USER MOD reduce.3.24.130724 H: found=0, std=0, add=1264, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1259 hydrogens (0 hets) HEADER APOPTOSIS 31-MAY-01 1GJH TITLE HUMAN BCL-2, ISOFORM 2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROTEIN (APOPTOSIS REGULATOR BCL-2 WITH PUTATIVE COMPND 3 FLEXIBLE LOOP REPLACED WITH A PORTION OF APOPTOSIS COMPND 4 REGULATOR BCL-X PROTEIN); COMPND 5 CHAIN: A; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS APOPTOSIS EXPDTA SOLUTION NMR AUTHOR A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON,K.SWIFT, AUTHOR 2 E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK REVDAT 2 24-FEB-09 1GJH 1 VERSN REVDAT 1 13-JUN-01 1GJH 0 SPRSDE 13-JUN-01 1GJH 1G5O JRNL AUTH A.M.PETROS,A.MEDEK,D.G.NETTESHEIM,D.H.KIM,H.S.YOON, JRNL AUTH 2 K.SWIFT,E.D.MATAYOSHI,T.OLTERSDORF,S.W.FESIK JRNL TITL SOLUTION STRUCTURE OF THE ANTIAPOPTOTIC PROTEIN JRNL TITL 2 BCL-2. JRNL REF PROC.NATL.ACAD.SCI.USA V. 98 3012 2001 JRNL REFN ISSN 0027-8424 JRNL PMID 11248023 JRNL DOI 10.1073/PNAS.041619798 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH M.L.CLEARY,S.D.SMITH,J.SKLAR REMARK 1 TITL CLONING AND STRUCTURAL ANALYSIS OF CDNAS FOR BCL-2 REMARK 1 TITL 2 AND A HYBRID BCL-2/IMMUNOGLOBULIN TRANSCRIPT REMARK 1 TITL 3 RESULTING FROM THE T(14;18) TRANSLOCATION REMARK 1 REF CELL(CAMBRIDGE,MASS.) V. 47 19 1986 REMARK 1 REFN ISSN 0092-8674 REMARK 1 DOI 10.1016/0092-8674(86)90362-4 REMARK 1 REFERENCE 2 REMARK 1 AUTH M.SETO,U.JAEGER,R.D.HOCKETT,W.GRAINGER,S.BENNETT, REMARK 1 AUTH 2 P.GOLDMAN,S.J.KORSMEYER REMARK 1 TITL ALTERNATIVE PROMOTERS AND EXONS, SOMATIC MUTATION REMARK 1 TITL 2 AND DEREGULATION OF THE BCL-2-IG FUSION GENE IN REMARK 1 TITL 3 LYMPHOMA REMARK 1 REF EMBO J. V. 7 123 1988 REMARK 1 REFN ISSN 0261-4189 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNX 2000 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1GJH COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-JUN-01. REMARK 100 THE RCSB ID CODE IS RCSB001583. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298.00 REMARK 210 PH : 7.80 REMARK 210 IONIC STRENGTH : 20 MM REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 15N-BCL-2(2); 15N,13C-BCL- REMARK 210 2(2); 15N, 13C-BCL-2(2) REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ, 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NULL REMARK 210 METHOD USED : SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 465 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 RES C SSSEQI REMARK 465 MET A 1 REMARK 465 ALA A 2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ALA A 4 74.50 -179.09 REMARK 500 ARG A 6 31.15 -144.59 REMARK 500 GLU A 29 83.99 -66.35 REMARK 500 GLU A 38 85.87 43.48 REMARK 500 ARG A 40 57.11 -107.97 REMARK 500 THR A 41 -78.04 -49.86 REMARK 500 ALA A 43 151.40 68.76 REMARK 500 GLU A 48 -73.17 -50.97 REMARK 500 ASP A 111 -50.22 -172.87 REMARK 500 GLN A 118 57.82 -90.55 REMARK 500 PHE A 124 149.42 -177.69 REMARK 500 PHE A 138 66.17 -112.23 REMARK 500 ASP A 140 -74.76 -80.88 REMARK 500 ARG A 164 -74.98 -78.94 REMARK 500 GLU A 165 63.61 -175.74 REMARK 500 MET A 166 43.03 -149.44 REMARK 500 HIS A 184 -35.97 -143.66 REMARK 500 ASN A 192 52.45 -110.60 REMARK 500 PRO A 204 160.24 -41.95 REMARK 500 SER A 205 95.19 -47.45 REMARK 500 MET A 206 79.47 45.57 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1BXL RELATED DB: PDB REMARK 900 STRUCTURE OF BCL-XL/BAK PEPTIDE COMPLEX, NMR, MINIMIZED REMARK 900 AVERAGE STRUCTURE REMARK 900 RELATED ID: 1G5J RELATED DB: PDB REMARK 900 COMPLEX OF BCL-XL WITH PEPTIDE FROM BAD REMARK 900 RELATED ID: 1G5M RELATED DB: PDB REMARK 900 HUMAN BCL-2, ISOFORM 1 DBREF 1GJH A 1 34 UNP P10415 BCL2_HUMAN 1 34 DBREF 1GJH A 35 50 UNP Q07817 BCLX_HUMAN 29 44 DBREF 1GJH A 92 207 UNP P10415 BCL2_HUMAN 92 207 SEQRES 1 A 166 MET ALA HIS ALA GLY ARG THR GLY TYR ASP ASN ARG GLU SEQRES 2 A 166 ILE VAL MET LYS TYR ILE HIS TYR LYS LEU SER GLN ARG SEQRES 3 A 166 GLY TYR GLU TRP ASP ALA GLY ASP ASP VAL GLU GLU ASN SEQRES 4 A 166 ARG THR GLU ALA PRO GLU GLY THR GLU SER GLU VAL VAL SEQRES 5 A 166 HIS LEU THR LEU ARG GLN ALA GLY ASP ASP PHE SER ARG SEQRES 6 A 166 ARG TYR ARG ARG ASP PHE ALA GLU MET SER SER GLN LEU SEQRES 7 A 166 HIS LEU THR PRO PHE THR ALA ARG GLY ARG PHE ALA THR SEQRES 8 A 166 VAL VAL GLU GLU LEU PHE ARG ASP GLY VAL ASN TRP GLY SEQRES 9 A 166 ARG ILE VAL ALA PHE PHE GLU PHE GLY GLY VAL MET CYS SEQRES 10 A 166 VAL GLU SER VAL ASN ARG GLU MET SER PRO LEU VAL ASP SEQRES 11 A 166 ASN ILE ALA LEU TRP MET THR GLU TYR LEU ASN ARG HIS SEQRES 12 A 166 LEU HIS THR TRP ILE GLN ASP ASN GLY GLY TRP ASP ALA SEQRES 13 A 166 PHE VAL GLU LEU TYR GLY PRO SER MET ARG HELIX 1 1 ASP A 10 GLN A 25 1 16 HELIX 2 2 GLY A 46 TYR A 108 1 22 HELIX 3 3 PHE A 112 SER A 117 1 6 HELIX 4 4 THR A 125 PHE A 138 1 14 HELIX 5 5 ASN A 143 GLU A 165 1 23 HELIX 6 6 PRO A 168 ASP A 191 1 24 HELIX 7 7 GLY A 194 TYR A 202 1 9 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 182 ASN : amide:sc= -0.755 K(o=-1.3,f=-7.7!) USER MOD Set 1.2: A 186 HIS :FLIP no HD1:sc= -0.545 F(o=-2.7!,f=-1.3) USER MOD Set 2.1: A 11 ASN : amide:sc= -0.359 X(o=-0.44,f=-0.5) USER MOD Set 2.2: A 178 THR OG1 : rot -108:sc= -0.0813 USER MOD Single : A 3 HIS : no HD1:sc= -0.346 K(o=-0.35,f=-1.3) USER MOD Single : A 7 THR OG1 : rot -175:sc= 2.01 USER MOD Single : A 9 TYR OH : rot 180:sc= -1.33! USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 162:sc= -0.315 (180deg=-1.03) USER MOD Single : A 18 TYR OH : rot 2:sc= -1.9 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 21 TYR OH : rot 30:sc= -0.909 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.194 K(o=-0.19,f=-2.8!) USER MOD Single : A 28 TYR OH : rot -146:sc= 0.277 USER MOD Single : A 39 ASN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.112 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 94 HIS :FLIP no HE2:sc= -5.92! F(o=-6.9,f=-5.9!) USER MOD Single : A 96 THR OG1 : rot 78:sc= 0.569 USER MOD Single : A 99 GLN : amide:sc=-0.00838 X(o=-0.0084,f=-0.3) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 MET CE :methyl 176:sc= 0 (180deg=-0.024) USER MOD Single : A 116 SER OG : rot -80:sc= -0.0456 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.0684 USER MOD Single : A 125 THR OG1 : rot 15:sc= 0.606 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0.229 K(o=0.23,f=-7.1!) USER MOD Single : A 157 MET CE :methyl -115:sc= -3.12! (180deg=-7.49!) USER MOD Single : A 158 CYS SG : rot -119:sc= -2.47 USER MOD Single : A 161 SER OG : rot 117:sc= -1.38 USER MOD Single : A 163 ASN : amide:sc= -0.218 K(o=-0.22,f=-2.6!) USER MOD Single : A 166 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 167 SER OG : rot -112:sc= -1.17! USER MOD Single : A 172 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 177 MET CE :methyl 167:sc= -1.68 (180deg=-2.29!) USER MOD Single : A 180 TYR OH : rot 0:sc= 0.941 USER MOD Single : A 184 HIS :FLIP no HE2:sc= -0.447 F(o=-1.3,f=-0.45) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 GLN : amide:sc= -0.142 K(o=-0.14,f=-1.3) USER MOD Single : A 192 ASN : amide:sc= -0.254 K(o=-0.25,f=-1.4) USER MOD Single : A 202 TYR OH : rot 180:sc= 0 USER MOD Single : A 205 SER OG : rot 180:sc= 0 USER MOD Single : A 206 MET CE :methyl 153:sc= -0.749 (180deg=-1.38) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 3 -6.289 14.483 17.805 1.00 9.43 N ATOM 2 CA HIS A 3 -6.654 14.304 16.375 1.00 8.75 C ATOM 3 C HIS A 3 -5.754 13.280 15.701 1.00 7.90 C ATOM 4 O HIS A 3 -4.990 12.577 16.364 1.00 8.06 O ATOM 5 CB HIS A 3 -6.543 15.656 15.669 1.00 9.00 C ATOM 6 CG HIS A 3 -7.868 16.287 15.371 1.00 9.67 C ATOM 7 ND1 HIS A 3 -7.997 17.502 14.732 1.00 10.29 N ATOM 8 CD2 HIS A 3 -9.129 15.864 15.628 1.00 10.04 C ATOM 9 CE1 HIS A 3 -9.279 17.800 14.610 1.00 10.95 C ATOM 10 NE2 HIS A 3 -9.986 16.822 15.145 1.00 10.82 N ATOM 0 HA HIS A 3 -7.676 13.932 16.311 1.00 8.75 H new ATOM 0 HB2 HIS A 3 -5.959 16.334 16.291 1.00 9.00 H new ATOM 0 HB3 HIS A 3 -5.994 15.526 14.736 1.00 9.00 H new ATOM 0 HD2 HIS A 3 -9.408 14.945 16.121 1.00 10.04 H new ATOM 0 HE1 HIS A 3 -9.680 18.692 14.151 1.00 10.95 H new ATOM 0 HE2 HIS A 3 -11.004 16.784 15.192 1.00 10.82 H new ATOM 18 N ALA A 4 -5.855 13.191 14.380 1.00 7.25 N ATOM 19 CA ALA A 4 -5.056 12.241 13.624 1.00 6.65 C ATOM 20 C ALA A 4 -5.339 12.350 12.128 1.00 5.95 C ATOM 21 O ALA A 4 -6.010 11.497 11.547 1.00 6.36 O ATOM 22 CB ALA A 4 -5.334 10.833 14.126 1.00 6.91 C ATOM 0 H ALA A 4 -6.481 13.764 13.814 1.00 7.25 H new ATOM 0 HA ALA A 4 -4.001 12.472 13.773 1.00 6.65 H new ATOM 0 HB1 ALA A 4 -4.735 10.120 13.559 1.00 6.91 H new ATOM 0 HB2 ALA A 4 -5.075 10.766 15.183 1.00 6.91 H new ATOM 0 HB3 ALA A 4 -6.391 10.603 13.996 1.00 6.91 H new ATOM 28 N GLY A 5 -4.822 13.408 11.511 1.00 5.22 N ATOM 29 CA GLY