H new ATOM 0 HB VAL B 128 5.539 4.184 -1.139 1.00 0.00 H new ATOM 0 HG11 VAL B 128 6.476 2.511 0.361 1.00 0.00 H new ATOM 0 HG12 VAL B 128 6.047 4.014 1.210 1.00 0.00 H new ATOM 0 HG13 VAL B 128 5.004 2.580 1.359 1.00 0.00 H new ATOM 0 HG21 VAL B 128 5.171 1.781 -1.619 1.00 0.00 H new ATOM 0 HG22 VAL B 128 3.621 1.855 -0.748 1.00 0.00 H new ATOM 0 HG23 VAL B 128 3.846 2.790 -2.246 1.00 0.00 H new ATOM 1615 N SER B 129 4.992 6.221 0.910 1.00 0.00 N ATOM 1616 CA SER B 129 5.436 7.115 1.970 1.00 0.00 C ATOM 1617 C SER B 129 4.345 8.101 2.406 1.00 0.00 C ATOM 1618 O SER B 129 4.399 8.626 3.513 1.00 0.00 O ATOM 1619 CB SER B 129 6.663 7.891 1.504 1.00 0.00 C ATOM 1620 OG SER B 129 6.480 8.400 0.195 1.00 0.00 O ATOM 0 H SER B 129 5.508 6.327 0.036 1.00 0.00 H new ATOM 0 HA SER B 129 5.680 6.496 2.833 1.00 0.00 H new ATOM 0 HB2 SER B 129 6.860 8.713 2.192 1.00 0.00 H new ATOM 0 HB3 SER B 129 7.538 7.241 1.525 1.00 0.00 H new ATOM 0 HG SER B 129 5.530 8.358 -0.043 1.00 0.00 H new ATOM 1626 N THR B 130 3.350 8.350 1.554 1.00 0.00 N ATOM 1627 CA THR B 130 2.275 9.271 1.904 1.00 0.00 C ATOM 1628 C THR B 130 1.329 8.587 2.860 1.00 0.00 C ATOM 1629 O THR B 130 0.987 9.125 3.913 1.00 0.00 O ATOM 1630 CB THR B 130 1.510 9.737 0.663 1.00 0.00 C ATOM 1631 OG1 THR B 130 2.351 10.492 -0.191 1.00 0.00 O ATOM 1632 CG2 THR B 130 0.298 10.591 0.991 1.00 0.00 C ATOM 0 H THR B 130 3.268 7.931 0.628 1.00 0.00 H new ATOM 0 HA THR B 130 2.714 10.151 2.374 1.00 0.00 H new ATOM 0 HB THR B 130 1.169 8.824 0.174 1.00 0.00 H new ATOM 0 HG1 THR B 130 3.026 9.904 -0.589 1.00 0.00 H new ATOM 0 HG21 THR B 130 -0.199 10.888 0.067 1.00 0.00 H new ATOM 0 HG22 THR B 130 -0.395 10.018 1.608 1.00 0.00 H new ATOM 0 HG23 THR B 130 0.616 11.481 1.534 1.00 0.00 H new ATOM 1640 N THR B 131 0.929 7.379 2.495 1.00 0.00 N ATOM 1641 CA THR B 131 0.043 6.601 3.332 1.00 0.00 C ATOM 1642 C THR B 131 0.645 6.458 4.719 1.00 0.00 C ATOM 1643 O THR B 131 -0.059 6.238 5.705 1.00 0.00 O ATOM 1644 CB THR B 131 -0.198 5.218 2.728 1.00 0.00 C ATOM 1645 OG1 THR B 131 -0.642 5.317 1.387 1.00 0.00 O ATOM 1646 CG2 THR B 131 -1.213 4.404 3.499 1.00 0.00 C ATOM 0 H THR B 131 1.205 6.921 1.626 1.00 0.00 H new ATOM 0 HA THR B 131 -0.914 7.119 3.400 1.00 0.00 H new ATOM 0 HB THR B 131 0.765 4.710 2.777 1.00 0.00 H new ATOM 0 HG1 THR B 131 -0.787 4.419 1.023 1.00 0.00 H new ATOM 0 HG21 THR B 131 -1.340 3.433 3.020 1.00 0.00 H new ATOM 0 HG22 THR B 131 -0.864 4.262 4.522 1.00 0.00 H new ATOM 0 HG23 THR B 131 -2.168 4.930 3.511 1.00 0.00 H new ATOM 1654 N MET B 132 1.960 6.597 4.773 1.00 0.00 N ATOM 1655 CA MET B 132 2.694 6.500 6.017 1.00 0.00 C ATOM 1656 C MET B 132 2.537 7.782 6.809 1.00 0.00 C ATOM 1657 O MET B 132 2.289 7.745 8.002 1.00 0.00 O ATOM 1658 CB MET B 132 4.178 6.239 5.759 1.00 0.00 C ATOM 1659 CG MET B 132 4.461 5.445 4.497 1.00 0.00 C ATOM 1660 SD MET B 132 3.901 3.747 4.595 1.00 0.00 S ATOM 1661 CE MET B 132 5.489 2.934 4.569 1.00 0.00 C ATOM 0 H MET B 132 2.544 6.780 3.957 1.00 0.00 H new ATOM 0 HA MET B 132 2.288 5.664 6.586 1.00 0.00 H new ATOM 0 HB2 MET B 132 4.698 7.195 5.697 1.00 0.00 H new ATOM 0 HB3 MET B 132 4.595 5.704 6.612 1.00 0.00 H new ATOM 0 HG2 MET B 132 3.976 5.933 3.652 1.00 0.00 H new ATOM 0 HG3 MET B 132 5.533 5.457 4.300 1.00 0.00 H new ATOM 0 HE1 MET B 132 5.407 1.994 4.024 1.00 0.00 H new ATOM 0 HE2 MET B 132 6.219 3.577 4.077 1.00 0.00 H new ATOM 0 HE3 MET B 132 5.812 2.734 5.591 1.00 0.00 H new ATOM 1671 N GLN B 133 2.678 8.919 6.134 1.00 0.00 N ATOM 1672 CA GLN B 133 2.541 10.213 6.792 1.00 0.00 C ATOM 1673 C GLN B 133 1.250 10.263 7.597 1.00 0.00 C ATOM 1674 O GLN B 133 1.214 10.807 8.700 1.00 0.00 O ATOM 1675 CB GLN B 133 2.563 11.342 5.766 1.00 0.00 C ATOM 1676 CG GLN B 133 2.404 12.726 6.377 1.00 0.00 C ATOM 1677 CD GLN B 133 1.061 13.354 6.061 1.00 0.00 C ATOM 1678 OE1 GLN B 133 0.658 13.436 4.900 1.00 0.00 O ATOM 1679 NE2 GLN B 133 0.360 13.802 7.096 1.00 0.00 N ATOM 0 H GLN B 133 2.886 8.970 5.137 1.00 0.00 H new ATOM 0 HA GLN B 133 3.384 10.344 7.470 1.00 0.00 H new ATOM 0 HB2 GLN B 133 3.503 11.303 5.216 1.00 0.00 H new ATOM 0 HB3 GLN B 133 1.764 11.180 5.043 1.00 0.00 H new ATOM 0 HG2 GLN B 133 2.523 12.657 7.458 1.00 0.00 H new ATOM 0 HG3 GLN B 133 3.199 13.375 6.009 1.00 0.00 H new ATOM 0 HE21 GLN B 133 0.733 13.713 8.041 1.00 0.00 H new ATOM 0 HE22 GLN B 133 -0.551 14.235 6.946 1.00 0.00 H new ATOM 1688 N ASN B 134 0.196 9.670 7.045 1.00 0.00 N ATOM 1689 CA ASN B 134 -1.088 9.629 7.727 1.00 0.00 C ATOM 1690 C ASN B 134 -1.045 8.569 8.812 1.00 0.00 C ATOM 1691 O ASN B 134 -1.476 8.801 9.942 1.00 0.00 O ATOM 1692 CB ASN B 134 -2.209 9.349 6.722 1.00 0.00 C ATOM 1693 CG ASN B 134 -3.585 9.394 7.355 1.00 0.00 C ATOM 1694 OD1 ASN B 134 -3.916 10.328 8.087 1.00 0.00 O ATOM 1695 ND2 ASN B 134 -4.397 8.381 7.076 1.00 0.00 N ATOM 0 H ASN B 134 0.207 9.214 6.133 1.00 0.00 H new ATOM 0 HA ASN B 134 -1.291 10.594 8.191 1.00 0.00 H new ATOM 0 HB2 ASN B 134 -2.160 10.081 5.916 1.00 0.00 H new ATOM 0 HB3 ASN B 134 -2.052 8.369 6.272 1.00 0.00 H new ATOM 0 HD21 ASN B 134 -5.336 8.356 7.473 1.00 0.00 H new ATOM 0 HD22 ASN B 134 -4.082 7.628 6.464 1.00 0.00 H new ATOM 1702 N GLU