A 5 -5.028 13.614 10.089 1.00 4.87 C ATOM 30 C GLY A 5 -6.478 13.450 9.681 1.00 4.11 C ATOM 31 O GLY A 5 -7.366 13.379 10.531 1.00 4.13 O ATOM 0 H GLY A 5 -4.264 14.127 11.971 1.00 5.22 H new ATOM 0 HA2 GLY A 5 -4.689 14.614 9.817 1.00 4.87 H new ATOM 0 HA3 GLY A 5 -4.415 12.907 9.530 1.00 4.87 H new ATOM 35 N ARG A 6 -6.720 13.388 8.375 1.00 3.87 N ATOM 36 CA ARG A 6 -8.073 13.230 7.854 1.00 3.47 C ATOM 37 C ARG A 6 -8.074 12.364 6.598 1.00 2.89 C ATOM 38 O ARG A 6 -8.907 12.545 5.709 1.00 3.10 O ATOM 39 CB ARG A 6 -8.686 14.597 7.545 1.00 4.21 C ATOM 40 CG ARG A 6 -10.085 14.777 8.112 1.00 4.92 C ATOM 41 CD ARG A 6 -10.352 16.226 8.485 1.00 5.56 C ATOM 42 NE ARG A 6 -10.845 16.357 9.854 1.00 6.18 N ATOM 43 CZ ARG A 6 -10.127 16.057 10.935 1.00 6.90 C ATOM 44 NH1 ARG A 6 -8.883 15.607 10.815 1.00 7.18 N ATOM 45 NH2 ARG A 6 -10.655 16.207 12.142 1.00 7.61 N ATOM 0 H ARG A 6 -5.996 13.445 7.658 1.00 3.87 H new ATOM 0 HA ARG A 6 -8.674 12.734 8.617 1.00 3.47 H new ATOM 0 HB2 ARG A 6 -8.037 15.376 7.946 1.00 4.21 H new ATOM 0 HB3 ARG A 6 -8.720 14.735 6.464 1.00 4.21 H new ATOM 0 HG2 ARG A 6 -10.821 14.447 7.379 1.00 4.92 H new ATOM 0 HG3 ARG A 6 -10.206 14.145 8.992 1.00 4.92 H new ATOM 0 HD2 ARG A 6 -9.435 16.804 8.373 1.00 5.56 H new ATOM 0 HD3 ARG A 6 -11.082 16.649 7.795 1.00 5.56 H new ATOM 0 HE ARG A 6 -11.796 16.699 9.990 1.00 6.18 H new ATOM 0 HH11 ARG A 6 -8.470 15.489 9.890 1.00 7.18 H new ATOM 0 HH12 ARG A 6 -8.340 15.380 11.648 1.00 7.18 H new ATOM 0 HH21 ARG A 6 -11.610 16.552 12.242 1.00 7.61 H new ATOM 0 HH22 ARG A 6 -10.106 15.978 12.971 1.00 7.61 H new ATOM 59 N THR A 7 -7.137 11.424 6.531 1.00 2.72 N ATOM 60 CA THR A 7 -7.031 10.531 5.384 1.00 2.54 C ATOM 61 C THR A 7 -7.627 9.164 5.702 1.00 2.39 C ATOM 62 O THR A 7 -8.459 8.648 4.955 1.00 3.05 O ATOM 63 CB THR A 7 -5.569 10.377 4.964 1.00 2.98 C ATOM 64 OG1 THR A 7 -4.886 9.496 5.838 1.00 3.66 O ATOM 65 CG2 THR A 7 -4.810 11.687 4.947 1.00 3.57 C ATOM 0 H THR A 7 -6.440 11.261 7.258 1.00 2.72 H new ATOM 0 HA THR A 7 -7.594 10.970 4.560 1.00 2.54 H new ATOM 0 HB THR A 7 -5.600 9.981 3.949 1.00 2.98 H new ATOM 0 HG1 THR A 7 -3.936 9.468 5.597 1.00 3.66 H new ATOM 0 HG21 THR A 7 -3.780 11.507 4.641 1.00 3.57 H new ATOM 0 HG22 THR A 7 -5.283 12.372 4.244 1.00 3.57 H new ATOM 0 HG23 THR A 7 -4.820 12.126 5.944 1.00 3.57 H new ATOM 73 N GLY A 8 -7.197 8.581 6.817 1.00 2.11 N ATOM 74 CA GLY A 8 -7.698 7.280 7.214 1.00 2.26 C ATOM 75 C GLY A 8 -6.738 6.158 6.871 1.00 1.66 C ATOM 76 O GLY A 8 -7.160 5.046 6.552 1.00 2.05 O ATOM 0 H GLY A 8 -6.510 8.988 7.452 1.00 2.11 H new ATOM 0 HA2 GLY A 8 -7.885 7.278 8.288 1.00 2.26 H new ATOM 0 HA3 GLY A 8 -8.654 7.098 6.724 1.00 2.26 H new ATOM 80 N TYR A 9 -5.443 6.449 6.937 1.00 1.35 N ATOM 81 CA TYR A 9 -4.420 5.456 6.630 1.00 0.88 C ATOM 82 C TYR A 9 -4.696 4.148 7.365 1.00 0.93 C ATOM 83 O TYR A 9 -5.182 4.151 8.496 1.00 1.80 O ATOM 84 CB TYR A 9 -3.036 5.984 7.009 1.00 0.93 C ATOM 85 CG TYR A 9 -2.686 7.301 6.351 1.00 0.79 C ATOM 86 CD1 TYR A 9 -2.750 7.448 4.971 1.00 1.14 C ATOM 87 CD2 TYR A 9 -2.293 8.396 7.110 1.00 1.52 C ATOM 88 CE1 TYR A 9 -2.431 8.649 4.366 1.00 1.16 C ATOM 89 CE2 TYR A 9 -1.973 9.600 6.513 1.00 1.47 C ATOM 90 CZ TYR A 9 -2.043 9.721 5.141 1.00 0.70 C ATOM 91 OH TYR A 9 -1.725 10.919 4.543 1.00 0.76 O ATOM 0 H TYR A 9 -5.077 7.364 7.200 1.00 1.35 H new ATOM 0 HA TYR A 9 -4.446 5.263 5.557 1.00 0.88 H new ATOM 0 HB2 TYR A 9 -2.987 6.104 8.091 1.00 0.93 H new ATOM 0 HB3 TYR A 9 -2.286 5.241 6.736 1.00 0.93 H new ATOM 0 HD1 TYR A 9 -3.054 6.610 4.361 1.00 1.14 H new ATOM 0 HD2 TYR A 9 -2.237 8.305 8.185 1.00 1.52 H new ATOM 0 HE1 TYR A 9 -2.485 8.747 3.292 1.00 1.16 H new ATOM 0 HE2 TYR A 9 -1.670 10.442 7.117 1.00 1.47 H new ATOM 0 HH TYR A 9 -1.473 11.571 5.230 1.00 0.76 H new ATOM 101 N ASP A 10 -4.383 3.031 6.716 1.00 0.49 N ATOM 102 CA ASP A 10 -4.598 1.716 7.309 1.00 0.47 C ATOM 103 C ASP A 10 -3.578 0.709 6.789 1.00 0.40 C ATOM 104 O ASP A 10 -3.577 0.367 5.606 1.00 0.38 O ATOM 105 CB ASP A 10 -6.016 1.225 7.010 1.00 0.57 C ATOM 106 CG ASP A 10 -7.031 1.747 8.008 1.00 1.10 C ATOM 107 OD1 ASP A 10 -6.622 2.137 9.121 1.00 1.60 O ATOM 108 OD2 ASP A 10 -8.235 1.765 7.675 1.00 1.91 O ATOM 0 H ASP A 10 -3.980 3.010 5.779 1.00 0.49 H new ATOM 0 HA ASP A 10 -4.472 1.807 8.388 1.00 0.47 H new ATOM 0 HB2 ASP A 10 -6.302 1.540 6.006 1.00 0.57 H new ATOM 0 HB3 ASP A 10 -6.030 0.135 7.018 1.00 0.57 H new ATOM 113 N ASN A 11 -2.712 0.238 7.681 1.00 0.43 N ATOM 114 CA ASN A 11 -1.684 -0.731 7.315 1.00 0.46 C ATOM 115 C ASN A 11 -2.276 -1.874 6.496 1.00 0.42 C ATOM 116 O ASN A 11 -1.602 -2.455 5.645 1.00 0.48 O ATOM 117 CB ASN A 11 -1.009 -1.287 8.570 1.00 0.58 C ATOM 118 CG ASN A 11 -2.002 -1.586 9.675 1.00 1.29 C ATOM 119 OD1 ASN A 11 -2.712 -2.591 9.634 1.00 2.25 O ATOM 120 ND2 ASN A 11 -2.059 -0.711 10.672 1.00 1.67 N ATOM 0 H ASN A 11 -2.702 0.512 8.663 1.00 0.43 H new ATOM 0 HA ASN A 11 -0.940 -0.219 6.705 1.00 0.46 H new ATOM 0 HB2 ASN A 11 -0.468 -2.198 8.315 1.00 0.58 H new ATOM 0 HB3 ASN A 11 -0.272 -0.569 8.931 1.00 0.58 H new ATOM 0 HD21 ASN A 11 -2.710 -0.859 11.444 1.00 1.67 H new ATOM 0 HD22 ASN A 11 -1.452 0.109 10.666 1.00 1.67 H new ATOM 127 N ARG A 12 -3.540 -2.192 6.757 1.00 0.39 N ATOM 128 CA ARG A 12 -4.221 -3.265 6.042 1.00 0.38 C ATOM 129 C ARG A 12 -4.467 -2.874 4.589 1.00 0.35 C ATOM 130 O ARG A 12 -4.244 -3.669 3.676 1.00 0.33 O ATOM 131 CB ARG A 12 -5.547 -3.603 6.725 1.00 0.45 C ATOM 132 CG ARG A 12 -6.040 -5.011 6.432 1.00 1.12 C ATOM 133 CD ARG A 12 -7.501 -5.014 6.011 1.00 1.47 C ATOM 134 NE ARG A 12 -8.399 -4.860 7.153 1.00 1.97 N ATOM 135 CZ ARG A 12 -9.717 -5.042 7.092 1.00 2.52 C ATOM 136 NH1 ARG A 12 -10.299 -5.385 5.948 1.00 2.83 N ATOM 137 NH2 ARG A 12 -10.458 -4.881 8.181 1.00 3.25 N ATOM 0 H ARG A 12 -4.113 -1.722 7.458 1.00 0.39 H new ATOM 0 HA ARG A 12 -3.580 -4.146 6.060 1.00 0.38 H new ATOM 0 HB2 ARG A 12 -5.432 -3.484 7.802 1.00 0.45 H new ATOM 0 HB3 ARG A 12 -6.304 -2.888 6.404 1.00 0.45 H new ATOM 0 HG2 ARG A 12 -5.432 -5.454 5.643 1.00 1.12 H new ATOM 0 HG3 ARG A 12 -5.914 -5.633 7.318 1.00 1.12 H new ATOM 0 HD2 ARG A 12 -7.675 -4.206 5.301 1.00 1.47 H new ATOM 0 HD3 ARG A 12 -7.728 -5.947 5.494 1.00 1.47 H new ATOM 0 HE ARG A 12 -7.992 -4.597 8.051 1.00 1.97 H new ATOM 0 HH11 ARG A 12 -9.736 -5.511 5.107 1.00 2.83 H new ATOM 0 HH12 ARG A 12 -11.309 -5.522 5.911 1.00 2.83 H new ATOM 0 HH21 ARG A 12 -10.018 -4.618 9.063 1.00 3.25 H new ATOM 0 HH22 ARG A 12 -11.467 -5.020 8.136 1.00 3.25 H new ATOM 151 N GLU A 13 -4.926 -1.645 4.381 1.00 0.38 N ATOM 152 CA GLU A 13 -5.200 -1.150 3.037 1.00 0.40 C ATOM 153 C GLU A 13 -3.903 -0.931 2.268 1.00 0.37 C ATOM 154 O GLU A 13 -3.810 -1.250 1.083 1.00 0.41 O ATOM 155 CB GLU A 13 -5.993 0.157 3.103 1.00 0.47 C ATOM 156 CG GLU A 13 -6.705 0.502 1.806 1.00 1.11 C ATOM 157 CD GLU A 13 -7.934 1.362 2.027 1.00 1.78 C ATOM 158 OE1 GLU A 13 -8.320 1.556 3.199 1.00 2.39 O ATOM 159 OE2 GLU A 13 -8.510 1.842 1.028 1.00 2.44 O ATOM 0 H GLU A 13 -5.116 -0.974 5.125 1.00 0.38 H new ATOM 0 HA GLU A 13 -5.793 -1.900 2.513 1.00 0.40 H new ATOM 0 HB2 GLU A 13 -6.729 0.086 3.904 1.00 0.47 H new ATOM 0 HB3 GLU A 13 -5.316 0.970 3.364 1.00 0.47 H new ATOM 0 HG2 GLU A 13 -6.014 1.025 1.145 1.00 1.11 H new ATOM 0 HG3 GLU A 13 -6.996 -0.418 1.300 1.00 1.11 H new ATOM 166 N ILE A 14 -2.902 -0.384 2.951 1.00 0.35 N ATOM 167 CA ILE A 14 -1.610 -0.122 2.333 1.00 0.34 C ATOM 168 C ILE A 14 -1.017 -1.392 1.735 1.00 0.30 C ATOM 169 O ILE A 14 -0.631 -1.418 0.567 1.00 0.37 O ATOM 170 CB ILE A 14 -0.614 0.472 3.346 1.00 0.33 C ATOM 171 CG1 ILE A 14 -0.633 1.998 3.273 1.00 0.39 C ATOM 172 CG2 ILE A 14 0.788 -0.060 3.087 1.00 0.32 C ATOM 173 CD1 ILE A 14 0.050 2.669 4.445 1.00 0.81 C ATOM 0 H ILE A 14 -2.962 -0.114 3.933 1.00 0.35 H new ATOM 0 HA ILE A 14 -1.781 0.602 1.537 1.00 0.34 H new ATOM 0 HB ILE A 14 -0.914 0.170 4.349 1.00 0.33 H new ATOM 0 HG12 ILE A 14 -0.148 2.315 2.350 1.00 0.39 H new ATOM 0 HG13 ILE A 14 -1.667 2.338 3.223 1.00 0.39 H new ATOM 0 HG21 ILE A 14 1.480 0.370 3.812 1.00 0.32 H new ATOM 0 HG22 ILE A 14 0.789 -1.146 3.184 1.00 0.32 H new ATOM 0 HG23 ILE A 14 1.101 0.214 2.080 1.00 0.32 H new ATOM 0 HD11 ILE A 14 -0.002 3.751 4.326 1.00 0.81 H new ATOM 0 HD12 ILE A 14 -0.449 2.381 5.370 1.00 0.81 H new ATOM 0 HD13 ILE A 14 1.094 2.358 4.484 1.00 0.81 H new ATOM 185 N VAL A 15 -0.947 -2.445 2.543 1.00 0.25 N ATOM 186 CA VAL A 15 -0.400 -3.716 2.087 1.00 0.24 C ATOM 187 C VAL A 15 -1.277 -4.333 1.004 1.00 0.24 C ATOM 188 O VAL A 15 -0.775 -4.925 0.051 1.00 0.26 O ATOM 189 CB VAL A 15 -0.250 -4.718 3.246 1.00 0.26 C ATOM 190 CG1 VAL A 15 0.424 -5.990 2.763 1.00 0.33 C ATOM 191 CG2 VAL A 15 0.534 -4.099 4.387 1.00 0.30 C ATOM 0 H VAL A 15 -1.261 -2.443 3.513 1.00 0.25 H