B 135 -0.472 7.421 8.478 1.00 0.00 N ATOM 1703 CA GLU B 135 -0.316 6.350 9.445 1.00 0.00 C ATOM 1704 C GLU B 135 0.844 6.690 10.380 1.00 0.00 C ATOM 1705 O GLU B 135 1.059 6.028 11.392 1.00 0.00 O ATOM 1706 CB GLU B 135 -0.055 5.019 8.737 1.00 0.00 C ATOM 1707 CG GLU B 135 -1.320 4.334 8.244 1.00 0.00 C ATOM 1708 CD GLU B 135 -1.032 3.051 7.489 1.00 0.00 C ATOM 1709 OE1 GLU B 135 0.071 2.935 6.915 1.00 0.00 O ATOM 1710 OE2 GLU B 135 -1.909 2.162 7.473 1.00 0.00 O ATOM 0 H GLU B 135 -0.110 7.210 7.548 1.00 0.00 H new ATOM 0 HA GLU B 135 -1.235 6.249 10.023 1.00 0.00 H new ATOM 0 HB2 GLU B 135 0.609 5.192 7.890 1.00 0.00 H new ATOM 0 HB3 GLU B 135 0.468 4.350 9.420 1.00 0.00 H new ATOM 0 HG2 GLU B 135 -1.965 4.114 9.095 1.00 0.00 H new ATOM 0 HG3 GLU B 135 -1.870 5.017 7.596 1.00 0.00 H new ATOM 1717 N ALA B 136 1.583 7.742 10.021 1.00 0.00 N ATOM 1718 CA ALA B 136 2.719 8.207 10.799 1.00 0.00 C ATOM 1719 C ALA B 136 2.241 9.127 11.903 1.00 0.00 C ATOM 1720 O ALA B 136 2.556 8.925 13.076 1.00 0.00 O ATOM 1721 CB ALA B 136 3.715 8.928 9.901 1.00 0.00 C ATOM 0 H ALA B 136 1.405 8.292 9.181 1.00 0.00 H new ATOM 0 HA ALA B 136 3.219 7.348 11.246 1.00 0.00 H new ATOM 0 HB1 ALA B 136 4.561 9.271 10.497 1.00 0.00 H new ATOM 0 HB2 ALA B 136 4.069 8.245 9.128 1.00 0.00 H new ATOM 0 HB3 ALA B 136 3.230 9.785 9.434 1.00 0.00 H new ATOM 1727 N ARG B 137 1.450 10.129 11.526 1.00 0.00 N ATOM 1728 CA ARG B 137 0.906 11.054 12.503 1.00 0.00 C ATOM 1729 C ARG B 137 0.034 10.307 13.469 1.00 0.00 C ATOM 1730 O ARG B 137 0.213 10.365 14.685 1.00 0.00 O ATOM 1731 CB ARG B 137 0.036 12.099 11.842 1.00 0.00 C ATOM 1732 CG ARG B 137 0.559 13.517 11.986 1.00 0.00 C ATOM 1733 CD ARG B 137 0.458 14.004 13.423 1.00 0.00 C ATOM 1734 NE ARG B 137 -0.692 14.885 13.621 1.00 0.00 N ATOM 1735 CZ ARG B 137 -1.429 14.914 14.731 1.00 0.00 C ATOM 1736 NH1 ARG B 137 -1.141 14.118 15.754 1.00 0.00 N ATOM 1737 NH2 ARG B 137 -2.457 15.745 14.818 1.00 0.00 N ATOM 0 H ARG B 137 1.177 10.316 10.561 1.00 0.00 H new ATOM 0 HA ARG B 137 1.747 11.532 13.005 1.00 0.00 H new ATOM 0 HB2 ARG B 137 -0.057 11.863 10.782 1.00 0.00 H new ATOM 0 HB3 ARG B 137 -0.965 12.047 12.269 1.00 0.00 H new ATOM 0 HG2 ARG B 137 1.598 13.558 11.659 1.00 0.00 H new ATOM 0 HG3 ARG B 137 -0.007 14.183 11.334 1.00 0.00 H new ATOM 0 HD2 ARG B 137 0.378 13.147 14.092 1.00 0.00 H new ATOM 0 HD3 ARG B 137 1.372 14.534 13.692 1.00 0.00 H new ATOM 0 HE ARG B 137 -0.946 15.517 12.862 1.00 0.00 H new ATOM 0 HH11 ARG B 137 -0.350 13.477 15.694 1.00 0.00 H new ATOM 0 HH12 ARG B 137 -1.711 14.148 16.599 1.00 0.00 H new ATOM 0 HH21 ARG B 137 -2.683 16.361 14.037 1.00 0.00 H new ATOM 0 HH22 ARG B 137 -3.023 15.769 15.666 1.00 0.00 H new ATOM 1751 N ARG B 138 -0.946 9.631 12.897 1.00 0.00 N ATOM 1752 CA ARG B 138 -1.896 8.895 13.683 1.00 0.00 C ATOM 1753 C ARG B 138 -1.268 7.646 14.311 1.00 0.00 C ATOM 1754 O ARG B 138 -1.794 7.113 15.288 1.00 0.00 O ATOM 1755 CB ARG B 138 -3.103 8.504 12.828 1.00 0.00 C ATOM 1756 CG ARG B 138 -4.437 8.714 13.527 1.00 0.00 C ATOM 1757 CD ARG B 138 -5.545 9.028 12.533 1.00 0.00 C ATOM 1758 NE ARG B 138 -6.718 8.180 12.735 1.00 0.00 N ATOM 1759 CZ ARG B 138 -7.479 8.215 13.826 1.00 0.00 C ATOM 1760 NH1 ARG B 138 -7.195 9.053 14.816 1.00 0.00 N ATOM 1761 NH2 ARG B 138 -8.528 7.410 13.928 1.00 0.00 N ATOM 0 H ARG B 138 -1.098 9.582 11.890 1.00 0.00 H new ATOM 0 HA ARG B 138 -2.225 9.545 14.494 1.00 0.00 H new ATOM 0 HB2 ARG B 138 -3.089 9.086 11.907 1.00 0.00 H new ATOM 0 HB3 ARG B 138 -3.012 7.456 12.544 1.00 0.00 H new ATOM 0 HG2 ARG B 138 -4.697 7.819 14.093 1.00 0.00 H new ATOM 0 HG3 ARG B 138 -4.348 9.530 14.244 1.00 0.00 H new ATOM 0 HD2 ARG B 138 -5.833 10.075 12.630 1.00 0.00 H new ATOM 0 HD3 ARG B 138 -5.171 8.893 11.518 1.00 0.00 H new ATOM 0 HE ARG B 138 -6.968 7.523 11.996 1.00 0.00 H new ATOM 0 HH11 ARG B 138 -6.390 9.675 14.743 1.00 0.00 H new ATOM 0 HH12 ARG B 138 -7.782 9.075 15.650 1.00 0.00 H new ATOM 0 HH21 ARG B 138 -8.751 6.764 13.170 1.00 0.00 H new ATOM 0 HH22 ARG B 138 -9.112 7.436 14.764 1.00 0.00 H new ATOM 1775 N LEU B 139 -0.147 7.179 13.737 1.00 0.00 N ATOM 1776 CA LEU B 139 0.552 5.985 14.223 1.00 0.00 C ATOM 1777 C LEU B 139 -0.403 4.984 14.872 1.00 0.00 C ATOM 1778 O LEU B 139 -0.368 4.765 16.083 1.00 0.00 O ATOM 1779 CB LEU B 139 1.670 6.373 15.192 1.00 0.00 C ATOM 1780 CG LEU B 139 3.027 5.759 14.893 1.00 0.00 C ATOM 1781 CD1 LEU B 139 3.913 5.846 16.125 1.00 0.00 C ATOM 1782 CD2 LEU B 139 2.895 4.312 14.427 1.00 0.00 C ATOM 0 H LEU B 139 0.295 7.617 12.929 1.00 0.00 H new ATOM 0 HA LEU B 139 0.994 5.493 13.357 1.00 0.00 H new ATOM 0 HB2 LEU B 139 1.771 7.458 15.189 1.00 0.00 H new ATOM 0 HB3 LEU B 139 1.372 6.084 16.200 1.00 0.00 H new ATOM 0 HG LEU B 139 3.486 6.322 14.081 1.00 0.00 H new ATOM 0 HD11 LEU B 139 4.885 5.404 15.906 1.00 0.00 H new ATOM 0 HD12 LEU B 139 4.044 6.891 16.406 1.00 0.00 H new ATOM 0 HD13 LEU B 139 3.446 5.305 16.948 1.00 0.00 H new ATOM 0 HD21 LEU B 139 3.885 3.904 14.222 1.00 0.00 H new ATOM 0 HD22 LEU B 139 2.413 3.721 15.206 1.00 0.00 H new ATOM 0 HD23 LEU B 139 2.292 4.276 13.519 1.00 0.00 H new ATOM 1794 N ARG B 140 -1.254 4.381 14.049 1.00 0.00 N ATOM 1795 CA ARG B 140 -2.222 3.401 14.524 1.00 0.00 C ATOM 1796 C ARG B 140 -2.548 2.394 13.421 1.00 0.00 C ATOM 1797 O ARG B 140 -3.708 2.212 13.050 1.00 0.00 O ATOM 1798 CB ARG B 140 -3.497 4.105 15.000 1.00 0.00 C ATOM 1799 CG ARG B 140 -3.917 3.715 16.407 1.00 0.00 C ATOM 1800 CD ARG B 140 -4.129 2.215 16.534 1.00 0.00 C ATOM 1801 NE ARG B 140 -5.472 1.891 17.009 1.00 0.00 N ATOM 1802 CZ ARG B 140 -5.803 0.728 17.565 1.00 0.00 C ATOM 1803 NH1 ARG B 140 -4.893 -0.227 17.714 1.00 0.00 N ATOM 1804 NH2 ARG B 140 -7.047 0.518 17.972 1.00 0.00 N ATOM 0 H ARG B 140 -1.292 4.555 13.045 1.00 0.00 H new ATOM 0 HA ARG B 140 -1.787 2.861 15.365 1.00 0.00 H new ATOM 0 HB2 ARG B 140 -3.343 5.183 14.961 1.00 0.00 H new ATOM 0 HB3 ARG B 140 -4.309 3.874 14.310 1.00 0.00 H new ATOM 0 HG2 ARG B 140 -3.155 4.036 17.117 1.00 0.00 H new ATOM 0 HG3 ARG B 140 -4.837 4.236 16.670 1.00 0.00 H new ATOM 0 HD2 ARG B 140 -3.963 1.742 15.566 1.00 0.00 H new ATOM 0 HD3 ARG B 140 -3.391 1.801 17.222 1.00 0.00 H new ATOM 0 HE ARG B 140 -6.200 2.599 16.908 1.00 0.00 H new ATOM 0 HH11 ARG B 140 -3.935 -0.071 17.402 1.00 0.00 H new ATOM 0 HH12 ARG B 140 -5.152 -1.116 18.141 1.00 0.00 H new ATOM 0 HH21 ARG B 140 -7.751 1.248 17.859 1.00 0.00 H new ATOM 0 HH22 ARG B 140 -7.301 -0.373 18.398 1.00 0.00 H new ATOM 1818 N ALA B 141 -1.510 1.749 12.898 1.00 0.00 N ATOM 1819 CA ALA B 141 -1.673 0.765 11.833 1.00 0.00 C ATOM 1820 C ALA B 141 -2.631 -0.349 12.244 1.00 0.00 C ATOM 1821 O ALA B 141 -3.354 -0.228 13.233 1.00 0.00 O ATOM 1822 CB ALA B 141 -0.320 0.184 11.445 1.00 0.00 C ATOM 0 H ALA B 141 -0.545 1.890 13.195 1.00 0.00 H new ATOM 0 HA ALA B 141 -2.105 1.272 10.970 1.00 0.00 H new ATOM 0 HB1 ALA B 141 -0.453 -0.549 10.650 1.00 0.00 H new ATOM 0 HB2 ALA B 141 0.333 0.984 11.095 1.00 0.00 H new ATOM 0 HB3 ALA B 141 0.131 -0.299 12.312 1.00 0.00 H new ATOM 1828 N GLU B 142 -2.630 -1.435 11.477 1.00 0.00 N ATOM 1829 CA GLU B 142 -3.493 -2.569 11.753 1.00 0.00 C ATOM 1830 C GLU B 142 -2.908 -3.851 11.168 1.00 0.00 C ATOM 1831 O GLU B 142 -2.063 -3.807 10.274 1.00 0.00 O ATOM 1832 CB GLU B 142 -4.890 -2.323 11.183 1.00 0.00 C ATOM 1833 CG GLU B 142 -5.969 -3.187 11.816 1.00 0.00 C ATOM 1834 CD GLU B 142 -7.360 -2.619 11.617 1.00 0.00 C ATOM 1835 OE1 GLU B 142 -7.581 -1.932 10.598 1.00 0.00 O ATOM 1836 OE2 GLU B 142 -8.229 -2.862 12.482 1.00 0.00 O ATOM 0 H GLU B 142 -2.036 -1.550 10.656 1.00 0.00 H new ATOM 0 HA GLU B 142 -3.566 -2.685 12.834 1.00 0.00 H new ATOM 0 HB2 GLU B 142 -5.150 -1.273 11.321 1.00 0.00 H new ATOM 0 HB3 GLU B 142 -4.872 -2.508 10.109 1.00 0.00 H new ATOM 0 HG2 GLU B 142 -5.925 -4.189 11.389 1.00 0.00 H new ATOM 0 HG3 GLU B 142 -5.770 -3.287 12.883 1.00 0.00 H new ATOM 1843 N ARG B 143 -3.360 -4.991 11.679 1.00 0.00 N ATOM 1844 CA ARG B 143 -2.878 -6.284 11.206 1.00 0.00 C ATOM 1845 C ARG B 143 -4.023 -7.127 10.654 1.00 0.00 C ATOM 1846 O ARG B 143 -4.867 -7.615 11.406 1.00 0.00 O ATOM 1847 CB ARG B 143 -2.177 -7.036 12.339 1.00 0.00 C ATOM 1848 CG ARG B 143 -0.851 -6.417 12.752 1.00 0.00 C ATOM 1849 CD ARG B 143 -0.515 -6.737 14.200 1.00 0.00 C ATOM 1850 NE ARG B 143 0.635 -5.972 14.676 1.00 0.00 N ATOM 1851 CZ ARG B 143 0.592 -4.675 14.974 1.00 0.00 C ATOM 1852 NH1 ARG B 143 -0.542 -3.996 14.847 1.00 0.00 N ATOM 1853 NH2 ARG B 143 1.684 -4.056 15.402 1.00 0.00 N ATOM 0 H ARG B 143 -4.059 -5.046 12.420 1.00 0.00 H new ATOM 0 HA ARG B 143 -2.165 -6.103 10.402 1.00 0.00 H new ATOM 0 HB2 ARG B 143 -2.838 -7.069 13.205 1.00 0.00 H new ATOM 0 HB3 ARG B 143 -2.006 -8.067 12.028 1.00 0.00 H new ATOM 0 HG2 ARG B 143 -0.057 -6.787 12.103 1.00 0.00 H new ATOM 0 HG3 ARG B 143 -0.895 -5.336 12.618 1.00 0.00 H new ATOM 0 HD2 ARG B 143 -1.379 -6.522 14.829 1.00 0.00 H new ATOM 0 HD3 ARG B 143 -0.307 -7.803 14.297 1.00 0.00 H new ATOM 0 HE ARG B 143 1.524 -6.460 14.787 1.00 0.00 H new ATOM 0 HH11 ARG B 143 -1.385 -4.468 14.520 1.00 0.00 H new ATOM 0 HH12 ARG B 143 -0.570 -3.003 15.077 1.00 0.00 H new ATOM 0 HH21 ARG B 143 2.557 -4.574 15.503 1.00 0.00 H new ATOM 0 HH22 ARG B 143 1.651 -3.062 15.630 1.00 0.00 H new ATOM 1867 N TRP B 144 -4.045 -7.296 9.336 1.00 0.00 N ATOM 1868 CA TRP B 144 -5.085 -8.082 8.683 1.00 0.00 C ATOM 1869 C TRP B 144 -4.743 -8.325 7.216 1.00 0.00 C ATOM 1870 O TRP B 144 -5.264 -7.653 6.327 1.00 0.00 O ATOM 1871 CB TRP B 144 -6.436 -7.374 8.795 1.00 0.00 C ATOM 1872 CG TRP B 144 -6.447 -6.012 8.170 1.00 0.00 C ATOM 1873 CD1 TRP B 144 -5.576 -4.990 8.416 1.00 0.00 C ATOM 1874 CD2 TRP B 144 -7.375 -5.524 7.195 1.00 0.00 C ATOM 1875 NE1 TRP B 144 -5.906 -3.895 7.654 1.00 0.00 N ATOM 1876 CE2 TRP B 144 -7.007 -4.198 6.896 1.00 0.00 C ATOM 1877 CE3 TRP B 144 -8.481 -6.079 6.546 1.00 0.00 C ATOM 1878 CZ2 TRP B 144 -7.706 -3.421 5.976 1.00 0.00 C ATOM 1879 CZ3 TRP B 144 -9.175 -5.306 5.633 1.00 0.00 C ATOM 1880 CH2 TRP B 144 -8.785 -3.990 5.355 1.00 0.00 C ATOM 0 H TRP B 144 -3.354 -6.899 8.699 1.00 0.00 H new ATOM 0 HA TRP B 144 -5.147 -9.047 9.187 1.00 0.00 H new ATOM 0 HB2 TRP B 144 -7.201 -7.989 8.321 1.00 0.00 H new ATOM 0 HB3 TRP B 144 -6.705 -7.285 9.847 1.00 0.00 H new ATOM 0 HD1 TRP B 144 -4.748 -5.035 9.108 1.00 0.00 H new ATOM 0 HE1 TRP