new ATOM 0 HA VAL A 15 0.587 -3.504 1.676 1.00 0.24 H new ATOM 0 HB VAL A 15 -1.244 -4.973 3.613 1.00 0.26 H new ATOM 0 HG11 VAL A 15 0.522 -6.688 3.594 1.00 0.33 H new ATOM 0 HG12 VAL A 15 -0.178 -6.445 1.977 1.00 0.33 H new ATOM 0 HG13 VAL A 15 1.413 -5.751 2.370 1.00 0.33 H new ATOM 0 HG21 VAL A 15 0.630 -4.822 5.197 1.00 0.30 H new ATOM 0 HG22 VAL A 15 1.526 -3.815 4.035 1.00 0.30 H new ATOM 0 HG23 VAL A 15 0.011 -3.214 4.750 1.00 0.30 H new ATOM 201 N MET A 16 -2.589 -4.193 1.157 1.00 0.25 N ATOM 202 CA MET A 16 -3.532 -4.739 0.187 1.00 0.28 C ATOM 203 C MET A 16 -3.265 -4.177 -1.206 1.00 0.30 C ATOM 204 O MET A 16 -3.141 -4.926 -2.175 1.00 0.31 O ATOM 205 CB MET A 16 -4.968 -4.424 0.609 1.00 0.33 C ATOM 206 CG MET A 16 -5.483 -5.312 1.730 1.00 0.51 C ATOM 207 SD MET A 16 -6.651 -6.556 1.149 1.00 1.07 S ATOM 208 CE MET A 16 -6.287 -7.910 2.263 1.00 0.53 C ATOM 0 H MET A 16 -3.023 -3.707 1.942 1.00 0.25 H new ATOM 0 HA MET A 16 -3.398 -5.820 0.155 1.00 0.28 H new ATOM 0 HB2 MET A 16 -5.024 -3.383 0.927 1.00 0.33 H new ATOM 0 HB3 MET A 16 -5.623 -4.529 -0.256 1.00 0.33 H new ATOM 0 HG2 MET A 16 -4.640 -5.807 2.212 1.00 0.51 H new ATOM 0 HG3 MET A 16 -5.964 -4.693 2.487 1.00 0.51 H new ATOM 0 HE1 MET A 16 -6.931 -8.757 2.029 1.00 0.53 H new ATOM 0 HE2 MET A 16 -5.244 -8.205 2.149 1.00 0.53 H new ATOM 0 HE3 MET A 16 -6.464 -7.593 3.291 1.00 0.53 H new ATOM 218 N LYS A 17 -3.179 -2.854 -1.297 1.00 0.33 N ATOM 219 CA LYS A 17 -2.928 -2.189 -2.571 1.00 0.38 C ATOM 220 C LYS A 17 -1.562 -2.575 -3.129 1.00 0.35 C ATOM 221 O LYS A 17 -1.429 -2.878 -4.315 1.00 0.38 O ATOM 222 CB LYS A 17 -3.013 -0.671 -2.403 1.00 0.47 C ATOM 223 CG LYS A 17 -4.117 -0.030 -3.227 1.00 1.13 C ATOM 224 CD LYS A 17 -4.165 1.475 -3.018 1.00 1.58 C ATOM 225 CE LYS A 17 -3.022 2.173 -3.736 1.00 1.19 C ATOM 226 NZ LYS A 17 -2.917 1.747 -5.159 1.00 2.02 N ATOM 0 H LYS A 17 -3.279 -2.221 -0.504 1.00 0.33 H new ATOM 0 HA LYS A 17 -3.692 -2.513 -3.277 1.00 0.38 H new ATOM 0 HB2 LYS A 17 -3.175 -0.439 -1.350 1.00 0.47 H new ATOM 0 HB3 LYS A 17 -2.057 -0.228 -2.684 1.00 0.47 H new ATOM 0 HG2 LYS A 17 -3.957 -0.247 -4.283 1.00 1.13 H new ATOM 0 HG3 LYS A 17 -5.077 -0.467 -2.954 1.00 1.13 H new ATOM 0 HD2 LYS A 17 -5.116 1.864 -3.382 1.00 1.58 H new ATOM 0 HD3 LYS A 17 -4.116 1.697 -1.952 1.00 1.58 H new ATOM 0 HE2 LYS A 17 -3.170 3.252 -3.690 1.00 1.19 H new ATOM 0 HE3 LYS A 17 -2.085 1.957 -3.222 1.00 1.19 H new ATOM 0 HZ1 LYS A 17 -2.351 2.440 -5.688 1.00 2.02 H new ATOM 0 HZ2 LYS A 17 -2.459 0.815 -5.209 1.00 2.02 H new ATOM 0 HZ3 LYS A 17 -3.868 1.688 -5.575 1.00 2.02 H new ATOM 240 N TYR A 18 -0.550 -2.565 -2.267 1.00 0.31 N ATOM 241 CA TYR A 18 0.805 -2.918 -2.677 1.00 0.31 C ATOM 242 C TYR A 18 0.849 -4.341 -3.222 1.00 0.29 C ATOM 243 O TYR A 18 1.179 -4.561 -4.388 1.00 0.32 O ATOM 244 CB TYR A 18 1.770 -2.779 -1.499 1.00 0.31 C ATOM 245 CG TYR A 18 3.177 -3.237 -1.811 1.00 0.32 C ATOM 246 CD1 TYR A 18 3.938 -2.593 -2.778 1.00 1.19 C ATOM 247 CD2 TYR A 18 3.744 -4.313 -1.140 1.00 1.17 C ATOM 248 CE1 TYR A 18 5.224 -3.008 -3.067 1.00 1.22 C ATOM 249 CE2 TYR A 18 5.029 -4.734 -1.423 1.00 1.21 C ATOM 250 CZ TYR A 18 5.765 -4.078 -2.387 1.00 0.50 C ATOM 251 OH TYR A 18 7.045 -4.494 -2.672 1.00 0.62 O ATOM 0 H TYR A 18 -0.642 -2.317 -1.282 1.00 0.31 H new ATOM 0 HA TYR A 18 1.111 -2.233 -3.468 1.00 0.31 H new ATOM 0 HB2 TYR A 18 1.798 -1.736 -1.184 1.00 0.31 H new ATOM 0 HB3 TYR A 18 1.388 -3.356 -0.657 1.00 0.31 H new ATOM 0 HD1 TYR A 18 3.518 -1.754 -3.313 1.00 1.19 H new ATOM 0 HD2 TYR A 18 3.171 -4.829 -0.384 1.00 1.17 H new ATOM 0 HE1 TYR A 18 5.802 -2.496 -3.822 1.00 1.22 H new ATOM 0 HE2 TYR A 18 5.455 -5.573 -0.892 1.00 1.21 H new ATOM 0 HH TYR A 18 7.436 -3.907 -3.353 1.00 0.62 H new ATOM 261 N ILE A 19 0.508 -5.304 -2.372 1.00 0.26 N ATOM 262 CA ILE A 19 0.501 -6.706 -2.767 1.00 0.27 C ATOM 263 C ILE A 19 -0.302 -6.904 -4.044 1.00 0.28 C ATOM 264 O ILE A 19 0.132 -7.605 -4.959 1.00 0.30 O ATOM 265 CB ILE A 19 -0.098 -7.596 -1.663 1.00 0.28 C ATOM 266 CG1 ILE A 19 0.762 -7.538 -0.402 1.00 0.45 C ATOM 267 CG2 ILE A 19 -0.232 -9.031 -2.146 1.00 0.47 C ATOM 268 CD1 ILE A 19 0.152 -8.274 0.769 1.00 0.49 C ATOM 0 H ILE A 19 0.233 -5.138 -1.404 1.00 0.26 H new ATOM 0 HA ILE A 19 1.538 -6.995 -2.936 1.00 0.27 H new ATOM 0 HB ILE A 19 -1.092 -7.219 -1.422 1.00 0.28 H new ATOM 0 HG12 ILE A 19 1.742 -7.962 -0.619 1.00 0.45 H new ATOM 0 HG13 ILE A 19 0.920 -6.496 -0.125 1.00 0.45 H new ATOM 0 HG21 ILE A 19 -0.657 -9.644 -1.351 1.00 0.47 H new ATOM 0 HG22 ILE A 19 -0.886 -9.062 -3.018 1.00 0.47 H new ATOM 0 HG23 ILE A 19 0.751 -9.417 -2.416 1.00 0.47 H new ATOM 0 HD11 ILE A 19 0.812 -8.194 1.633 1.00 0.49 H new ATOM 0 HD12 ILE A 19 -0.816 -7.835 1.010 1.00 0.49 H new ATOM 0 HD13 ILE A 19 0.019 -9.324 0.509 1.00 0.49 H new ATOM 280 N HIS A 20 -1.479 -6.283 -4.092 1.00 0.27 N ATOM 281 CA HIS A 20 -2.359 -6.382 -5.249 1.00 0.28 C ATOM 282 C HIS A 20 -1.576 -6.212 -6.545 1.00 0.31 C ATOM 283 O HIS A 20 -1.459 -7.149 -7.333 1.00 0.43 O ATOM 284 CB HIS A 20 -3.464 -5.330 -5.160 1.00 0.30 C ATOM 285 CG HIS A 20 -4.484 -5.437 -6.251 1.00 0.34 C ATOM 286 ND1 HIS A 20 -5.158 -4.347 -6.762 1.00 0.58 N ATOM 287 CD2 HIS A 20 -4.944 -6.514 -6.931 1.00 0.62 C ATOM 288 CE1 HIS A 20 -5.988 -4.749 -7.707 1.00 0.52 C ATOM 289 NE2 HIS A 20 -5.877 -6.059 -7.830 1.00 0.51 N ATOM 0 H HIS A 20 -1.845 -5.703 -3.337 1.00 0.27 H new ATOM 0 HA HIS A 20 -2.810 -7.374 -5.251 1.00 0.28 H new ATOM 0 HB2 HIS A 20 -3.965 -5.422 -4.196 1.00 0.30 H new ATOM 0 HB3 HIS A 20 -3.013 -4.338 -5.192 1.00 0.30 H new ATOM 0 HD2 HIS A 20 -4.635 -7.539 -6.792 1.00 0.62 H new ATOM 0 HE1 HIS A 20 -6.646 -4.114 -8.282 1.00 0.52 H new ATOM 0 HE2 HIS A 20 -6.400 -6.639 -8.486 1.00 0.51 H new ATOM 297 N TYR A 21 -1.038 -5.016 -6.759 1.00 0.33 N ATOM 298 CA TYR A 21 -0.260 -4.740 -7.961 1.00 0.39 C ATOM 299 C TYR A 21 0.784 -5.831 -8.181 1.00 0.37 C ATOM 300 O TYR A 21 1.040 -6.240 -9.313 1.00 0.48 O ATOM 301 CB TYR A 21 0.414 -3.367 -7.862 1.00 0.46 C ATOM 302 CG TYR A 21 1.926 -3.422 -7.846 1.00 0.42 C ATOM 303 CD1 TYR A 21 2.647 -3.670 -9.009 1.00 0.47 C ATOM 304 CD2 TYR A 21 2.633 -3.222 -6.667 1.00 0.41 C ATOM 305 CE1 TYR A 21 4.027 -3.720 -8.996 1.00 0.47 C ATOM 306 CE2 TYR A 21 4.013 -3.268 -6.646 1.00 0.43 C ATOM 307 CZ TYR A 21 4.706 -3.518 -7.813 1.00 0.44 C ATOM 308 OH TYR A 21 6.081 -3.565 -7.796 1.00 0.48 O ATOM 0 H TYR A 21 -1.126 -4.226 -6.120 1.00 0.33 H new ATOM 0 HA TYR A 21 -0.937 -4.730 -8.815 1.00 0.39 H new ATOM 0 HB2 TYR A 21 0.092 -2.754 -8.704 1.00 0.46 H new ATOM 0 HB3 TYR A 21 0.069 -2.869 -6.956 1.00 0.46 H new ATOM 0 HD1 TYR A 21 2.119 -3.826 -9.938 1.00 0.47 H new ATOM 0 HD2 TYR A 21 2.094 -3.027 -5.751 1.00 0.41 H new ATOM 0 HE1 TYR A 21 4.572 -3.916 -9.908 1.00 0.47 H new ATOM 0 HE2 TYR A 21 4.547 -3.109 -5.721 1.00 0.43 H new ATOM 0 HH TYR A 21 6.429 -3.275 -8.665 1.00 0.48 H new ATOM 318 N LYS A 22 1.376 -6.304 -7.088 1.00 0.30 N ATOM 319 CA LYS A 22 2.385 -7.356 -7.159 1.00 0.33 C ATOM 320 C LYS A 22 1.812 -8.611 -7.812 1.00 0.36 C ATOM 321 O LYS A 22 2.534 -9.373 -8.455 1.00 0.50 O ATOM 322 CB LYS A 22 2.908 -7.687 -5.760 1.00 0.37 C ATOM 323 CG LYS A 22 4.417 -7.855 -5.699 1.00 0.77 C ATOM 324 CD LYS A 22 5.135 -6.620 -6.218 1.00 0.95 C ATOM 325 CE LYS A 22 6.580 -6.577 -5.747 1.00 1.34 C ATOM 326 NZ LYS A 22 7.415 -7.608 -6.422 1.00 1.84 N ATOM 0 H LYS A 22 1.175 -5.976 -6.143 1.00 0.30 H new ATOM 0 HA LYS A 22 3.212 -6.994 -7.770 1.00 0.33 H new ATOM 0 HB2 LYS A 22 2.611 -6.894 -5.073 1.00 0.37 H new ATOM 0 HB3 LYS A 22 2.434 -8.605 -5.412 1.00 0.37 H new ATOM 0 HG2 LYS A 22 4.721 -8.049 -4.671 1.00 0.77 H new ATOM 0 HG3 LYS A 22 4.712 -8.723 -6.288 1.00 0.77 H new ATOM 0 HD2 LYS A 22 5.106 -6.612 -7.308 1.00 0.95 H new ATOM 0 HD3 LYS A 22 4.614 -5.725 -5.878 1.00 0.95 H new ATOM 0 HE2 LYS A 22 6.996 -5.589 -5.942 1.00 1.34 H new ATOM 0 HE3 LYS A 22 6.615 -6.731 -4.668 1.00 1.34 H new ATOM 0 HZ1 LYS A 22 8.393 -7.546 -6.073 1.00 1.84 H new ATOM 0 HZ2 LYS A 22 7.034 -8.553 -6.216 1.00 1.84 H new ATOM 0 HZ3 LYS A 22 7.403 -7.447 -7.449 1.00 1.84 H new ATOM 340 N LEU A 23 0.506 -8.810 -7.655 1.00 0.34 N ATOM 341 CA LEU A 23 -0.165 -9.963 -8.243 1.00 0.37 C ATOM 342 C LEU A 23 -0.660 -9.618 -9.644 1.00 0.40 C ATOM 343 O LEU A 23 -0.452 -10.376 -10.592 1.00 0.43 O ATOM 344 CB LEU A 23 -1.338 -10.413 -7.365 1.00 0.40 C ATOM 345 CG LEU A 23 -0.984 -11.353 -6.203 1.00 0.37 C ATOM 346 CD1 LEU A 23 -0.045 -12.460 -6.659 1.00 0.56 C ATOM 347 CD2 LEU A 23 -0.371 -10.576 -5.048 1.00 0.71 C ATOM 0 H LEU A 23 -0.106 -8.189 -7.127 1.00 0.34 H new ATOM 0 HA LEU A 23 0.549 -10.784 -8.308 1.00 0.37 H new ATOM 0 HB2 LEU A 23 -1.821 -9.526 -6.955 1.00 0.40 H new ATOM 0 HB3 LEU A 23 -2.071 -10.911 -7.999 1.00 0.40 H new ATOM 0 HG LEU