B 144 -5.412 -3.002 7.653 1.00 0.00 H new ATOM 0 HE3 TRP B 144 -8.788 -7.093 6.754 1.00 0.00 H new ATOM 0 HZ2 TRP B 144 -7.408 -2.406 5.760 1.00 0.00 H new ATOM 0 HZ3 TRP B 144 -10.032 -5.724 5.126 1.00 0.00 H new ATOM 0 HH2 TRP B 144 -9.347 -3.412 4.636 1.00 0.00 H new ATOM 1891 N LYS B 145 -3.863 -9.290 6.972 1.00 0.00 N ATOM 1892 CA LYS B 145 -3.450 -9.622 5.613 1.00 0.00 C ATOM 1893 C LYS B 145 -4.427 -10.601 4.970 1.00 0.00 C ATOM 1894 O LYS B 145 -5.482 -10.899 5.531 1.00 0.00 O ATOM 1895 CB LYS B 145 -2.041 -10.219 5.618 1.00 0.00 C ATOM 1896 CG LYS B 145 -1.032 -9.389 6.396 1.00 0.00 C ATOM 1897 CD LYS B 145 -0.254 -10.238 7.389 1.00 0.00 C ATOM 1898 CE LYS B 145 0.009 -9.483 8.681 1.00 0.00 C ATOM 1899 NZ LYS B 145 -1.238 -9.280 9.469 1.00 0.00 N ATOM 0 H LYS B 145 -3.422 -9.856 7.697 1.00 0.00 H new ATOM 0 HA LYS B 145 -3.447 -8.703 5.027 1.00 0.00 H new ATOM 0 HB2 LYS B 145 -2.081 -11.221 6.045 1.00 0.00 H new ATOM 0 HB3 LYS B 145 -1.696 -10.325 4.589 1.00 0.00 H new ATOM 0 HG2 LYS B 145 -0.339 -8.914 5.702 1.00 0.00 H new ATOM 0 HG3 LYS B 145 -1.550 -8.590 6.927 1.00 0.00 H new ATOM 0 HD2 LYS B 145 -0.812 -11.149 7.606 1.00 0.00 H new ATOM 0 HD3 LYS B 145 0.694 -10.543 6.945 1.00 0.00 H new ATOM 0 HE2 LYS B 145 0.733 -10.033 9.282 1.00 0.00 H new ATOM 0 HE3 LYS B 145 0.455 -8.515 8.452 1.00 0.00 H new ATOM 0 HZ1 LYS B 145 -1.003 -9.215 10.480 1.00 0.00 H new ATOM 0 HZ2 LYS B 145 -1.702 -8.401 9.164 1.00 0.00 H new ATOM 0 HZ3 LYS B 145 -1.881 -10.082 9.314 1.00 0.00 H new ATOM 1913 N VAL B 146 -4.070 -11.097 3.790 1.00 0.00 N ATOM 1914 CA VAL B 146 -4.915 -12.041 3.070 1.00 0.00 C ATOM 1915 C VAL B 146 -4.758 -13.454 3.622 1.00 0.00 C ATOM 1916 O VAL B 146 -3.759 -13.771 4.268 1.00 0.00 O ATOM 1917 CB VAL B 146 -4.589 -12.053 1.564 1.00 0.00 C ATOM 1918 CG1 VAL B 146 -5.608 -12.886 0.802 1.00 0.00 C ATOM 1919 CG2 VAL B 146 -4.536 -10.634 1.019 1.00 0.00 C ATOM 0 H VAL B 146 -3.200 -10.860 3.312 1.00 0.00 H new ATOM 0 HA VAL B 146 -5.944 -11.711 3.210 1.00 0.00 H new ATOM 0 HB VAL B 146 -3.608 -12.508 1.427 1.00 0.00 H new ATOM 0 HG11 VAL B 146 -5.360 -12.882 -0.260 1.00 0.00 H new ATOM 0 HG12 VAL B 146 -5.592 -13.910 1.174 1.00 0.00 H new ATOM 0 HG13 VAL B 146 -6.603 -12.464 0.944 1.00 0.00 H new ATOM 0 HG21 VAL B 146 -4.305 -10.662 -0.046 1.00 0.00 H new ATOM 0 HG22 VAL B 146 -5.502 -10.151 1.168 1.00 0.00 H new ATOM 0 HG23 VAL B 146 -3.764 -10.071 1.544 1.00 0.00 H new ATOM 1929 N GLU B 147 -5.751 -14.298 3.365 1.00 0.00 N ATOM 1930 CA GLU B 147 -5.723 -15.678 3.837 1.00 0.00 C ATOM 1931 C GLU B 147 -5.265 -16.622 2.730 1.00 0.00 C ATOM 1932 O GLU B 147 -4.145 -17.133 2.761 1.00 0.00 O ATOM 1933 CB GLU B 147 -7.107 -16.093 4.343 1.00 0.00 C ATOM 1934 CG GLU B 147 -7.130 -16.457 5.819 1.00 0.00 C ATOM 1935 CD GLU B 147 -8.492 -16.245 6.450 1.00 0.00 C ATOM 1936 OE1 GLU B 147 -8.984 -15.097 6.429 1.00 0.00 O ATOM 1937 OE2 GLU B 147 -9.067 -17.227 6.966 1.00 0.00 O ATOM 0 H GLU B 147 -6.585 -14.051 2.833 1.00 0.00 H new ATOM 0 HA GLU B 147 -5.010 -15.742 4.659 1.00 0.00 H new ATOM 0 HB2 GLU B 147 -7.809 -15.278 4.167 1.00 0.00 H new ATOM 0 HB3 GLU B 147 -7.457 -16.946 3.761 1.00 0.00 H new ATOM 0 HG2 GLU B 147 -6.837 -17.500 5.937 1.00 0.00 H new ATOM 0 HG3 GLU B 147 -6.391 -15.857 6.349 1.00 0.00 H new ATOM 1944 N ASN B 148 -6.138 -16.850 1.754 1.00 0.00 N ATOM 1945 CA ASN B 148 -5.823 -17.734 0.637 1.00 0.00 C ATOM 1946 C ASN B 148 -5.850 -16.972 -0.684 1.00 0.00 C ATOM 1947 O ASN B 148 -6.083 -15.764 -0.711 1.00 0.00 O ATOM 1948 CB ASN B 148 -6.812 -18.899 0.588 1.00 0.00 C ATOM 1949 CG ASN B 148 -8.255 -18.433 0.567 1.00 0.00 C ATOM 1950 OD1 ASN B 148 -8.540 -17.250 0.757 1.00 0.00 O ATOM 1951 ND2 ASN B 148 -9.174 -19.363 0.337 1.00 0.00 N ATOM 0 H ASN B 148 -7.069 -16.435 1.714 1.00 0.00 H new ATOM 0 HA ASN B 148 -4.817 -18.126 0.788 1.00 0.00 H new ATOM 0 HB2 ASN B 148 -6.615 -19.502 -0.298 1.00 0.00 H new ATOM 0 HB3 ASN B 148 -6.654 -19.543 1.453 1.00 0.00 H new ATOM 0 HD21 ASN B 148 -10.162 -19.109 0.312 1.00 0.00 H new ATOM 0 HD22 ASN B 148 -8.893 -20.332 0.185 1.00 0.00 H new ATOM 1958 N GLN B 149 -5.611 -17.688 -1.779 1.00 0.00 N ATOM 1959 CA GLN B 149 -5.609 -17.080 -3.105 1.00 0.00 C ATOM 1960 C GLN B 149 -6.706 -17.678 -3.979 1.00 0.00 C ATOM 1961 O GLN B 149 -7.389 -18.620 -3.578 1.00 0.00 O ATOM 1962 CB GLN B 149 -4.246 -17.271 -3.774 1.00 0.00 C ATOM 1963 CG GLN B 149 -3.690 -18.679 -3.631 1.00 0.00 C ATOM 1964 CD GLN B 149 -4.513 -19.709 -4.379 1.00 0.00 C ATOM 1965 OE1 GLN B 149 -5.162 -20.562 -3.773 1.00 0.00 O ATOM 1966 NE2 GLN B 149 -4.491 -19.635 -5.705 1.00 0.00 N ATOM 0 H GLN B 149 -5.416 -18.689 -1.774 1.00 0.00 H new ATOM 0 HA GLN B 149 -5.803 -16.014 -2.989 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -4.334 -17.030 -4.833 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -3.537 -16.564 -3.344 1.00 0.00 H new ATOM 0 HG2 GLN B 149 -2.665 -18.700 -4.001 1.00 0.00 H new ATOM 0 HG3 GLN B 149 -3.653 -18.946 -2.575 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -3.939 -18.912 -6.166 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -5.026 -20.301 -6.262 1.00 0.00 H new ATOM 1975 N GLU B 150 -6.871 -17.123 -5.175 1.00 0.00 N ATOM 1976 CA GLU B 150 -7.887 -17.600 -6.106 1.00 0.00 C ATOM 1977 C GLU B 150 -7.245 -18.286 -7.309 1.00 0.00 C ATOM 1978 O GLU B 150 -7.494 -19.463 -7.570 1.00 0.00 O ATOM 1979 CB GLU B 150 -8.764 -16.439 -6.576 1.00 0.00 C ATOM 1980 CG GLU B 150 -10.110 -16.879 -7.130 1.00 0.00 C ATOM 1981 CD GLU B 150 -11.272 -16.130 -6.507 1.00 0.00 C ATOM 1982 OE1 GLU B 150 -11.335 -14.893 -6.667 1.00 0.00 O ATOM 1983 OE2 GLU B 150 -12.118 -16.781 -5.859 1.00 0.00 O ATOM 0 H GLU B 150 -6.314 -16.342 -5.522 1.00 0.00 H new ATOM 0 HA GLU B 150 -8.508 -18.328 -5.584 1.00 0.00 H new ATOM 0 HB2 GLU B 150 -8.929 -15.758 -5.741 1.00 0.00 H new ATOM 0 HB3 GLU B 150 -8.230 -15.879 -7.344 1.00 0.00 H new ATOM 0 HG2 GLU B 150 -10.122 -16.727 -8.209 1.00 0.00 H new ATOM 0 HG3 GLU B 150 -10.238 -17.948 -6.958 1.00 0.00 H new ATOM 1990 N GLY B 151 -6.420 -17.542 -8.037 1.00 0.00 N ATOM 1991 CA GLY B 151 -5.757 -18.095 -9.204 1.00 0.00 C ATOM 1992 C GLY B 151 -6.646 -18.092 -10.432 1.00 0.00 C ATOM 1993 O GLY B 151 -6.456 -18.896 -11.345 1.00 0.00 O ATOM 0 H GLY B 151 -6.198 -16.566 -7.840 1.00 0.00 H new ATOM 0 HA2 GLY B 151 -4.854 -17.520 -9.411 1.00 0.00 H new ATOM 0 HA3 GLY B 151 -5.443 -19.116 -8.989 1.00 0.00 H new ATOM 1997 N MET B 152 -7.618 -17.186 -10.456 1.00 0.00 N ATOM 1998 CA MET B 152 -8.539 -17.082 -11.582 1.00 0.00 C ATOM 1999 C MET B 152 -9.425 -15.848 -11.447 1.00 0.00 C ATOM 2000 O MET B 152 -10.475 -15.892 -10.807 1.00 0.00 O ATOM 2001 CB MET B 152 -9.407 -18.338 -11.676 1.00 0.00 C ATOM 2002 CG MET B 152 -9.990 -18.775 -10.342 1.00 0.00 C ATOM 2003 SD MET B 152 -11.424 -19.852 -10.531 1.00 0.00 S ATOM 2004 CE MET B 152 -11.225 -20.931 -9.116 1.00 0.00 C ATOM 0 H MET B 152 -7.788 -16.513 -9.708 1.00 0.00 H new ATOM 0 HA MET B 152 -7.949 -16.987 -12.494 1.00 0.00 H new ATOM 0 HB2 MET B 152 -10.222 -18.155 -12.377 1.00 0.00 H new ATOM 0 HB3 MET B 152 -8.810 -19.152 -12.087 1.00 0.00 H new ATOM 0 HG2 MET B 152 -9.223 -19.295 -9.767 1.00 0.00 H new ATOM 0 HG3 MET B 152 -10.276 -17.893 -9.768 1.00 0.00 H new ATOM 0 HE1 MET B 152 -12.038 -21.656 -9.094 1.00 0.00 H new ATOM 0 HE2 MET B 152 -10.273 -21.456 -9.190 1.00 0.00 H new ATOM 0 HE3 MET B 152 -11.243 -20.338 -8.201 1.00 0.00 H new ATOM 2014 N VAL B 153 -8.992 -14.747 -12.053 1.00 0.00 N ATOM 2015 CA VAL B 153 -9.744 -13.499 -11.999 1.00 0.00 C ATOM 2016 C VAL B 153 -11.152 -13.676 -12.558 1.00 0.00 C ATOM 2017 O VAL B 153 -12.115 -13.127 -12.022 1.00 0.00 O ATOM 2018 CB VAL B 153 -9.030 -12.379 -12.779 1.00 0.00 C ATOM 2019 CG1 VAL B 153 -7.752 -11.964 -12.067 1.00 0.00 C ATOM 2020 CG2 VAL B 153 -8.736 -12.822 -14.204 1.00 0.00 C ATOM 0 H VAL B 153 -8.125 -14.694 -12.587 1.00 0.00 H new ATOM 0 HA VAL B 153 -9.809 -13.216 -10.948 1.00 0.00 H new ATOM 0 HB VAL B 153 -9.692 -11.514 -12.823 1.00 0.00 H new ATOM 0 HG11 VAL B 153 -7.261 -11.172 -12.633 1.00 0.00 H new ATOM 0 HG12 VAL B 153 -7.994 -11.600 -11.068 1.00 0.00 H new ATOM 0 HG13 VAL B 153 -7.084 -12.822 -11.989 1.00 0.00 H new ATOM 0 HG21 VAL B 153 -8.232 -12.017 -14.739 1.00 0.00 H new ATOM 0 HG22 VAL B 153 -8.095 -13.703 -14.186 1.00 0.00 H new ATOM 0 HG23 VAL B 153 -9.671 -13.064 -14.710 1.00 0.00 H new ATOM 2030 N GLU B 154 -11.268 -14.445 -13.637 1.00 0.00 N ATOM 2031 CA GLU B 154 -12.563 -14.689 -14.261 1.00 0.00 C ATOM 2032 C GLU B 154 -12.723 -16.168 -14.629 1.00 0.00 C ATOM 2033 O GLU B 154 -13.116 -16.968 -13.783 1.00 0.00 O ATOM 2034 CB GLU B 154 -12.732 -13.791 -15.493 1.00 0.00 C ATOM 2035 CG GLU B 154 -14.015 -14.049 -16.269 1.00 0.00 C ATOM 2036 CD GLU B 154 -14.312 -12.960 -17.282 1.00 0.00 C ATOM 2037 OE1 GLU B 154 -13.524 -12.810 -18.240 1.00 0.00 O ATOM 2038 OE2 GLU B 154 -15.331 -12.258 -17.117 1.00 0.00 O ATOM 0 H GLU B 154 -10.483 -14.908 -14.095 1.00 0.00 H new ATOM 0 HA GLU B 154 -13.347 -14.442 -13.545 1.00 0.00 H new ATOM 0 HB2 GLU B 154 -12.713 -12.748 -15.176 1.00 0.00 H new ATOM 0 HB3 GLU B 154 -11.881 -13.938 -16.158 1.00 0.00 H new ATOM 0 HG2 GLU B 154 -13.938 -15.007 -16.783 1.00 0.00 H new ATOM 0 HG3 GLU B 154 -14.848 -14.128 -15.571 1.00 0.00 H new ATOM 2045 N VAL B 155 -12.420 -16.512 -15.892 1.00 0.00 N ATOM 2046 CA VAL B 155 -12.517 -17.876 -16.416 1.00 0.00 C ATOM 2047 C VAL B 155 -13.009 -17.828 -17.857 1.00 0.00 C ATOM 2048 O VAL B 155 -14.212 -17.755 -18.112 1.00 0.00 O ATOM 2049 CB VAL B 155 -13.449 -18.777 -15.575 1.00 0.00 C ATOM 2050 CG1 VAL B 155 -14.061 -19.889 -16.417 1.00 0.00 C ATOM 2051 CG2 VAL B 155 -12.679 -19.357 -14.403 1.00 0.00 C ATOM 0 H VAL B 155 -12.096 -15.837 -16.584 1.00 0.00 H new ATOM 0 HA VAL B 155 -11.521 -18.316 -16.365 1.00 0.00 H new ATOM 0 HB VAL B 155 -14.269 -18.165 -15.199 1.00 0.00 H new ATOM 0 HG11 VAL B 155 -14.710 -20.503 -15.793 1.00 0.00 H new ATOM 0 HG12 VAL B 155 -14.644 -19.452 -17.228 1.00 0.00 H new ATOM 0 HG13 VAL B 155 -13.267 -20.509 -16.834 1.00 0.00 H new ATOM 0 HG21 VAL B 155 -13.339 -19.992 -13.812 1.00 0.00 H new ATOM 0 HG22 VAL B 155 -11.843 -19.949 -14.774 1.00 0.00 H new ATOM 0 HG23 VAL B 155 -12.301 -18.547 -13.779 1.00 0.00 H new ATOM 2061 N ALA B 156 -12.072 -17.846 -18.797 1.00 0.00 N ATOM 2062 CA ALA B 156 -12.404 -17.783 -20.203 1.00 0.00 C ATOM 2063 C ALA B 156 -11.145 -17.999 -20.993 1.00 0.00 C ATOM 2064 O ALA B 156 -10.972 -19.012 -21.670 1.00 0.00 O ATOM 2065 CB ALA B 156 -12.992 -16.426 -20.532 1.00 0.00 C ATOM 0 H ALA B 156 -11.072 -17.904 -18.603 1.00 0.00 H new ATOM 0 HA ALA B 156 -13.139 -18.549 -20.451 1.00 0.00 H new ATOM 0 HB1 ALA B 156 -13.240 -16.384 -21.593 1.00 0.00 H new ATOM 0 HB2 ALA B 156 -13.895 -16.268 -19.942 1.00 0.00 H new ATOM 0 HB3 ALA B 156 -12.265 -15.648 -20.299 1.00 0.00 H new ATOM 2071 N ARG B 157 -10.246 -17.041 -20.856 1.00 0.00 N ATOM 2072 CA ARG B 157 -8.970 -17.120 -21.508 1.00 0.00 C ATOM 2073 C ARG B 157 -8.087 -15.933 -21.141 1.00 0.00 C ATOM 2074 O ARG B 157 -8.528 -14.784 -21.168 1.00 0.00 O ATOM 2075 CB ARG B 157 -9.128 -17.222 -23.029 1.00 0.00 C ATOM 2076 CG ARG B 157 -10.269 -16.384 -23.590 1.00 0.00 C ATOM 2077 CD ARG B 157 -9.887 -14.916 -23.705 1.00 0.00 C ATOM 2078 NE ARG B 157 -10.756 -14.059 -22.901 1.00 0.00 N ATOM 2079 CZ ARG B 157 -10.915 -12.754 -23.113 1.00 0.00 C ATOM 2080 NH1 ARG B 157 -10.262 -12.149 -24.097 1.00 0.00 N ATOM 2081 NH2 ARG B 157 -11.730 -12.052 -22.338 1.00 0.00 N ATOM 0 H ARG B 157 -10.385 -16.200 -20.295 1.00 0.00 H new ATOM 0 HA ARG B 157 -8.481 -18.028 -21.156 1.00 0.00 H new ATOM 0 HB2 ARG B 157 -8.196 -16.912 -23.502 1.00 0.00 H new ATOM 0 HB3 ARG B 157 -9.291 -18.266 -23.298 1.00 0.00 H new ATOM 0 HG2 ARG B 157 -10.551 -16.764 -24.572 1.00 0.00 H new ATOM 0 HG3 ARG B 157 -11.143 -16.483 -22.947 1.00 0.00 H new ATOM 0 HD2 ARG B 157 -8.853 -14.785 -23.386 1.00 0.00 H new ATOM 0 HD3 ARG B 157 -9.940 -14.608 -24.749 1.00 0.00 H new ATOM 0 HE ARG B 157 -11.272 -14.486 -22.131 1.00 0.00 H new ATOM 0 HH11 ARG B 157 -9.634 -12.684 -24.697 1.00 0.00 H new ATOM 0 HH12 ARG B 157 -10.388 -11.149 -24.254 1.00 0.00 H new ATOM 0 HH21 ARG B 157 -12.235 -12.512 -21.580 1.00 0.00 H new ATOM 0 HH22 ARG B 157 -11.852 -11.052 -22.500 1.00 0.00 H new ATOM 2095 N PHE B 158 -6.836 -16.221 -20.795 1.00 0.00 N ATOM 2096 CA PHE B 158 -5.886 -15.180 -20.418 1.00 0.00 C ATOM 2097 C PHE B 158 -4.455 -15.709 -20.465 1.00 0.00 C ATOM 2098 O PHE B 158 -3.820 -15.906 -19.429 1.00 0.00 O ATOM 2099 CB PHE B 158 -6.202 -14.643 -19.018 1.00 0.00 C ATOM 2100 CG PHE B 158 -6.776 -15.674 -18.085 1.00 0.00 C ATOM 2101 CD1 PHE B 158 -5.946 -16.537 -17.388 1.00 0.00 C ATOM 2102 CD2 PHE B 158 -8.147 -15.778 -17.907 1.00 0.00 C ATOM 2103 CE1 PHE B 158 -6.472 -17.484 -16.530 1.00 0.00 C ATOM 2104 CE2 PHE B 158 -8.678 -16.724 -17.050 1.00 0.00 C ATOM 2105 CZ PHE B 158 -7.840 -17.578 -16.361 1.00 0.00 C ATOM 0 H PHE B 158 -6.456 -17.167 -20.768 1.00 0.00 H new ATOM 0 HA PHE B 158 -5.978 -14.365 -21.135 1.00 0.00 H new ATOM 0 HB2 PHE B 158 -5.289 -14.239 -18.580 1.00 0.00 H new ATOM 0 HB3 PHE B 158 -6.906 -13.816 -19.107 1.00 0.00 H new ATOM 0 HD1 PHE B 158 -4.876 -16.469 -17.517 1.00 0.00 H new ATOM 0 HD2 PHE B 158 -8.807 -15.113 -18.444 1.00 0.00 H new ATOM 0 HE1 PHE B 158 -5.814 -18.150 -15.992 1.00 0.00 H new ATOM 0 HE2 PHE B 158 -9.748 -16.795 -16.920 1.00 0.00 H new ATOM 0 HZ PHE B 158 -8.253 -18.318 -15.691 1.00 0.00 H new ATOM 2115 N ILE B 159 -3.955 -15.937 -21.675 1.00 0.00 N ATOM 2116 CA ILE B 159 -2.600 -16.442 -21.861 1.00 0.00 C ATOM 2117 C ILE B 159 -1.569 -15.336 -21.630 1.00 0.00 C ATOM 2118 O ILE B 159 -1.928 -14.170 -21.464 1.00 0.00 O ATOM 2119 CB ILE B 159 -2.421 -17.049 -23.274 1.00 0.00 C ATOM 2120 CG1 ILE B 159 -1.309 -18.101 -23.270 1.00 0.00 C ATOM 2121 CG2 ILE B 159 -2.132 -15.965 -24.307 1.00 0.00 C ATOM 2122 CD1 ILE B 159 -1.702 -19.395 -23.948 1.00 0.00 C ATOM 0 H ILE B 159 -4.469 -15.780 -22.542 1.00 0.00 H new ATOM 0 HA ILE B 159 -2.438 -17.229 -21.124 1.00 0.00 H new ATOM 0 HB ILE B 159 -3.356 -17.535 -23.552 1.00 0.00 H new ATOM 0 HG12 ILE B 159 -0.430 -17.691 -23.768 1.00 0.00 H new ATOM 0 HG13 ILE B 159 -1.023 -18.312 -22.240 1.00 0.00 H new ATOM 0 HG21 ILE B 159 -2.011 -16.422 -25.289 1.00 0.00 H new ATOM 0 HG22 ILE B 159 -2.962 -15.258 -24.335 1.00 0.00 H new ATOM 0 HG23 ILE B 159 -1.216 -15.439 -24.036 1.00 0.00 H new ATOM 0 HD11 ILE B 159 -0.867 -20.095 -23.908 1.00 0.00 H new ATOM 0 HD12 ILE B 159 -2.562 -19.827 -23.437 1.00 0.00 H new ATOM 0 HD13 ILE B 159 -1.960 -19.197 -24.988 1.00 0.00 H new ATOM 2134 N GLU B 160 -0.290 -15.709 -21.616 1.00 0.00 N ATOM 2135 CA GLU B 160 0.793 -14.749 -21.401 1.00 0.00 C ATOM 2136 C GLU B 160 0.571 -13.468 -22.204 1.00 0.00 C ATOM 2137 O GLU B 160 0.253 -13.516 -23.392 1.00 0.00 O ATOM 2138 CB GLU B 160 2.137 -15.375 -21.783 1.00 0.00 C ATOM 2139 CG GLU B 160 3.322 -14.443 -21.585 1.00 0.00 C ATOM 2140 CD GLU B 160 4.277 -14.454 -22.764 1.00 0.00 C ATOM 2141 OE1 GLU B 160 4.702 -15.555 -23.173 1.00 0.00 O ATOM 2142 OE2 GLU B 160 4.598 -13.362 -23.277 1.00 0.00 O ATOM 0 H GLU B 160 0.022 -16.671 -21.751 1.00 0.00 H new ATOM 0 HA GLU B 160 0.802 -14.489 -20.343 1.00 0.00 H new ATOM 0 HB2 GLU B 160 2.291 -16.276 -21.188 1.00 0.00 H new ATOM 0 HB3 GLU B 160 2.100 -15.685 -22.827 1.00 0.00 H new ATOM 0 HG2 GLU B 160 2.958 -13.428 -21.426 1.00 0.00 H new ATOM 0 HG3 GLU B 160 3.861 -14.733 -20.683 1.00 0.00 H new ATOM 2149 N MET B 161 0.737 -12.327 -21.543 1.00 0.00 N ATOM 2150 CA MET B 161 0.552 -11.033 -22.191 1.00 0.00 C ATOM 2151 C MET B 161 1.790 -10.157 -22.023 1.00 0.00 C ATOM 2152 O MET B 161 2.585 -10.358 -21.105 1.00 0.00 O ATOM 2153 CB MET B 161 -0.673 -10.322 -21.610 1.00 0.00 C ATOM 2154 CG MET B 161 -1.510 -9.600 -22.652 1.00 0.00 C ATOM 2155 SD MET B 161 -3.076 -8.999 -21.991 1.00 0.00 S ATOM 2156 CE MET B 161 -3.908 -10.544 -21.632 1.00 0.00 C ATOM 0 H MET B 161 0.999 -12.272 -20.559 1.00 0.00 H new ATOM 0 HA MET B 161 0.395 -11.206 -23.256 1.00 0.00 H new ATOM 0 HB2 MET B 161 -1.298 -11.054 -21.098 1.00 0.00 H new ATOM 0 HB3 MET B 161 -0.343 -9.603 -20.860 1.00 0.00 H new ATOM 0 HG2 MET B 161 -0.942 -8.759 -23.050 1.00 0.00 H new ATOM 0 HG3 MET B 161 -1.707 -10.275 -23.485 1.00 0.00 H new ATOM 0 HE1 MET B 161 -4.530 -10.425 -20.745 1.00 0.00 H new ATOM 0 HE2 MET B 161 -4.534 -10.826 -22.479 1.00 0.00 H new ATOM 0 HE3 MET B 161 -3.167 -11.323 -21.453 1.00 0.00 H new ATOM 2166 N ASN B 162 1.945 -9.184 -22.916 1.00 0.00 N ATOM 2167 CA ASN B 162 3.086 -8.276 -22.866 1.00 0.00 C ATOM 2168 C ASN B 162 2.646 -6.866 -22.484 1.00 0.00 C ATOM 2169 O ASN B 162 3.409 -6.109 -21.884 1.00 0.00 O ATOM 2170 CB ASN B 162 3.805 -8.252 -24.216 1.00 0.00 C ATOM 2171 CG ASN B 162 4.940 -9.255 -24.284 1.00 0.00 C ATOM 2172 OD1 ASN B 162 4.716 -10.465 -24.286 1.00 0.00 O ATOM 2173 ND2 ASN B 162 6.170 -8.755 -24.338 1.00 0.00 N ATOM 0 H ASN B 162 1.296 -9.004 -23.682 1.00 0.00 H new ATOM 0 HA ASN B 162 3.774 -8.640 -22.103 1.00 0.00 H new ATOM 0 HB2 ASN B 162 3.089 -8.464 -25.010 1.00 0.00 H new ATOM 0 HB3 ASN B 162 4.197 -7.251 -24.398 1.00 0.00 H new ATOM 0 HD21 ASN B 162 6.974 -9.381 -24.383 1.00 0.00 H new ATOM 0 HD22 ASN B 162 6.310 -7.745 -24.334 1.00 0.00 H new ATOM 2180 N GLY B 163 1.411 -6.518 -22.835 1.00 0.00 N ATOM 2181 CA GLY B 163 0.893 -5.200 -22.517 1.00 0.00 C ATOM 2182 C GLY B 163 0.372 -4.469 -23.740 1.00 0.00 C ATOM 2183 O GLY B 163 0.520 -4.944 -24.866 1.00 0.00 O ATOM 0 H GLY B 163 0.761 -7.125 -23.334 1.00 0.00 H new ATOM 0 HA2 GLY B 163 0.090 -5.296 -21.786 1.00 0.00 H new ATOM 0 HA3 GLY B 163 1.680 -4.607 -22.051 1.00 0.00 H new ATOM 2187 N SER B 164 -0.239 -3.309 -23.517 1.00 0.00 N ATOM 2188 CA SER B 164 -0.784 -2.510 -24.608 1.00 0.00 C ATOM 2189 C SER B 164 -1.176 -1.118 -24.120 1.00 0.00 C ATOM 2190 O SER B 164 -0.660 -0.111 -24.604 1.00 0.00 O ATOM 2191 CB SER B 164 -1.997 -3.211 -25.225 1.00 0.00 C ATOM 2192 OG SER B 164 -1.768 -3.520 -26.589 1.00 0.00 O ATOM 0 H SER B 164 -0.369 -2.902 -22.591 1.00 0.00 H new ATOM 0 HA SER B 164 -0.011 -2.403 -25.369 1.00 0.00 H new ATOM 0 HB2 SER B 164 -2.212 -4.126 -24.673 1.00 0.00 H new ATOM 0 HB3 SER B 164 -2.875 -2.571 -25.136 1.00 0.00 H new ATOM 0 HG SER B 164 -2.557 -3.969 -26.960 1.00 0.00 H new ATOM 2198 N PHE B 165 -2.093 -1.070 -23.159 1.00 0.00 N ATOM 2199 CA PHE B 165 -2.555 0.199 -22.606 1.00 0.00 C ATOM 2200 C PHE B 165 -2.591 0.149 -21.081 1.00 0.00 C ATOM 2201 O PHE B 165 -2.780 -0.914 -20.490 1.00 0.00 O ATOM 2202 CB PHE B 165 -3.943 0.542 -23.154 1.00 0.00 C ATOM 2203 CG PHE B 165 -3.993 1.854 -23.883 1.00 0.00 C ATOM 2204 CD1 PHE B 165 -4.221 3.036 -23.197 1.00 0.00 C ATOM 2205 CD2 PHE B 165 -3.811 1.905 -25.256 1.00 0.00 C ATOM 2206 CE1 PHE B 165 -4.266 4.244 -23.865 1.00 0.00 C ATOM 2207 CE2 PHE B 165 -3.856 3.111 -25.930 1.00 0.00 C ATOM 2208 CZ PHE B 165 -4.084 4.282 -25.234 1.00 0.00 C ATOM 0 H PHE B 165 -2.531 -1.894 -22.747 1.00 0.00 H new ATOM 0 HA PHE B 165 -1.852 0.976 -22.907 1.00 0.00 H new ATOM 0 HB2 PHE B 165 -4.265 -0.252 -23.828 1.00 0.00 H new ATOM 0 HB3 PHE B 165 -4.655 0.567 -22.329 1.00 0.00 H new ATOM 0 HD1 PHE B 165 -4.365 3.012 -22.127 1.00 0.00 H new ATOM 0 HD2 PHE B 165 -3.632 0.993 -25.805 1.00 0.00 H new ATOM 0 HE1 PHE B 165 -4.443 5.158 -23.318 1.00 0.00 H new ATOM 0 HE2 PHE B 165 -3.713 3.138 -27.000 1.00 0.00 H new ATOM 0 HZ PHE B 165 -4.120 5.225 -25.759 1.00 0.00 H new ATOM 2218 N ALA B 166 -2.411 1.309 -20.454 1.00 0.00 N ATOM 2219 CA ALA B 166 -2.421 1.413 -19.000 1.00 0.00 C ATOM 2220 C ALA B 166 -1.240 0.685 -18.387 1.00 0.00 C ATOM 2221 O ALA B 166 -0.295 1.298 -17.891 1.00 0.00 O ATOM 2222 CB ALA B 166 -3.731 0.877 -18.439 1.00 0.00 C ATOM 0 H ALA B 166 -2.256 2.195 -20.935 1.00 0.00 H new ATOM 0 HA ALA B 166 -2.334 2.467 -18.738 1.00 0.00 H new ATOM 0 HB1 ALA B 166 -3.723 0.961 -17.352 1.00 0.00 H new ATOM 0 HB2 ALA B 166 -4.563 1.455 -18.842 1.00 0.00 H new ATOM 0 HB3 ALA B 166 -3.846 -0.170 -18.721 1.00 0.00 H new ATOM 2228 N ASP B 167 -1.314 -0.625 -18.435 1.00 0.00 N ATOM 2229 CA ASP B 167 -0.268 -1.486 -17.895 1.00 0.00 C ATOM 2230 C ASP B 167 -0.624 -2.955 -18.098 1.00 0.00 C ATOM 2231 O ASP B 167 0.234 -3.773 -18.430 1.00 0.00 O ATOM 2232 CB ASP B 167 -0.059 -1.206 -16.405 1.00 0.00 C ATOM 2233 CG ASP B 167 1.307 -1.653 -15.920 1.00 0.00 C ATOM 2234 OD1 ASP B 167 2.285 -0.905 -16.129 1.00 0.00 O ATOM 2235 OD2 ASP B 167 1.398 -2.750 -15.330 1.00 0.00 O ATOM 0 H ASP B 167 -2.098 -1.131 -18.848 1.00 0.00 H new ATOM 0 HA ASP B 167 0.657 -1.270 -18.429 1.00 0.00 H new ATOM 0 HB2 ASP B 167 -0.177 -0.139 -16.218 1.00 0.00 H new ATOM 0 HB3 ASP B 167 -0.831 -1.717 -15.830 1.00 