A 23 -1.908 -11.815 -5.856 1.00 0.37 H new ATOM 0 HD11 LEU A 23 0.188 -13.110 -5.815 1.00 0.56 H new ATOM 0 HD12 LEU A 23 -0.525 -13.043 -7.445 1.00 0.56 H new ATOM 0 HD13 LEU A 23 0.875 -12.021 -7.044 1.00 0.56 H new ATOM 0 HD21 LEU A 23 -0.128 -11.262 -4.236 1.00 0.71 H new ATOM 0 HD22 LEU A 23 0.538 -10.078 -5.386 1.00 0.71 H new ATOM 0 HD23 LEU A 23 -1.083 -9.831 -4.693 1.00 0.71 H new ATOM 359 N SER A 24 -1.306 -8.462 -9.767 1.00 0.41 N ATOM 360 CA SER A 24 -1.822 -8.004 -11.052 1.00 0.45 C ATOM 361 C SER A 24 -0.726 -8.020 -12.117 1.00 0.49 C ATOM 362 O SER A 24 -1.010 -8.147 -13.308 1.00 0.53 O ATOM 363 CB SER A 24 -2.399 -6.593 -10.920 1.00 0.52 C ATOM 364 OG SER A 24 -3.816 -6.619 -10.925 1.00 1.44 O ATOM 0 H SER A 24 -1.485 -7.825 -8.991 1.00 0.41 H new ATOM 0 HA SER A 24 -2.614 -8.686 -11.361 1.00 0.45 H new ATOM 0 HB2 SER A 24 -2.044 -6.136 -9.996 1.00 0.52 H new ATOM 0 HB3 SER A 24 -2.041 -5.972 -11.741 1.00 0.52 H new ATOM 0 HG SER A 24 -4.160 -5.706 -10.838 1.00 1.44 H new ATOM 370 N GLN A 25 0.527 -7.906 -11.680 1.00 0.50 N ATOM 371 CA GLN A 25 1.653 -7.926 -12.601 1.00 0.57 C ATOM 372 C GLN A 25 1.586 -9.177 -13.470 1.00 0.60 C ATOM 373 O GLN A 25 1.808 -9.123 -14.680 1.00 0.70 O ATOM 374 CB GLN A 25 2.976 -7.883 -11.831 1.00 0.58 C ATOM 375 CG GLN A 25 3.976 -6.887 -12.394 1.00 0.56 C ATOM 376 CD GLN A 25 4.402 -7.224 -13.810 1.00 1.36 C ATOM 377 OE1 GLN A 25 3.609 -7.130 -14.747 1.00 2.21 O ATOM 378 NE2 GLN A 25 5.659 -7.619 -13.972 1.00 2.08 N ATOM 0 H GLN A 25 0.783 -7.800 -10.699 1.00 0.50 H new ATOM 0 HA GLN A 25 1.601 -7.045 -13.241 1.00 0.57 H new ATOM 0 HB2 GLN A 25 2.773 -7.632 -10.790 1.00 0.58 H new ATOM 0 HB3 GLN A 25 3.423 -8.877 -11.838 1.00 0.58 H new ATOM 0 HG2 GLN A 25 3.537 -5.889 -12.378 1.00 0.56 H new ATOM 0 HG3 GLN A 25 4.856 -6.858 -11.751 1.00 0.56 H new ATOM 0 HE21 GLN A 25 6.282 -7.682 -13.166 1.00 2.08 H new ATOM 0 HE22 GLN A 25 6.002 -7.859 -14.902 1.00 2.08 H new ATOM 387 N ARG A 26 1.265 -10.301 -12.838 1.00 0.58 N ATOM 388 CA ARG A 26 1.151 -11.574 -13.539 1.00 0.66 C ATOM 389 C ARG A 26 -0.240 -11.730 -14.144 1.00 0.65 C ATOM 390 O ARG A 26 -0.384 -12.111 -15.306 1.00 0.73 O ATOM 391 CB ARG A 26 1.438 -12.734 -12.586 1.00 0.70 C ATOM 392 CG ARG A 26 2.710 -12.551 -11.775 1.00 0.97 C ATOM 393 CD ARG A 26 2.403 -12.268 -10.313 1.00 0.70 C ATOM 394 NE ARG A 26 3.551 -12.547 -9.453 1.00 1.22 N ATOM 395 CZ ARG A 26 4.575 -11.712 -9.282 1.00 1.89 C ATOM 396 NH1 ARG A 26 4.602 -10.540 -9.906 1.00 2.58 N ATOM 397 NH2 ARG A 26 5.577 -12.051 -8.483 1.00 2.43 N ATOM 0 H ARG A 26 1.078 -10.356 -11.837 1.00 0.58 H new ATOM 0 HA ARG A 26 1.886 -11.588 -14.344 1.00 0.66 H new ATOM 0 HB2 ARG A 26 0.595 -12.851 -11.904 1.00 0.70 H new ATOM 0 HB3 ARG A 26 1.513 -13.657 -13.161 1.00 0.70 H new ATOM 0 HG2 ARG A 26 3.324 -13.448 -11.852 1.00 0.97 H new ATOM 0 HG3 ARG A 26 3.293 -11.729 -12.191 1.00 0.97 H new ATOM 0 HD2 ARG A 26 2.109 -11.225 -10.199 1.00 0.70 H new ATOM 0 HD3 ARG A 26 1.555 -12.875 -9.996 1.00 0.70 H new ATOM 0 HE ARG A 26 3.569 -13.436 -8.953 1.00 1.22 H new ATOM 0 HH11 ARG A 26 3.835 -10.273 -10.522 1.00 2.58 H new ATOM 0 HH12 ARG A 26 5.390 -9.907 -9.769 1.00 2.58 H new ATOM 0 HH21 ARG A 26 5.563 -12.950 -8.001 1.00 2.43 H new ATOM 0 HH22 ARG A 26 6.362 -11.413 -8.351 1.00 2.43 H new ATOM 411 N GLY A 27 -1.263 -11.428 -13.350 1.00 0.59 N ATOM 412 CA GLY A 27 -2.629 -11.536 -13.830 1.00 0.60 C ATOM 413 C GLY A 27 -3.536 -12.327 -12.902 1.00 0.62 C ATOM 414 O GLY A 27 -4.733 -12.449 -13.161 1.00 0.99 O ATOM 0 H GLY A 27 -1.171 -11.111 -12.385 1.00 0.59 H new ATOM 0 HA2 GLY A 27 -3.040 -10.535 -13.961 1.00 0.60 H new ATOM 0 HA3 GLY A 27 -2.625 -12.010 -14.812 1.00 0.60 H new ATOM 418 N TYR A 28 -2.977 -12.865 -11.821 1.00 0.60 N ATOM 419 CA TYR A 28 -3.761 -13.639 -10.869 1.00 0.61 C ATOM 420 C TYR A 28 -4.740 -12.738 -10.121 1.00 0.63 C ATOM 421 O TYR A 28 -4.341 -11.916 -9.295 1.00 0.99 O ATOM 422 CB TYR A 28 -2.830 -14.350 -9.887 1.00 0.80 C ATOM 423 CG TYR A 28 -3.412 -14.514 -8.505 1.00 0.55 C ATOM 424 CD1 TYR A 28 -4.354 -15.498 -8.241 1.00 1.35 C ATOM 425 CD2 TYR A 28 -3.015 -13.686 -7.465 1.00 1.20 C ATOM 426 CE1 TYR A 28 -4.887 -15.654 -6.976 1.00 1.49 C ATOM 427 CE2 TYR A 28 -3.542 -13.837 -6.196 1.00 1.18 C ATOM 428 CZ TYR A 28 -4.477 -14.822 -5.957 1.00 0.78 C ATOM 429 OH TYR A 28 -5.004 -14.974 -4.695 1.00 1.10 O ATOM 0 H TYR A 28 -1.988 -12.779 -11.585 1.00 0.60 H new ATOM 0 HA TYR A 28 -4.337 -14.387 -11.414 1.00 0.61 H new ATOM 0 HB2 TYR A 28 -2.580 -15.334 -10.285 1.00 0.80 H new ATOM 0 HB3 TYR A 28 -1.898 -13.790 -9.814 1.00 0.80 H new ATOM 0 HD1 TYR A 28 -4.676 -16.153 -9.037 1.00 1.35 H new ATOM 0 HD2 TYR A 28 -2.284 -12.913 -7.649 1.00 1.20 H new ATOM 0 HE1 TYR A 28 -5.621 -16.424 -6.787 1.00 1.49 H new ATOM 0 HE2 TYR A 28 -3.223 -13.186 -5.395 1.00 1.18 H new ATOM 0 HH TYR A 28 -5.077 -14.097 -4.263 1.00 1.10 H new ATOM 439 N GLU A 29 -6.025 -12.893 -10.427 1.00 0.63 N ATOM 440 CA GLU A 29 -7.070 -12.091 -9.800 1.00 0.63 C ATOM 441 C GLU A 29 -7.191 -12.401 -8.313 1.00 0.58 C ATOM 442 O GLU A 29 -8.033 -13.199 -7.900 1.00 0.69 O ATOM 443 CB GLU A 29 -8.412 -12.337 -10.491 1.00 0.79 C ATOM 444 CG GLU A 29 -8.342 -12.246 -12.007 1.00 1.20 C ATOM 445 CD GLU A 29 -9.700 -12.019 -12.641 1.00 1.85 C ATOM 446 OE1 GLU A 29 -10.525 -12.957 -12.629 1.00 2.58 O ATOM 447 OE2 GLU A 29 -9.939 -10.903 -13.148 1.00 2.32 O ATOM 0 H GLU A 29 -6.368 -13.570 -11.108 1.00 0.63 H new ATOM 0 HA GLU A 29 -6.794 -11.042 -9.908 1.00 0.63 H new ATOM 0 HB2 GLU A 29 -8.780 -13.324 -10.211 1.00 0.79 H new ATOM 0 HB3 GLU A 29 -9.138 -11.611 -10.125 1.00 0.79 H new ATOM 0 HG2 GLU A 29 -7.673 -11.432 -12.288 1.00 1.20 H new ATOM 0 HG3 GLU A 29 -7.909 -13.165 -12.403 1.00 1.20 H new ATOM 454 N TRP A 30 -6.351 -11.757 -7.513 1.00 0.48 N ATOM 455 CA TRP A 30 -6.368 -11.957 -6.068 1.00 0.47 C ATOM 456 C TRP A 30 -7.727 -11.580 -5.487 1.00 0.56 C ATOM 457 O TRP A 30 -8.205 -10.462 -5.678 1.00 0.85 O ATOM 458 CB TRP A 30 -5.272 -11.126 -5.399 1.00 0.42 C ATOM 459 CG TRP A 30 -5.358 -11.133 -3.903 1.00 0.36 C ATOM 460 CD1 TRP A 30 -5.882 -12.119 -3.118 1.00 0.36 C ATOM 461 CD2 TRP A 30 -4.911 -10.104 -3.012 1.00 0.36 C ATOM 462 NE1 TRP A 30 -5.788 -11.767 -1.793 1.00 0.36 N ATOM 463 CE2 TRP A 30 -5.195 -10.535 -1.702 1.00 0.36 C ATOM 464 CE3 TRP A 30 -4.297 -8.862 -3.194 1.00 0.42 C ATOM 465 CZ2 TRP A 30 -4.886 -9.767 -0.582 1.00 0.41 C ATOM 466 CZ3 TRP A 30 -3.991 -8.101 -2.082 1.00 0.47 C ATOM 467 CH2 TRP A 30 -4.285 -8.556 -0.790 1.00 0.46 C ATOM 0 H TRP A 30 -5.650 -11.092 -7.839 1.00 0.48 H new ATOM 0 HA TRP A 30 -6.183 -13.013 -5.872 1.00 0.47 H new ATOM 0 HB2 TRP A 30 -4.298 -11.509 -5.703 1.00 0.42 H new ATOM 0 HB3 TRP A 30 -5.335 -10.098 -5.756 1.00 0.42 H new ATOM 0 HD1 TRP A 30 -6.308 -13.041 -3.485 1.00 0.36 H new ATOM 0 HE1 TRP A 30 -6.108 -12.331 -1.005 1.00 0.36 H new ATOM 0 HE3 TRP A 30 -4.066 -8.503 -4.186 1.00 0.42 H new ATOM 0 HZ2 TRP A 30 -5.113 -10.115 0.415 1.00 0.41 H new ATOM 0 HZ3 TRP A 30 -3.517 -7.139 -2.211 1.00 0.47 H new ATOM 0 HH2 TRP A 30 -4.032 -7.938 0.059 1.00 0.46 H new ATOM 478 N ASP A 31 -8.344 -12.518 -4.777 1.00 0.86 N ATOM 479 CA ASP A 31 -9.648 -12.280 -4.168 1.00 1.00 C ATOM 480 C ASP A 31 -9.496 -11.635 -2.794 1.00 0.97 C ATOM 481 O ASP A 31 -9.940 -12.186 -1.786 1.00 1.29 O ATOM 482 CB ASP A 31 -10.425 -13.591 -4.046 1.00 1.26 C ATOM 483 CG ASP A 31 -11.032 -14.029 -5.364 1.00 2.13 C ATOM 484 OD1 ASP A 31 -10.713 -13.407 -6.400 1.00 2.71 O ATOM 485 OD2 ASP A 31 -11.825 -14.993 -5.362 1.00 2.82 O ATOM 0 H ASP A 31 -7.963 -13.449 -4.609 1.00 0.86 H new ATOM 0 HA ASP A 31 -10.203 -11.597 -4.811 1.00 1.00 H new ATOM 0 HB2 ASP A 31 -9.759 -14.372 -3.679 1.00 1.26 H new ATOM 0 HB3 ASP A 31 -11.217 -13.473 -3.306 1.00 1.26 H new ATOM 490 N ALA A 32 -8.865 -10.466 -2.761 1.00 0.95 N ATOM 491 CA ALA A 32 -8.654 -9.746 -1.510 1.00 0.99 C ATOM 492 C ALA A 32 -9.970 -9.219 -0.949 1.00 1.18 C ATOM 493 O ALA A 32 -10.316 -9.485 0.202 1.00 1.46 O ATOM 494 CB ALA A 32 -7.672 -8.604 -1.721 1.00 1.05 C ATOM 0 H ALA A 32 -8.491 -9.997 -3.586 1.00 0.95 H new ATOM 0 HA ALA A 32 -8.235 -10.443 -0.784 1.00 0.99 H new ATOM 0 HB1 ALA A 32 -7.523 -8.074 -0.780 1.00 1.05 H new ATOM 0 HB2 ALA A 32 -6.719 -9.003 -2.068 1.00 1.05 H new ATOM 0 HB3 ALA A 32 -8.070 -7.915 -2.466 1.00 1.05 H new ATOM 500 N GLY A 33 -10.699 -8.469 -1.769 1.00 1.41 N ATOM 501 CA GLY A 33 -11.968 -7.915 -1.335 1.00 1.62 C ATOM 502 C GLY A 33 -13.122 -8.876 -1.543 1.00 2.53 C ATOM 503 O GLY A 33 -13.988 -8.644 -2.387 1.00 3.27 O ATOM 0 H GLY A 33 -10.434 -8.235 -2.726 1.00 1.41 H new ATOM 0 HA2 GLY A 33 -11.904 -7.652 -0.279 1.00 1.62 H new ATOM 0 HA3 GLY A 33 -12.164 -6.993 -1.882 1.00 1.62 H new ATOM 507 N ASP A 34 -13.135 -9.957 -0.771 1.00 3.10 N ATOM 508 CA ASP A 34 -14.192 -10.957 -0.874 1.00 4.25 C ATOM 509 C ASP A 34 -15.567 -10.300 -0.839 1.00 4.56 C ATOM 510 O ASP A 34 -16.513 -10.782 -1.462 1.00 5.25 O ATOM 511 CB ASP A 34 -14.071 -11.976 0.261 1.00 5.08 C ATOM 512 CG ASP A 34 -14.268 -13.400 -0.218 1.00 5.80 C ATOM 513 OD1 ASP A 34 -13.592 -13.799 -1.190 1.00 6.10 O ATOM 514 OD2 ASP A 34 -15.098 -14.118 0.378 1.00 6.39 O ATOM 0 H ASP A 34 -12.426 -10.163 -0.067 1.00 3.10 H new ATOM 0 HA ASP A 34 -14.080 -11.472 -1.828 1.00 4.25 H new ATOM 0 HB2 ASP A 34 -13.089 -11.884 0.725 1.00 5.08 H new ATOM 0 HB3 ASP A 34 -14.809 -11.749 1.030 1.00 5.08 H new ATOM 519 N ASP A 35 -15.671 -9.196 -0.105 1.00 4.40 N ATOM 520 CA ASP A 35 -16.932 -8.472 0.011 1.00 4.91 C ATOM 521 C ASP A 35 -17.173 -7.601 -1.217 1.00 4.64 C ATOM 522 O ASP A 35 -17.031 -6.379 -1.162 1.00 4.81 O ATOM 523 CB ASP A 35 -16.933 -7.607 1.273 1.00 5.75 C ATOM 524 CG ASP A 35 -18.318 -7.458 1.870 1.00 6.68 C ATOM 525 OD1 ASP A 35 -18.882 -8.476 2.323 1.00 7.25 O ATOM 526 OD2 ASP A 35 -18.839 -6.323 1.885 1.00 7.08 O ATOM 0 H ASP A 35 -14.898 -8.784 0.418 1.00 4.40 H new ATOM 0 HA ASP A 35 -17.738 -9.203 0.080 1.00 4.91 H new ATOM 0 HB2 ASP A 35 -16.267 -8.049 2.014 1.00 5.75 H new ATOM 0 HB3 ASP A 35 -16.535 -6.621 1.035 1.00 5.75 H new ATOM 531 N VAL A 36 -17.540 -8.237 -2.324 1.00 4.72 N ATOM 532 CA VAL A 36 -17.802 -7.521 -3.567 1.00 4.94 C ATOM 533 C VAL A 36 -19.256 -7.071 -3.645 1.00 5.18 C ATOM 534 O VAL A 36 -19.965 -7.391 -4.599 1.00 5.68 O ATOM 535 CB VAL A 36 -17.479 -8.391 -4.796 1.00 5.44 C ATOM 536 CG1 VAL A 36 -18.375 -9.619 -4.832 1.00 5.96 C ATOM 537 CG2 VAL A 36 -17.621 -7.580 -6.075 1.00 6.12 C ATOM 0 H VAL A 36 -17.663 -9.248 -2.386 1.00 4.72 H new ATOM 0 HA VAL A 36 -17.152 -6.646 -3.571 1.00 4.94 H new ATOM 0 HB VAL A 36 -16.445 -8.728 -4.719 1.00 5.44 H new ATOM 0 HG11 VAL A 36 -18.132 -10.221 -5.707 1.00 5.96 H new ATOM 0 HG12 VAL A 36 -18.218 -10.210 -3.930 1.00 5.96 H new ATOM 0 HG13 VAL A 36 -19.418 -9.307 -4.885 1.00 5.96 H new ATOM 0 HG21 VAL A 36 -17.389 -8.211 -6.933 1.00 6.12 H new ATOM 0 HG22 VAL A 36 -18.643 -7.212 -6.161 1.00 6.12 H new ATOM 0 HG23 VAL A 36 -16.932 -6.735 -6.049 1.00 6.12 H new ATOM 547 N GLU A 37 -19.695 -6.327 -2.635 1.00 5.23 N ATOM 548 CA GLU A 37 -21.066 -5.832 -2.589 1.00 5.82 C ATOM 549 C GLU A 37 -21.108 -4.321 -2.787 1.00 6.05 C ATOM 550 O GLU A 37 -21.907 -3.627 -2.159 1.00 6.18 O ATOM 551 CB GLU A 37 -21.719 -6.202 -1.256 1.00 6.18 C ATOM 552 CG GLU A 37 -21.785 -7.699 -1.006 1.00 6.33 C ATOM 553 CD GLU A 37 -21.486 -8.063 0.435 1.00 7.24 C ATOM 554 OE1 GLU A 37 -21.534 -7.161 1.297 1.00 7.50 O ATOM 555 OE2 GLU A 37 -21.203 -9.251 0.701 1.00 7.91 O ATOM 0 H GLU A 37 -19.121 -6.054 -1.837 1.00 5.23 H new ATOM 0 HA GLU A 37 -21.622 -6.301 -3.401 1.00 5.82 H new ATOM 0 HB2 GLU A 37 -21.163 -5.731 -0.445 1.00 6.18 H new ATOM 0 HB3 GLU A 37 -22.729 -5.793 -1.230 1.00 6.18 H new ATOM 0 HG2 GLU A 37 -22.777 -8.064 -1.271 1.00 6.33 H new ATOM 0 HG3 GLU A 37 -21.074 -8.205 -1.660 1.00 6.33 H new ATOM 562 N GLU A 38 -20.240 -3.822 -3.668 1.00 6.42 N ATOM 563 CA GLU A 38 -20.162 -2.392 -3.964 1.00 6.91 C ATOM 564 C GLU A 38 -20.232 -1.555 -2.689 1.00 6.83 C ATOM 565 O GLU A 38 -21.304 -1.104 -2.287 1.00 7.12 O ATOM 566 CB GLU A 38 -21.278 -1.976 -4.930 1.00 7.68 C ATOM 567 CG GLU A 38 -22.663 -2.458 -4.526 1.00 8.06 C ATOM 568 CD GLU A 38 -23.752 -1.931 -5.439 1.00 8.78 C ATOM 569 OE1 GLU A 38 -23.415 -1.363 -6.499 1.00 9.10 O ATOM 570 OE2 GLU A 38 -24.942 -2.087 -5.095 1.00 9.26 O ATOM 0 H GLU A 38 -19.577 -4.393 -4.192 1.00 6.42 H new ATOM 0 HA GLU A 38 -19.198 -2.207 -4.439 1.00 6.91 H new ATOM 0 HB2 GLU A 38 -21.291 -0.889 -5.005 1.00 7.68 H new ATOM 0 HB3 GLU A 38 -21.046 -2.362 -5.923 1.00 7.68 H new ATOM 0 HG2 GLU A 38 -22.682 -3.548 -4.536 1.00 8.06 H new ATOM 0 HG3 GLU A 38 -22.869 -2.145 -3.502 1.00 8.06 H new ATOM 577 N ASN A 39 -19.080 -1.351 -2.059 1.00 6.73 N ATOM 578 CA ASN A 39 -19.009 -0.568 -0.830 1.00 6.89 C ATOM 579 C ASN A 39 -18.481 0.836 -1.109 1.00 6.79 C ATOM 580 O ASN A 39 -17.273 1.072 -1.084 1.00 7.10 O ATOM 581 CB ASN A 39 -18.114 -1.268 0.194 1.00 7.50 C ATOM 582 CG ASN A 39 -18.089 -0.548 1.528 1.00 7.98 C ATOM 583 OD1 ASN A 39 -17.023 -0.255 2.068 1.00 8.08 O ATOM 584 ND2 ASN A 39 -19.268 -0.259 2.066 1.00 8.58 N ATOM 0 H ASN A 39 -18.183 -1.717 -2.379 1.00 6.73 H new ATOM 0 HA ASN A 39 -20.017 -0.483 -0.424 1.00 6.89 H new ATOM 0 HB2 ASN A 39 -18.466 -2.289 0.342 1.00 7.50 H new ATOM 0 HB3 ASN A 39 -17.100 -1.334 -0.199 1.00 7.50 H new ATOM 0 HD21 ASN A 39 -19.315 0.225 2.963 1.00 8.58 H new ATOM 0 HD22 ASN A 39 -20.127 -0.521 1.583 1.00 8.58 H new ATOM 591 N ARG A 40 -19.394 1.764 -1.375 1.00 6.66 N ATOM 592 CA ARG A 40 -19.020 3.145 -1.658 1.00 6.87 C ATOM 593 C ARG A 40 -19.390 4.059 -0.495 1.00 6.86 C ATOM 594 O ARG A 40 -20.130 5.028 -0.664 1.00 7.36 O ATOM 595 CB ARG A 40 -19.704 3.628 -2.939 1.00 6.93 C ATOM 596 CG ARG A 40 -20.066 2.504 -3.897 1.00 7.23 C ATOM 597 CD ARG A 40 -21.459 1.964 -3.620 1.00 7.49 C ATOM 598 NE ARG A 40 -22.368 2.193 -4.741 1.00 7.97 N ATOM 599 CZ ARG A 40 -23.694 2.107 -4.654 1.00 8.38 C ATOM 600 NH1 ARG A 40 -24.276 1.797 -3.501 1.00 8.41 N ATOM 601 NH2 ARG A 40 -24.443 2.332 -5.725 1.00 9.03 N ATOM 0 H ARG A 40 -20.398 1.585 -1.401 1.00 6.66 H new ATOM 0 HA ARG A 40 -17.939 3.181 -1.795 1.00 6.87 H new ATOM 0 HB2 ARG A 40 -20.609 4.174 -2.674 1.00 6.93 H new ATOM 0 HB3 ARG A 40 -19.046 4.331 -3.449 1.00 6.93 H new ATOM 0 HG2 ARG A 40 -20.013 2.868 -4.923 1.00 7.23 H new ATOM 0 HG3 ARG A 40 -19.337 1.698 -3.806 1.00 7.23 H new ATOM 0 HD2 ARG A 40 -21.399 0.895 -3.414 1.00 7.49 H new ATOM 0 HD3 ARG A 40 -21.861 2.439 -2.725 1.00 7.49 H new ATOM 0 HE ARG A 40 -21.962 2.433 -5.645 1.00 7.97 H new ATOM 0 HH11 ARG A 40 -23.707 1.623 -2.673 1.00 8.41 H new ATOM 0 HH12 ARG A 40 -25.292 1.733 -3.444 1.00 8.41 H new ATOM 0 HH21 ARG A 40 -24.003 2.571 -6.614 1.00 9.03 H new ATOM 0 HH22 ARG A 40 -25.459 2.266 -5.660 1.00 9.03 H new ATOM 615 N THR A 41 -18.871 3.743 0.687 1.00 6.54 N ATOM 616 CA THR A 41 -19.147 4.535 1.880 1.00 6.69 C ATOM 617 C THR A 41 -18.911 6.019 1.613 1.00 6.62 C ATOM 618 O THR A 41 -19.856 6.781 1.413 1.00 6.68 O ATOM 619 CB THR A 41 -18.270 4.068 3.042 1.00 6.74 C ATOM 620 OG1 THR A 41 -17.246 3.204 2.582 1.00 6.84 O ATOM 621 CG2 THR A 41 -19.042 3.334 4.117 1.00 7.14 C ATOM 0 H THR A 41 -18.257 2.944 0.844 1.00 6.54 H new ATOM 0 HA THR A 41 -20.195 4.394 2.146 1.00 6.69 H new ATOM 0 HB THR A 41 -17.854 4.978 3.474 1.00 6.74 H new ATOM 0 HG1 THR A 41 -16.695 2.918 3.340 1.00 6.84 H new ATOM 0 HG21 THR A 41 -18.360 3.030 4.911 1.00 7.14 H new ATOM 0 HG22 THR A 41 -19.808 3.991 4.528 1.00 7.14 H new ATOM 0 HG23 THR A 41 -19.514 2.451 3.687 1.00 7.14 H new ATOM 629 N GLU A 42 -17.644 6.421 1.612 1.00 6.80 N ATOM 630 CA GLU A 42 -17.284 7.813 1.370 1.00 6.99 C ATOM 631 C GLU A 42 -16.593 7.970 0.023 1.00 6.54 C ATOM 632 O GLU A 42 -15.736 8.836 -0.149 1.00 6.77 O ATOM 633 CB GLU A 42 -16.378 8.332 2.487 1.00 7.43 C ATOM 634 CG GLU A 42 -16.394 7.465 3.735 1.00 7.92 C ATOM 635 CD GLU A 42 -15.985 8.227 4.980 1.00 8.54 C ATOM 636 OE1 GLU A 42 -14.768 8.331 5.240 1.00 9.10 O ATOM 637 OE2 GLU A 42 -16.882 8.722 5.695 1.00 8.71 O ATOM 0 H GLU A 42 -16.850 5.802 1.776 1.00 6.80 H new ATOM 0 HA GLU A 42 -18.202 8.401 1.357 1.00 6.99 H new ATOM 0 HB2 GLU A 42 -15.356 8.398 2.114 1.00 7.43 H new ATOM 0 HB3 GLU A 42 -16.686 9.343 2.753 1.00 7.43 H new ATOM 0 HG2 GLU A 42 -17.395 7.056 3.876 1.00 7.92 H new ATOM 0 HG3 GLU A 42 -15.721 6.619 3.594 1.00 7.92 H new ATOM 644 N ALA A 43 -16.979 7.133 -0.934 1.00 6.13 N ATOM 645 CA ALA A 43 -16.401 7.191 -2.267 1.00 5.94 C ATOM 646 C ALA A 43 -14.941 6.748 -2.256 1.00 5.40 C ATOM 647 O ALA A 43 -14.244 6.897 -1.253 1.00 5.44 O ATOM 648 CB ALA A 43 -16.526 8.601 -2.818 1.00 6.51 C ATOM 0 H ALA A 43 -17.687 6.410 -0.810 1.00 6.13 H new ATOM 0 HA ALA A 43 -16.949 6.504 -2.912 1.00 5.94 H new ATOM 0 HB1 ALA A 43 -16.092 8.641 -3.817 1.00 6.51 H new ATOM 0 HB2 ALA A 43 -17.578 8.880 -2.868 1.00 6.51 H new ATOM 0 HB3 ALA A 43 -15.997 9.295 -2.165 1.00 6.51 H new ATOM 654 N PRO A 44 -14.462 6.194 -3.380 1.00 5.27 N ATOM 655 CA PRO A 44 -13.079 5.724 -3.506 1.00 5.11 C ATOM 656 C PRO A 44 -12.077 6.873 -3.574 1.00 4.87 C ATOM 657 O PRO A 44 -10.913 6.714 -3.206 1.00 5.35 O ATOM 658 CB PRO A 44 -13.090 4.946 -4.823 1.00 5.53 C ATOM 659 CG PRO A 44 -14.193 5.558 -5.614 1.00 5.93 C ATOM 660 CD PRO A 44 -15.236 5.982 -4.617 1.00 5.75 C ATOM 0 HA PRO A 44 -12.770 5.131 -2.645 1.00 5.11 H new ATOM 0 HB2 PRO A 44 -12.135 5.032 -5.342 1.00 5.53 H new ATOM 0 HB3 PRO A 44 -13.266 3.884 -4.654 1.00 5.53 H new ATOM 0 HG2 PRO A 44 -13.833 6.412 -6.189 1.00 5.93 H new ATOM 0 HG3 