0.00 H new ATOM 2240 N GLU B 168 -1.897 -3.280 -17.894 1.00 0.00 N ATOM 2241 CA GLU B 168 -2.373 -4.649 -18.052 1.00 0.00 C ATOM 2242 C GLU B 168 -3.816 -4.669 -18.547 1.00 0.00 C ATOM 2243 O GLU B 168 -4.613 -5.511 -18.134 1.00 0.00 O ATOM 2244 CB GLU B 168 -2.267 -5.403 -16.725 1.00 0.00 C ATOM 2245 CG GLU B 168 -2.415 -6.909 -16.866 1.00 0.00 C ATOM 2246 CD GLU B 168 -2.073 -7.651 -15.589 1.00 0.00 C ATOM 2247 OE1 GLU B 168 -0.942 -7.479 -15.087 1.00 0.00 O ATOM 2248 OE2 GLU B 168 -2.936 -8.404 -15.090 1.00 0.00 O ATOM 0 H GLU B 168 -2.618 -2.613 -17.619 1.00 0.00 H new ATOM 0 HA GLU B 168 -1.746 -5.143 -18.794 1.00 0.00 H new ATOM 0 HB2 GLU B 168 -1.302 -5.183 -16.268 1.00 0.00 H new ATOM 0 HB3 GLU B 168 -3.034 -5.033 -16.045 1.00 0.00 H new ATOM 0 HG2 GLU B 168 -3.439 -7.144 -17.155 1.00 0.00 H new ATOM 0 HG3 GLU B 168 -1.768 -7.260 -17.670 1.00 0.00 H new ATOM 2255 N ASN B 169 -4.146 -3.734 -19.433 1.00 0.00 N ATOM 2256 CA ASN B 169 -5.493 -3.645 -19.983 1.00 0.00 C ATOM 2257 C ASN B 169 -5.544 -4.218 -21.396 1.00 0.00 C ATOM 2258 O ASN B 169 -4.529 -4.660 -21.934 1.00 0.00 O ATOM 2259 CB ASN B 169 -5.968 -2.191 -19.993 1.00 0.00 C ATOM 2260 CG ASN B 169 -6.307 -1.684 -18.605 1.00 0.00 C ATOM 2261 OD1 ASN B 169 -5.430 -1.541 -17.753 1.00 0.00 O ATOM 2262 ND2 ASN B 169 -7.585 -1.409 -18.371 1.00 0.00 N ATOM 0 H ASN B 169 -3.499 -3.028 -19.785 1.00 0.00 H new ATOM 0 HA ASN B 169 -6.156 -4.232 -19.348 1.00 0.00 H new ATOM 0 HB2 ASN B 169 -5.192 -1.561 -20.427 1.00 0.00 H new ATOM 0 HB3 ASN B 169 -6.846 -2.103 -20.633 1.00 0.00 H new ATOM 0 HD21 ASN B 169 -7.873 -1.064 -17.455 1.00 0.00 H new ATOM 0 HD22 ASN B 169 -8.278 -1.542 -19.107 1.00 0.00 H new ATOM 2269 N LYS B 170 -6.733 -4.208 -21.991 1.00 0.00 N ATOM 2270 CA LYS B 170 -6.917 -4.727 -23.341 1.00 0.00 C ATOM 2271 C LYS B 170 -7.305 -3.611 -24.306 1.00 0.00 C ATOM 2272 O LYS B 170 -6.550 -3.275 -25.219 1.00 0.00 O ATOM 2273 CB LYS B 170 -7.988 -5.820 -23.347 1.00 0.00 C ATOM 2274 CG LYS B 170 -7.623 -7.024 -24.200 1.00 0.00 C ATOM 2275 CD LYS B 170 -6.477 -7.813 -23.588 1.00 0.00 C ATOM 2276 CE LYS B 170 -6.945 -8.653 -22.410 1.00 0.00 C ATOM 2277 NZ LYS B 170 -7.029 -7.856 -21.155 1.00 0.00 N ATOM 0 H LYS B 170 -7.583 -3.846 -21.559 1.00 0.00 H new ATOM 0 HA LYS B 170 -5.970 -5.154 -23.672 1.00 0.00 H new ATOM 0 HB2 LYS B 170 -8.164 -6.150 -22.323 1.00 0.00 H new ATOM 0 HB3 LYS B 170 -8.925 -5.398 -23.711 1.00 0.00 H new ATOM 0 HG2 LYS B 170 -8.494 -7.671 -24.310 1.00 0.00 H new ATOM 0 HG3 LYS B 170 -7.344 -6.692 -25.200 1.00 0.00 H new ATOM 0 HD2 LYS B 170 -6.035 -8.461 -24.345 1.00 0.00 H new ATOM 0 HD3 LYS B 170 -5.696 -7.127 -23.260 1.00 0.00 H new ATOM 0 HE2 LYS B 170 -7.923 -9.080 -22.635 1.00 0.00 H new ATOM 0 HE3 LYS B 170 -6.259 -9.487 -22.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 170 -6.590 -8.387 -20.376 1.00 0.00 H new ATOM 0 HZ2 LYS B 170 -6.529 -6.953 -21.283 1.00 0.00 H new ATOM 0 HZ3 LYS B 170 -8.027 -7.671 -20.928 1.00 0.00 H new ATOM 2291 N ASP B 171 -8.487 -3.039 -24.098 1.00 0.00 N ATOM 2292 CA ASP B 171 -8.974 -1.960 -24.950 1.00 0.00 C ATOM 2293 C ASP B 171 -9.541 -0.818 -24.113 1.00 0.00 C ATOM 2294 O ASP B 171 -8.972 0.273 -24.067 1.00 0.00 O ATOM 2295 CB ASP B 171 -10.044 -2.484 -25.910 1.00 0.00 C ATOM 2296 CG ASP B 171 -10.503 -1.428 -26.896 1.00 0.00 C ATOM 2297 OD1 ASP B 171 -9.642 -0.861 -27.602 1.00 0.00 O ATOM 2298 OD2 ASP B 171 -11.723 -1.168 -26.964 1.00 0.00 O ATOM 0 H ASP B 171 -9.125 -3.305 -23.347 1.00 0.00 H new ATOM 0 HA ASP B 171 -8.132 -1.579 -25.528 1.00 0.00 H new ATOM 0 HB2 ASP B 171 -9.650 -3.341 -26.457 1.00 0.00 H new ATOM 0 HB3 ASP B 171 -10.900 -2.839 -25.337 1.00 0.00 H new ATOM 2303 N TRP B 172 -10.665 -1.076 -23.453 1.00 0.00 N ATOM 2304 CA TRP B 172 -11.309 -0.069 -22.617 1.00 0.00 C ATOM 2305 C TRP B 172 -10.969 -0.285 -21.146 1.00 0.00 C ATOM 2306 O TRP B 172 -11.326 0.585 -20.323 1.00 0.00 O ATOM 2307 CB TRP B 172 -12.825 -0.107 -22.814 1.00 0.00 C ATOM 2308 CG TRP B 172 -13.504 1.178 -22.452 1.00 0.00 C ATOM 2309 CD1 TRP B 172 -12.962 2.431 -22.490 1.00 0.00 C ATOM 2310 CD2 TRP B 172 -14.853 1.337 -21.997 1.00 0.00 C ATOM 2311 NE1 TRP B 172 -13.891 3.359 -22.086 1.00 0.00 N ATOM 2312 CE2 TRP B 172 -15.060 2.713 -21.779 1.00 0.00 C ATOM 2313 CE3 TRP B 172 -15.906 0.451 -21.754 1.00 0.00 C ATOM 2314 CZ2 TRP B 172 -16.276 3.220 -21.329 1.00 0.00 C ATOM 2315 CZ3 TRP B 172 -17.112 0.956 -21.307 1.00 0.00 C ATOM 2316 CH2 TRP B 172 -17.289 2.330 -21.099 1.00 0.00 C ATOM 2317 OXT TRP B 172 -10.350 -1.322 -20.828 1.00 0.00 O ATOM 0 H TRP B 172 -11.149 -1.973 -23.481 1.00 0.00 H new ATOM 0 HA TRP B 172 -10.935 0.910 -22.917 1.00 0.00 H new ATOM 0 HB2 TRP B 172 -13.043 -0.344 -23.855 1.00 0.00 H new ATOM 0 HB3 TRP B 172 -13.242 -0.913 -22.210 1.00 0.00 H new ATOM 0 HD1 TRP B 172 -11.951 2.659 -22.793 1.00 0.00 H new ATOM 0 HE1 TRP B 172 -13.736 4.365 -22.025 1.00 0.00 H new ATOM 0 HE3 TRP B 172 -15.779 -0.610 -21.913 1.00 0.00 H new ATOM 0 HZ2 TRP B 172 -16.415 4.279 -21.167 1.00 0.00 H new ATOM 0 HZ3 TRP B 172 -17.932 0.280 -21.115 1.00 0.00 H new ATOM 0 HH2 TRP B 172 -18.244 2.694 -20.750 1.00 0.00 H new TER 2328 TRP B 172 END