PRO A 44 -14.604 4.844 -6.328 1.00 5.93 H new ATOM 0 HD2 PRO A 44 -15.746 6.892 -4.932 1.00 5.75 H new ATOM 0 HD3 PRO A 44 -16.001 5.217 -4.486 1.00 5.75 H new ATOM 668 N GLU A 45 -12.534 8.028 -4.050 1.00 4.48 N ATOM 669 CA GLU A 45 -11.676 9.202 -4.167 1.00 4.55 C ATOM 670 C GLU A 45 -10.889 9.436 -2.881 1.00 4.19 C ATOM 671 O GLU A 45 -11.466 9.715 -1.831 1.00 4.69 O ATOM 672 CB GLU A 45 -12.512 10.440 -4.499 1.00 5.41 C ATOM 673 CG GLU A 45 -12.981 10.488 -5.944 1.00 6.13 C ATOM 674 CD GLU A 45 -11.834 10.624 -6.926 1.00 6.96 C ATOM 675 OE1 GLU A 45 -10.748 11.080 -6.511 1.00 7.57 O ATOM 676 OE2 GLU A 45 -12.022 10.274 -8.111 1.00 7.23 O ATOM 0 H GLU A 45 -13.494 8.175 -4.361 1.00 4.48 H new ATOM 0 HA GLU A 45 -10.968 9.022 -4.976 1.00 4.55 H new ATOM 0 HB2 GLU A 45 -13.382 10.468 -3.842 1.00 5.41 H new ATOM 0 HB3 GLU A 45 -11.924 11.333 -4.287 1.00 5.41 H new ATOM 0 HG2 GLU A 45 -13.542 9.581 -6.170 1.00 6.13 H new ATOM 0 HG3 GLU A 45 -13.665 11.327 -6.072 1.00 6.13 H new ATOM 683 N GLY A 46 -9.568 9.319 -2.974 1.00 3.68 N ATOM 684 CA GLY A 46 -8.721 9.521 -1.813 1.00 3.54 C ATOM 685 C GLY A 46 -7.363 10.086 -2.179 1.00 3.04 C ATOM 686 O GLY A 46 -6.330 9.533 -1.800 1.00 3.12 O ATOM 0 H GLY A 46 -9.069 9.088 -3.833 1.00 3.68 H new ATOM 0 HA2 GLY A 46 -9.218 10.198 -1.118 1.00 3.54 H new ATOM 0 HA3 GLY A 46 -8.589 8.572 -1.294 1.00 3.54 H new ATOM 690 N THR A 47 -7.365 11.189 -2.921 1.00 2.96 N ATOM 691 CA THR A 47 -6.126 11.833 -3.344 1.00 2.66 C ATOM 692 C THR A 47 -5.158 11.983 -2.175 1.00 2.34 C ATOM 693 O THR A 47 -3.941 11.941 -2.355 1.00 2.51 O ATOM 694 CB THR A 47 -6.424 13.204 -3.954 1.00 3.12 C ATOM 695 OG1 THR A 47 -6.834 14.119 -2.953 1.00 3.75 O ATOM 696 CG2 THR A 47 -7.505 13.166 -5.012 1.00 3.41 C ATOM 0 H THR A 47 -8.213 11.656 -3.242 1.00 2.96 H new ATOM 0 HA THR A 47 -5.657 11.200 -4.097 1.00 2.66 H new ATOM 0 HB THR A 47 -5.492 13.521 -4.422 1.00 3.12 H new ATOM 0 HG1 THR A 47 -7.018 14.990 -3.362 1.00 3.75 H new ATOM 0 HG21 THR A 47 -7.667 14.170 -5.403 1.00 3.41 H new ATOM 0 HG22 THR A 47 -7.197 12.506 -5.823 1.00 3.41 H new ATOM 0 HG23 THR A 47 -8.431 12.794 -4.573 1.00 3.41 H new ATOM 704 N GLU A 48 -5.707 12.159 -0.977 1.00 2.22 N ATOM 705 CA GLU A 48 -4.890 12.316 0.220 1.00 2.10 C ATOM 706 C GLU A 48 -3.857 11.198 0.324 1.00 1.55 C ATOM 707 O GLU A 48 -2.664 11.420 0.120 1.00 1.75 O ATOM 708 CB GLU A 48 -5.773 12.328 1.469 1.00 2.49 C ATOM 709 CG GLU A 48 -5.619 13.584 2.311 1.00 2.71 C ATOM 710 CD GLU A 48 -6.925 14.032 2.936 1.00 3.04 C ATOM 711 OE1 GLU A 48 -7.933 14.125 2.204 1.00 3.51 O ATOM 712 OE2 GLU A 48 -6.941 14.289 4.158 1.00 3.36 O ATOM 0 H GLU A 48 -6.713 12.196 -0.810 1.00 2.22 H new ATOM 0 HA GLU A 48 -4.363 13.268 0.147 1.00 2.10 H new ATOM 0 HB2 GLU A 48 -6.816 12.228 1.168 1.00 2.49 H new ATOM 0 HB3 GLU A 48 -5.534 11.459 2.081 1.00 2.49 H new ATOM 0 HG2 GLU A 48 -4.888 13.401 3.098 1.00 2.71 H new ATOM 0 HG3 GLU A 48 -5.224 14.387 1.689 1.00 2.71 H new ATOM 719 N SER A 49 -4.323 9.997 0.661 1.00 1.27 N ATOM 720 CA SER A 49 -3.440 8.841 0.815 1.00 0.84 C ATOM 721 C SER A 49 -3.015 8.227 -0.526 1.00 0.71 C ATOM 722 O SER A 49 -2.370 7.179 -0.545 1.00 0.78 O ATOM 723 CB SER A 49 -4.122 7.774 1.673 1.00 1.01 C ATOM 724 OG SER A 49 -5.114 7.082 0.934 1.00 1.59 O ATOM 0 H SER A 49 -5.309 9.798 0.833 1.00 1.27 H new ATOM 0 HA SER A 49 -2.535 9.201 1.305 1.00 0.84 H new ATOM 0 HB2 SER A 49 -3.378 7.067 2.039 1.00 1.01 H new ATOM 0 HB3 SER A 49 -4.575 8.241 2.547 1.00 1.01 H new ATOM 0 HG SER A 49 -5.534 6.404 1.504 1.00 1.59 H new ATOM 730 N GLU A 50 -3.350 8.873 -1.643 1.00 0.68 N ATOM 731 CA GLU A 50 -2.965 8.363 -2.952 1.00 0.67 C ATOM 732 C GLU A 50 -1.513 8.711 -3.218 1.00 0.57 C ATOM 733 O GLU A 50 -0.711 7.860 -3.602 1.00 0.63 O ATOM 734 CB GLU A 50 -3.849 8.960 -4.047 1.00 0.85 C ATOM 735 CG GLU A 50 -5.259 8.403 -4.060 1.00 1.47 C ATOM 736 CD GLU A 50 -5.533 7.537 -5.274 1.00 1.76 C ATOM 737 OE1 GLU A 50 -4.971 7.828 -6.350 1.00 2.28 O ATOM 738 OE2 GLU A 50 -6.310 6.567 -5.148 1.00 2.15 O ATOM 0 H GLU A 50 -3.883 9.743 -1.665 1.00 0.68 H new ATOM 0 HA GLU A 50 -3.093 7.281 -2.960 1.00 0.67 H new ATOM 0 HB2 GLU A 50 -3.896 10.041 -3.916 1.00 0.85 H new ATOM 0 HB3 GLU A 50 -3.386 8.776 -5.017 1.00 0.85 H new ATOM 0 HG2 GLU A 50 -5.422 7.817 -3.156 1.00 1.47 H new ATOM 0 HG3 GLU A 50 -5.972 9.228 -4.038 1.00 1.47 H new ATOM 745 N VAL A 92 -1.188 9.974 -2.989 1.00 0.58 N ATOM 746 CA VAL A 92 0.165 10.463 -3.176 1.00 0.57 C ATOM 747 C VAL A 92 1.162 9.563 -2.460 1.00 0.52 C ATOM 748 O VAL A 92 2.288 9.373 -2.917 1.00 0.60 O ATOM 749 CB VAL A 92 0.309 11.894 -2.636 1.00 0.65 C ATOM 750 CG1 VAL A 92 -0.036 11.946 -1.155 1.00 1.49 C ATOM 751 CG2 VAL A 92 1.712 12.411 -2.879 1.00 1.09 C ATOM 0 H VAL A 92 -1.850 10.682 -2.671 1.00 0.58 H new ATOM 0 HA VAL A 92 0.372 10.459 -4.246 1.00 0.57 H new ATOM 0 HB VAL A 92 -0.391 12.537 -3.169 1.00 0.65 H new ATOM 0 HG11 VAL A 92 0.072 12.968 -0.792 1.00 1.49 H new ATOM 0 HG12 VAL A 92 -1.065 11.616 -1.009 1.00 1.49 H new ATOM 0 HG13 VAL A 92 0.637 11.291 -0.601 1.00 1.49 H new ATOM 0 HG21 VAL A 92 1.798 13.426 -2.491 1.00 1.09 H new ATOM 0 HG22 VAL A 92 2.430 11.766 -2.372 1.00 1.09 H new ATOM 0 HG23 VAL A 92 1.919 12.413 -3.949 1.00 1.09 H new ATOM 761 N VAL A 93 0.733 9.014 -1.329 1.00 0.46 N ATOM 762 CA VAL A 93 1.573 8.134 -0.533 1.00 0.46 C ATOM 763 C VAL A 93 1.694 6.757 -1.176 1.00 0.48 C ATOM 764 O VAL A 93 2.783 6.186 -1.241 1.00 0.59 O ATOM 765 CB VAL A 93 1.011 7.984 0.892 1.00 0.48 C ATOM 766 CG1 VAL A 93 1.877 7.043 1.716 1.00 0.52 C ATOM 767 CG2 VAL A 93 0.900 9.346 1.559 1.00 0.55 C ATOM 0 H VAL A 93 -0.199 9.166 -0.943 1.00 0.46 H new ATOM 0 HA VAL A 93 2.563 8.587 -0.483 1.00 0.46 H new ATOM 0 HB VAL A 93 0.013 7.550 0.829 1.00 0.48 H new ATOM 0 HG11 VAL A 93 1.462 6.951 2.720 1.00 0.52 H new ATOM 0 HG12 VAL A 93 1.901 6.062 1.242 1.00 0.52 H new ATOM 0 HG13 VAL A 93 2.890 7.441 1.777 1.00 0.52 H new ATOM 0 HG21 VAL A 93 0.501 9.226 2.566 1.00 0.55 H new ATOM 0 HG22 VAL A 93 1.886 9.807 1.612 1.00 0.55 H new ATOM 0 HG23 VAL A 93 0.233 9.982 0.978 1.00 0.55 H new ATOM 777 N HIS A 94 0.572 6.229 -1.654 1.00 0.47 N ATOM 778 CA HIS A 94 0.560 4.921 -2.296 1.00 0.51 C ATOM 779 C HIS A 94 1.580 4.870 -3.427 1.00 0.57 C ATOM 780 O HIS A 94 2.508 4.061 -3.407 1.00 0.82 O ATOM 781 CB HIS A 94 -0.834 4.609 -2.843 1.00 0.56 C ATOM 782 CG HIS A 94 -1.791 4.109 -1.806 1.00 0.86 C ATOM 783 ND1 HIS A 94 -2.958 4.627 -1.356 1.00 0.88 N flip ATOM 784 CD2 HIS A 94 -1.596 2.939 -1.104 1.00 1.53 C flip ATOM 785 CE1 HIS A 94 -3.442 3.768 -0.401 1.00 1.28 C flip ATOM 786 NE2 HIS A 94 -2.603 2.758 -0.268 1.00 1.76 N flip ATOM 0 H HIS A 94 -0.339 6.686 -1.609 1.00 0.47 H new ATOM 0 HA HIS A 94 0.825 4.173 -1.549 1.00 0.51 H new ATOM 0 HB2 HIS A 94 -1.245 5.509 -3.300 1.00 0.56 H new ATOM 0 HB3 HIS A 94 -0.746 3.863 -3.633 1.00 0.56 H new ATOM 0 HD1 HIS A 94 -3.396 5.494 -1.668 1.00 0.88 H new ATOM 0 HD2 HIS A 94 -0.752 2.274 -1.219 1.00 1.53 H new ATOM 0 HE1 HIS A 94 -4.361 3.898 0.152 1.00 1.28 H new ATOM 794 N LEU A 95 1.397 5.740 -4.415 1.00 0.50 N ATOM 795 CA LEU A 95 2.297 5.798 -5.562 1.00 0.54 C ATOM 796 C LEU A 95 3.754 5.814 -5.112 1.00 0.53 C ATOM 797 O LEU A 95 4.632 5.291 -5.799 1.00 0.60 O ATOM 798 CB LEU A 95 2.001 7.036 -6.415 1.00 0.60 C ATOM 799 CG LEU A 95 0.517 7.332 -6.653 1.00 1.26 C ATOM 800 CD1 LEU A 95 0.333 8.145 -7.924 1.00 2.14 C ATOM 801 CD2 LEU A 95 -0.285 6.041 -6.725 1.00 2.01 C ATOM 0 H LEU A 95 0.633 6.415 -4.445 1.00 0.50 H new ATOM 0 HA LEU A 95 2.130 4.905 -6.164 1.00 0.54 H new ATOM 0 HB2 LEU A 95 2.454 7.903 -5.935 1.00 0.60 H new ATOM 0 HB3 LEU A 95 2.489 6.915 -7.382 1.00 0.60 H new ATOM 0 HG LEU A 95 0.147 7.918 -5.812 1.00 1.26 H new ATOM 0 HD11 LEU A 95 -0.727 8.346 -8.077 1.00 2.14 H new ATOM 0 HD12 LEU A 95 0.872 9.088 -7.834 1.00 2.14 H new ATOM 0 HD13 LEU A 95 0.723 7.585 -8.774 1.00 2.14 H new ATOM 0 HD21 LEU A 95 -1.336 6.275 -6.894 1.00 2.01 H new ATOM 0 HD22 LEU A 95 0.087 5.427 -7.545 1.00 2.01 H new ATOM 0 HD23 LEU A 95 -0.181 5.495 -5.787 1.00 2.01 H new ATOM 813 N THR A 96 4.006 6.419 -3.955 1.00 0.49 N ATOM 814 CA THR A 96 5.359 6.503 -3.418 1.00 0.51 C ATOM 815 C THR A 96 5.811 5.156 -2.861 1.00 0.48 C ATOM 816 O THR A 96 6.827 4.609 -3.286 1.00 0.59 O ATOM 817 CB THR A 96 5.433 7.571 -2.325 1.00 0.53 C ATOM 818 OG1 THR A 96 4.672 8.709 -2.684 1.00 0.94 O ATOM 819 CG2 THR A 96 6.844 8.036 -2.037 1.00 1.06 C ATOM 0 H THR A 96 3.292 6.857 -3.373 1.00 0.49 H new ATOM 0 HA THR A 96 6.028 6.781 -4.233 1.00 0.51 H new ATOM 0 HB THR A 96 5.034 7.095 -1.429 1.00 0.53 H new ATOM 0 HG1 THR A 96 3.720 8.525 -2.540 1.00 0.94 H new ATOM 0 HG21 THR A 96 6.825 8.793 -1.253 1.00 1.06 H new ATOM 0 HG22 THR A 96 7.446 7.189 -1.709 1.00 1.06 H new ATOM 0 HG23 THR A 96 7.279 8.462 -2.941 1.00 1.06 H new ATOM 827 N LEU A 97 5.051 4.627 -1.908 1.00 0.43 N ATOM 828 CA LEU A 97 5.378 3.344 -1.295 1.00 0.42 C ATOM 829 C LEU A 97 5.493 2.247 -2.349 1.00 0.44 C ATOM 830 O LEU A 97 6.545 1.626 -2.502 1.00 0.48 O ATOM 831 CB LEU A 97 4.315 2.965 -0.262 1.00 0.42 C ATOM 832 CG LEU A 97 4.806 2.065 0.873 1.00 0.37 C ATOM 833 CD1 LEU A 97 4.917 2.853 2.169 1.00 0.30 C ATOM 834 CD2 LEU A 97 3.876 0.874 1.050 1.00 0.52 C ATOM 0 H LEU A 97 4.205 5.066 -1.544 1.00 0.43 H new ATOM 0 HA LEU A 97 6.342 3.444 -0.797 1.00 0.42 H new ATOM 0 HB2 LEU A 97 3.908 3.879 0.170 1.00 0.42 H new ATOM 0 HB3 LEU A 97 3.495 2.462 -0.775 1.00 0.42 H new ATOM 0 HG LEU A 97 5.796 1.692 0.612 1.00 0.37 H new ATOM 0 HD11 LEU A 97 5.268 2.196 2.965 1.00 0.30 H new ATOM 0 HD12 LEU A 97 5.623 3.673 2.037 1.00 0.30 H new ATOM 0 HD13 LEU A 97 3.940 3.256 2.435 1.00 0.30 H new ATOM 0 HD21 LEU A 97 4.241 0.245 1.862 1.00 0.52 H new ATOM 0 HD22 LEU A 97 2.873 1.228 1.288 1.00 0.52 H new ATOM 0 HD23 LEU A 97 3.847 0.295 0.127 1.00 0.52 H new ATOM 846 N ARG A 98 4.403 2.012 -3.071 1.00 0.46 N ATOM 847 CA ARG A 98 4.380 0.987 -4.110 1.00 0.51 C ATOM 848 C ARG A 98 5.564 1.145 -5.059 1.00 0.55 C ATOM 849 O ARG A 98 6.361 0.222 -5.231 1.00 0.66 O ATOM 850 CB ARG A 98 3.068 1.050 -4.895 1.00 0.55 C ATOM 851 CG ARG A 98 3.246 0.889 -6.396 1.00 1.48 C ATOM 852 CD ARG A 98 1.920 0.619 -7.088 1.00 1.64 C ATOM 853 NE ARG A 98 1.374 1.820 -7.715 1.00 2.22 N ATOM 854 CZ ARG A 98 0.371 1.811 -8.591 1.00 2.62 C ATOM 855 NH1 ARG A 98 -0.201 0.668 -8.952 1.00 2.72 N ATOM 856 NH2 ARG A 98 -0.064 2.952 -9.110 1.00 3.36 N ATOM 0 H ARG A 98 3.524 2.517 -2.957 1.00 0.46 H new ATOM 0 HA ARG A 98 4.455 0.014 -3.624 1.00 0.51 H new ATOM 0 HB2 ARG A 98 2.400 0.270 -4.532 1.00 0.55 H new ATOM 0 HB3 ARG A 98 2.581 2.005 -4.696 1.00 0.55 H new ATOM 0 HG2 ARG A 98 3.696 1.792 -6.809 1.00 1.48 H new ATOM 0 HG3 ARG A 98 3.936 0.069 -6.596 1.00 1.48 H new ATOM 0 HD2 ARG A 98 2.057 -0.154 -7.844 1.00 1.64 H new ATOM 0 HD3 ARG A 98 1.205 0.232 -6.362 1.00 1.64 H new ATOM 0 HE ARG A 98 1.786 2.720 -7.467 1.00 2.22 H new ATOM 0 HH11 ARG A 98 0.127 -0.213 -8.558 1.00 2.72 H new ATOM 0 HH12 ARG A 98 -0.969 0.672 -9.624 1.00 2.72 H new ATOM 0 HH21 ARG A 98 0.370 3.834 -8.838 1.00 3.36 H new ATOM 0 HH22 ARG A 98 -0.832 2.947 -9.781 1.00 3.36 H new ATOM 870 N GLN A 99 5.673 2.318 -5.674 1.00 0.57 N ATOM 871 CA GLN A 99 6.759 2.594 -6.608 1.00 0.64 C ATOM 872 C GLN A 99 8.116 2.458 -5.924 1.00 0.54 C ATOM 873 O GLN A 99 8.937 1.626 -6.313 1.00 0.53 O ATOM 874 CB GLN A 99 6.610 3.998 -7.195 1.00 0.89 C ATOM 875 CG GLN A 99 7.575 4.288 -8.333 1.00 1.14 C ATOM 876 CD GLN A 99 7.674 5.768 -8.651 1.00 1.66 C ATOM 877 OE1 GLN A 99 7.833 6.597 -7.755 1.00 2.31 O ATOM 878 NE2 GLN A 99 7.579 6.106 -9.931 1.00 2.17 N ATOM 0 H GLN A 99 5.023 3.093 -5.543 1.00 0.57 H new ATOM 0 HA GLN A 99 6.705 1.862 -7.414 1.00 0.64 H new ATOM 0 HB2 GLN A 99 5.589 4.126 -7.554 1.00 0.89 H new ATOM 0 HB3 GLN A 99 6.764 4.732 -6.404 1.00 0.89 H new ATOM 0 HG2 GLN A 99 8.563 3.909 -8.072 1.00 1.14 H new ATOM 0 HG3 GLN A 99 7.253 3.749 -9.224 1.00 1.14 H new ATOM 0 HE21 GLN A 99 7.448 5.385 -10.640 1.00 2.17 H new ATOM 0 HE22 GLN A 99 7.638 7.087 -10.205 1.00 2.17 H new ATOM 887 N ALA A 100 8.346 3.283 -4.907 1.00 0.60 N ATOM 888 CA ALA A 100 9.604 3.260 -4.169 1.00 0.70 C ATOM 889 C ALA A 100 10.003 1.835 -3.802 1.00 0.67 C ATOM 890 O ALA A 100 11.065 1.358 -4.203 1.00 0.79 O ATOM 891 CB ALA A 100 9.499 4.117 -2.917 1.00 0.84 C ATOM 0 H ALA A 100 7.676 3.977 -4.575 1.00 0.60 H new ATOM 0 HA ALA A 100 10.379 3.671 -4.815 1.00 0.70 H new ATOM 0 HB1 ALA A 100 10.445 4.090 -2.377 1.00 0.84 H new ATOM 0 HB2 ALA A 100 9.271 5.145 -3.198 1.00 0.84 H new ATOM 0 HB3 ALA A 100 8.705 3.731 -2.277 1.00 0.84 H new ATOM 897 N GLY A 101 9.155 1.170 -3.020 1.00 0.62 N ATOM 898 CA GLY A 101 9.439 -0.188 -2.587 1.00 0.80 C ATOM 899 C GLY A 101 9.956 -1.075 -3.703 1.00 0.90 C ATOM 900 O GLY A 101 10.987 -1.730 -3.549 1.00 1.24 O ATOM 0 H GLY A 101 8.273 1.550 -2.677 1.00 0.62 H new ATOM 0 HA2 GLY A 101 10.175 -0.160 -1.783 1.00 0.80 H new ATOM 0 HA3 GLY A 101 8.532 -0.628 -2.173 1.00 0.80 H new ATOM 904 N ASP A 102 9.253 -1.100 -4.831 1.00 0.79 N ATOM 905 CA ASP A 102 9.671 -1.914 -5.960 1.00 0.94 C ATOM 906 C ASP A 102 11.010 -1.427 -6.494 1.00 0.87 C ATOM 907 O ASP A 102 11.784 -2.201 -7.057 1.00 0.93 O ATOM 908 CB ASP A 102 8.616 -1.871 -7.068 1.00 1.11 C ATOM 909 CG ASP A 102 9.143 -2.396 -8.389 1.00 1.52 C ATOM 910 OD1 ASP A 102 9.732 -3.498 -8.398 1.00 2.18 O ATOM 911 OD2 ASP A 102 8.967 -1.707 -9.416 1.00 1.94 O ATOM 0 H ASP A 102 8.396 -0.568 -4.984 1.00 0.79 H new ATOM 0 HA ASP A 102 9.781 -2.944 -5.622 1.00 0.94 H new ATOM 0 HB2 ASP A 102 7.751 -2.461 -6.765 1.00 1.11 H new ATOM 0 HB3 ASP A 102 8.272 -0.845 -7.199 1.00 1.11 H new ATOM 916 N ASP A 103 11.279 -0.138 -6.310 1.00 0.80 N ATOM 917 CA ASP A 103 12.525 0.445 -6.771 1.00 0.84 C ATOM 918 C ASP A 103 13.701 -0.088 -5.959 1.00 0.82 C ATOM 919 O ASP A 103 14.750 -0.423 -6.509 1.00 0.93 O ATOM 920 CB ASP A 103 12.471 1.971 -6.677 1.00 0.89 C ATOM 921 CG ASP A 103 13.507 2.642 -7.558 1.00 1.21 C ATOM 922 OD1 ASP A 103 13.547 2.333 -8.768 1.00 1.65 O ATOM 923 OD2 ASP A 103 14.278 3.476 -7.038 1.00 1.89 O ATOM 0 H ASP A 103 10.650 0.517 -5.846 1.00 0.80 H new ATOM 0 HA ASP A 103 12.666 0.163 -7.814 1.00 0.84 H new ATOM 0 HB2 ASP A 103 11.477 2.315 -6.963 1.00 0.89 H new ATOM 0 HB3 ASP A 103 12.627 2.274 -5.642 1.00 0.89 H new ATOM 928 N PHE A 104 13.513 -0.167 -4.645 1.00 0.76 N ATOM 929 CA PHE A 104 14.551 -0.664 -3.750 1.00 0.82 C ATOM 930 C PHE A 104 14.923 -2.099 -4.108 1.00 0.90 C ATOM 931 O PHE A 104 16.066 -2.384 -4.466 1.00 1.10 O ATOM 932 CB PHE A 104 14.070 -0.589 -2.299 1.00 0.90 C ATOM 933 CG PHE A 104 15.046 -1.148 -1.302 1.00 0.72 C ATOM 934 CD1 PHE A 104 15.195 -2.518 -1.151 1.00 1.30 C ATOM 935 CD2 PHE A 104 15.808 -0.304 -0.512 1.00 1.10 C ATOM 936 CE1 PHE A 104 16.087 -3.034 -0.231 1.00 1.41 C ATOM 937 CE2 PHE A 104 16.702 -0.814 0.410 1.00 1.14 C ATOM 938 CZ PHE A 104 16.842 -2.181 0.551 1.00 0.94 C ATOM 0 H PHE A 104 12.650 0.108 -4.176 1.00 0.76 H new ATOM 0 HA PHE A 104 15.437 -0.040 -3.863 1.00 0.82 H new ATOM 0 HB2 PHE A 104 13.866 0.452 -2.048 1.00 0.90 H new ATOM 0 HB3 PHE A 104 13.127 -1.129 -2.211 1.00 0.90 H new ATOM 0 HD1 PHE A 104 14.607 -3.189 -1.759 1.00 1.30 H new ATOM 0 HD2 PHE A 104 15.702 0.766 -0.618 1.00 1.10 H new ATOM 0 HE1 PHE A 104 16.194 -4.103 -0.123 1.00 1.41 H new ATOM 0 HE2 PHE A 104 17.291 -0.145 1.020 1.00 1.14 H new ATOM 0 HZ PHE A 104 17.540 -2.582 1.271 1.00 0.94 H new ATOM 948 N SER A 105 13.948 -2.997 -4.008 1.00 0.92 N ATOM 949 CA SER A 105 14.168 -4.405 -4.321 1.00 1.05 C ATOM 950 C SER A 105 14.896 -4.556 -5.652 1.00 1.03 C ATOM 951 O SER A 105 15.775 -5.405 -5.798 1.00 1.11 O ATOM 952 CB SER A 105 12.835 -5.154 -4.367 1.00 1.13 C ATOM 953 OG SER A 105 12.685 -5.855 -5.589 1.00 1.55 O ATOM 0 H SER A 105 12.997 -2.775 -3.713 1.00 0.92 H new ATOM 0 HA SER A 105 14.790 -4.834 -3.535 1.00 1.05 H new ATOM 0 HB2 SER A 105 12.779 -5.854 -3.533 1.00 1.13 H new ATOM 0 HB3 SER A 105 12.013 -4.448 -4.246 1.00 1.13 H new ATOM 0 HG SER A 105 11.826 -6.327 -5.592 1.00 1.55 H new ATOM 959 N ARG A 106 14.528 -3.722 -6.620 1.00 0.99 N ATOM 960 CA ARG A 106 15.152 -3.759 -7.937 1.00 1.02 C ATOM 961 C ARG A 106 16.655 -3.530 -7.824 1.00 1.05 C ATOM 962 O ARG A 106 17.440 -4.100 -8.582 1.00 1.10 O ATOM 963 CB ARG A 106 14.529 -2.701 -8.850 1.00 1.04 C ATOM 964 CG ARG A 106 15.480 -2.179 -9.914 1.00 1.29 C ATOM 965 CD ARG A 106 14.726 -1.607 -11.103 1.00 1.63 C ATOM 966 NE ARG A 106 15.144 -0.241 -11.411 1.00 2.15 N ATOM 967 CZ ARG A 106 14.911 0.363 -12.575 1.00 2.57 C ATOM 968 NH1 ARG A 106 14.266 -0.271 -13.548 1.00 2.68 N ATOM 969 NH2 ARG A 106 15.325 1.608 -12.767 1.00 3.43 N ATOM 0 H ARG A 106 13.802 -3.013 -6.517 1.00 0.99 H new ATOM 0 HA ARG A 106 14.981 -4.745 -8.370 1.00 1.02 H new ATOM 0 HB2 ARG A 106 13.650 -3.125 -9.336 1.00 1.04 H new ATOM 0 HB3 ARG A 106 14.184 -1.865 -8.241 1.00 1.04 H new ATOM 0 HG2 ARG A 106 16.121 -1.410 -9.484 1.00 1.29 H new ATOM 0 HG3 ARG A 106 16.131 -2.986 -10.249 1.00 1.29 H new ATOM 0 HD2 ARG A 106 14.889 -2.241 -11.975 1.00 1.63 H new ATOM 0 HD3 ARG A 106 13.656 -1.620 -10.894 1.00 1.63 H new ATOM 0 HE ARG A 106 15.644 0.281 -10.692 1.00 2.15 H new ATOM 0 HH11 ARG A 106 13.944 -1.229 -13.407 1.00 2.68 H new ATOM 0 HH12 ARG A 106 14.092 0.200 -14.436 1.00 2.68 H new ATOM 0 HH21 ARG A 106 15.821 2.101 -12.024 1.00 3.43 H new ATOM 0 HH22 ARG A 106 15.148 2.073 -13.658 1.00 3.43 H new ATOM 983 N ARG A 107 17.046 -2.695 -6.867 1.00 1.05 N ATOM 984 CA ARG A 107 18.454 -2.389 -6.644 1.00 1.13 C ATOM 985 C ARG A 107 19.173 -3.539 -5.933 1.00 1.18 C ATOM 986 O ARG A 107 20.403 -3.594 -5.922 1.00 1.28 O ATOM 987 CB ARG A 107 18.592 -1.107 -5.822 1.00 1.10 C ATOM 988 CG ARG A 107 19.912 -1.003 -5.075 1.00 1.55 C ATOM 989 CD ARG A 107 20.159 0.410 -4.573 1.00 2.03 C ATOM 990 NE ARG A 107 21.562 0.633 -4.234 1.00 2.59 N ATOM 991 CZ ARG A 107 21.999 1.666 -3.515 1.00 2.85 C ATOM 992 NH1 ARG A 107 21.148 2.576 -3.056 1.00 2.76 N ATOM 993 NH2 ARG A 107 23.293 1.788 -3.254 1.00 3.73 N ATOM 0 H ARG A 107 16.406 -2.217 -6.232 1.00 1.05 H new ATOM 0 HA ARG A 107 18.920 -2.248 -7.619 1.00 1.13 H new ATOM 0 HB2 ARG A 107 18.490 -0.248 -6.485 1.00 1.10 H new ATOM 0 HB3 ARG A 107 17.773 -1.055 -5.105 1.00 1.10 H new ATOM 0 HG2 ARG A 107 19.910 -1.694 -4.232 1.00 1.55 H new ATOM 0 HG3 ARG A 107 20.728 -1.304 -5.732 1.00 1.55 H new ATOM 0 HD2 ARG A 107 19.853 1.125 -5.337 1.00 2.03 H new ATOM 0 HD3 ARG A 107 19.540 0.596 -3.695 1.00 2.03 H new ATOM 0 HE ARG A 107 22.249 -0.043 -4.568 1.00 2.59 H new ATOM 0 HH11 ARG A 107 20.151 2.487 -3.253 1.00 2.76 H new ATOM 0 HH12 ARG A 107 21.491 3.364 -2.506 1.00 2.76 H new ATOM 0 HH21 ARG A 107 23.952 1.092 -3.603 1.00 3.73 H new ATOM 0 HH22 ARG A 107 23.630 2.578 -2.704 1.00 3.73 H new ATOM 1007 N TYR A 108 18.408 -4.457 -5.342 1.00 1.15 N ATOM 1008 CA TYR A 108 18.990 -5.594 -4.639 1.00 1.24 C ATOM 1009 C TYR A 108 18.640 -6.904 -5.339 1.00 1.11 C ATOM 1010 O TYR A 108 17.558 -7.455 -5.139 1.00 1.65 O ATOM 1011 CB TYR A 108 18.501 -5.630 -3.190 1.00 1.47 C ATOM 1012 CG TYR A 108 19.048 -4.506 -2.340 1.00 1.71 C ATOM 1013 CD1 TYR A 108 18.453 -3.251 -2.349 1.00 1.96 C ATOM 1014 CD2 TYR A 108 20.161 -4.700 -1.531 1.00 2.34 C ATOM 1015 CE1 TYR A 108 18.952 -2.220 -1.575 1.00 2.22 C ATOM 1016 CE2 TYR A 108 20.664 -3.674 -0.753 1.00 2.65 C ATOM 1017 CZ TYR A 108 20.056 -2.437 -0.779 1.00 2.35 C ATOM 1018 OH TYR A 108 20.555 -1.413 -0.007 1.00 2.72 O ATOM 0 H TYR A 108 17.388 -4.434 -5.337 1.00 1.15 H new ATOM 0 HA TYR A 108 20.074 -5.477 -4.646 1.00 1.24 H new ATOM 0 HB2 TYR A 108 17.412 -5.584 -3.181 1.00 1.47 H new ATOM 0 HB3 TYR A 108 18.784 -6.583 -2.743 1.00 1.47 H new ATOM 0 HD1 TYR A 108 17.587 -3.078 -2.970 1.00 1.96 H new ATOM 0 HD2 TYR A 108 20.641 -5.667 -1.510 1.00 2.34 H new ATOM 0 HE1 TYR A 108 18.479 -1.249 -1.594 1.00 2.22 H new ATOM 0 HE2 TYR A 108 21.529 -3.841 -0.128 1.00 2.65 H new ATOM 0 HH TYR A 108 21.334 -1.732 0.495 1.00 2.72 H new ATOM 1028 N ARG A 109 19.563 -7.395 -6.159 1.00 1.41 N ATOM 1029 CA ARG A 109 19.352 -8.640 -6.889 1.00 1.46 C ATOM 1030 C ARG A 109 19.480 -9.843 -5.961 1.00 1.44 C ATOM 1031 O ARG A 109 18.679 -10.776 -6.023 1.00 2.06 O ATOM 1032 CB ARG A 109 20.355 -8.758 -8.037 1.00 1.56 C ATOM 1033 CG ARG A 109 19.703 -8.923 -9.400 1.00 1.96 C ATOM 1034 CD ARG A 109 19.325 -7.579 -10.002 1.00 2.36 C ATOM 1035 NE ARG A 109 20.157 -7.241 -11.154 1.00 2.86 N ATOM 1036 CZ ARG A 109 19.979 -7.745 -12.374 1.00 3.59 C ATOM 1037 NH1 ARG A 109 19.001 -8.612 -12.610 1.00 3.91 N ATOM 1038 NH2 ARG A 109 20.784 -7.381 -13.363 1.00 4.41 N ATOM 0 H ARG A 109 20.464 -6.950 -6.335 1.00 1.41 H new ATOM 0 HA ARG A 109 18.342 -8.626 -7.298 1.00 1.46 H new ATOM 0 HB2 ARG A 109 20.985 -7.869 -8.050 1.00 1.56 H new ATOM 0 HB3 ARG A 109 21.009 -9.610 -7.851 1.00 1.56 H new ATOM 0 HG2 ARG A 109 20.386 -9.444 -10.071 1.00 1.96 H new ATOM 0 HG3 ARG A 109 18.812 -9.544 -9.306 1.00 1.96 H new ATOM 0 HD2 ARG A 109 18.278 -7.599 -10.305 1.00 2.36 H new ATOM 0 HD3 ARG A 109 19.423 -6.802 -9.244 1.00 2.36 H new ATOM 0 HE ARG A 109 20.921 -6.579 -11.016 1.00 2.86 H new ATOM 0 HH11 ARG A 109 18.379 -8.897 -11.854 1.00 3.91 H new ATOM 0 HH12 ARG A 109 18.872 -8.993 -13.547 1.00 3.91 H new ATOM 0 HH21 ARG A 109 21.538 -6.716 -13.189 1.00 4.41 H new ATOM 0 HH22 ARG A 109 20.649 -7.766 -14.298 1.00 4.41 H new ATOM 1052 N ARG A 110 20.493 -9.816 -5.101 1.00 1.24 N ATOM 1053 CA ARG A 110 20.726 -10.906 -4.159 1.00 1.39 C ATOM 1054 C ARG A 110 20.700 -10.398 -2.721 1.00 1.32 C ATOM 1055 O ARG A 110 21.686 -9.851 -2.228 1.00 1.98 O ATOM 1056 CB ARG A 110 22.068 -11.579 -4.450 1.00 1.68 C ATOM 1057 CG ARG A 110 22.878 -10.883 -5.531 1.00 2.10 C ATOM 1058 CD ARG A 110 24.288 -11.444 -5.620 1.00 2.68 C ATOM 1059 NE ARG A 110 24.623 -11.869 -6.977 1.00 3.25 N ATOM 1060 CZ ARG A 110 25.868 -12.060 -7.410 1.00 3.84 C ATOM 1061 NH1 ARG A 110 26.902 -11.865 -6.600 1.00 4.02 N ATOM 1062 NH2 ARG A 110 26.080 -12.448 -8.661 1.00 4.68 N ATOM 0 H ARG A 110 21.166 -9.052 -5.037 1.00 1.24 H new ATOM 0 HA ARG A 110 19.926 -11.636 -4.281 1.00 1.39 H new ATOM 0 HB2 ARG A 110 22.655 -11.611 -3.532 1.00 1.68 H new ATOM 0 HB3 ARG A 110 21.889 -12.611 -4.750 1.00 1.68 H new ATOM 0 HG2 ARG A 110 22.378 -10.999 -6.493 1.00 2.10 H new ATOM 0 HG3 ARG A 110 22.923 -9.814 -5.322 1.00 2.10 H new ATOM 0 HD2 ARG A 110 25.001 -10.688 -5.291 1.00 2.68 H new ATOM 0 HD3 ARG A 110 24.385 -12.291 -4.941 1.00 2.68 H new ATOM 0 HE ARG A 110 23.858 -12.029 -7.632 1.00 3.25 H new ATOM 0 HH11 ARG A 110 26.746 -11.566 -5.637 1.00 4.02 H new ATOM 0 HH12 ARG A 110 27.852 -12.014 -6.941 1.00 4.02 H new ATOM 0 HH21 ARG A 110 25.290 -12.599 -9.289 1.00 4.68 H new ATOM 0 HH22 ARG A 110 27.033 -12.595 -8.995 1.00 4.68 H new ATOM 1076 N ASP A 111 19.565 -10.584 -2.054 1.00 1.26 N ATOM 1077 CA ASP A 111 19.411 -10.146 -0.672 1.00 1.18 C ATOM 1078 C ASP A 111 18.088 -10.632 -0.090 1.00 1.00 C ATOM 1079 O ASP A 111 18.051 -11.214 0.994 1.00 1.81 O ATOM 1080 CB ASP A 111 19.489 -8.620 -0.586 1.00 1.49 C ATOM 1081 CG ASP A 111 20.393 -8.150 0.537 1.00 1.95 C ATOM 1082 OD1 ASP A 111 21.594 -8.490 0.514 1.00 2.32 O ATOM 1083 OD2 ASP A 111 19.899 -7.441 1.439 1.00 2.62 O ATOM 0 H ASP A 111 18.739 -11.035 -2.448 1.00 1.26 H new ATOM 0 HA ASP A 111 20.224 -10.578 -0.089 1.00 1.18 H new ATOM 0 HB2 ASP A 111 19.855 -8.224 -1.533 1.00 1.49 H new ATOM 0 HB3 ASP A 111 18.488 -8.216 -0.436 1.00 1.49 H new ATOM 1088 N PHE A 112 17.003 -10.390 -0.818 1.00 0.83 N ATOM 1089 CA PHE A 112 15.677 -10.803 -0.374 1.00 0.54 C ATOM 1090 C PHE A 112 15.219 -12.056 -1.115 1.00 0.52 C ATOM 1091 O PHE A 112 14.476 -12.873 -0.572 1.00 0.57 O ATOM 1092 CB PHE A 112 14.669 -9.672 -0.588 1.00 0.66 C ATOM 1093 CG PHE A 112 14.575 -8.726 0.574 1.00 0.36 C ATOM 1094 CD1 PHE A 112 15.667 -7.959 0.950 1.00 1.17 C ATOM 1095 CD2 PHE A 112 13.396 -8.604 1.292 1.00 1.16 C ATOM 1096 CE1 PHE A 112 15.584 -7.088 2.019 1.00 1.24 C ATOM 1097 CE2 PHE A 112 13.308 -7.734 2.363 1.00 1.21 C ATOM 1098 CZ PHE A 112 14.403 -6.975 2.726 1.00 0.64 C ATOM 0 H PHE A 112 17.016 -9.910 -1.718 1.00 0.83 H new ATOM 0 HA PHE A 112 15.734 -11.033 0.690 1.00 0.54 H new ATOM 0 HB2 PHE A 112 14.947 -9.112 -1.481 1.00 0.66 H new ATOM 0 HB3 PHE A 112 13.686 -10.103 -0.776 1.00 0.66 H new ATOM 0 HD1 PHE A 112 16.593 -8.043 0.401 1.00 1.17 H new ATOM 0 HD2 PHE A 112 12.537 -9.195 1.012 1.00 1.16 H new ATOM 0 HE1 PHE A 112 16.442 -6.496 2.302 1.00 1.24 H new ATOM 0 HE2 PHE A 112 12.384 -7.648 2.915 1.00 1.21 H new ATOM 0 HZ PHE A 112 14.336 -6.294 3.562 1.00 0.64 H new ATOM 1108 N ALA A 113 15.669 -12.202 -2.357 1.00 0.56 N ATOM 1109 CA ALA A 113 15.308 -13.357 -3.169 1.00 0.65 C ATOM 1110 C ALA A 113 16.196 -14.551 -2.842 1.00 0.69 C ATOM 1111 O ALA A 113 15.705 -15.634 -2.523 1.00 0.74 O ATOM 1112 CB ALA A 113 15.403 -13.013 -4.648 1.00 0.75 C ATOM 0 H ALA A 113 16.284 -11.535 -2.822 1.00 0.56 H new ATOM 0 HA ALA A 113 14.278 -13.628 -2.938 1.00 0.65 H new ATOM 0 HB1 ALA A 113 15.131 -13.885 -5.243 1.00 0.75 H new ATOM 0 HB2 ALA A 113 14.723 -12.192 -4.875 1.00 0.75 H new ATOM 0 HB3 ALA A 113 16.424 -12.715 -4.887 1.00 0.75 H new ATOM 1118 N GLU A 114 17.507 -14.347 -2.923 1.00 0.75 N ATOM 1119 CA GLU A 114 18.465 -15.407 -2.633 1.00 0.89 C ATOM 1120 C GLU A 114 18.163 -16.060 -1.288 1.00 0.84 C ATOM 1121 O GLU A 114 18.410 -17.250 -1.095 1.00 0.93 O ATOM 1122 CB GLU A 114 19.890 -14.850 -2.635 1.00 1.02 C ATOM 1123 CG GLU A 114 20.947 -15.883 -2.282 1.00 1.51 C ATOM 1124 CD GLU A 114 22.307 -15.262 -2.030 1.00 1.83 C ATOM 1125 OE1 GLU A 114 22.814 -14.557 -2.928 1.00 2.23 O ATOM 1126 OE2 GLU A 114 22.865 -15.480 -0.934 1.00 2.54 O ATOM 0 H GLU A 114 17.930 -13.457 -3.187 1.00 0.75 H new ATOM 0 HA GLU A 114 18.378 -16.165 -3.412 1.00 0.89 H new ATOM 0 HB2 GLU A 114 20.110 -14.440 -3.621 1.00 1.02 H new ATOM 0 HB3 GLU A 114 19.950 -14.024 -1.926 1.00 1.02 H new ATOM 0 HG2 GLU A 114 20.632 -16.431 -1.394 1.00 1.51 H new ATOM 0 HG3 GLU A 114 21.027 -16.607 -3.092 1.00 1.51 H new ATOM 1133 N MET A 115 17.627 -15.272 -0.361 1.00 0.74 N ATOM 1134 CA MET A 115 17.290 -15.774 0.967 1.00 0.74 C ATOM 1135 C MET A 115 15.978 -16.551 0.937 1.00 0.69 C ATOM 1136 O MET A 115 15.796 -17.509 1.688 1.00 0.73 O ATOM 1137 CB MET A 115 17.188 -14.616 1.962 1.00 0.79 C ATOM 1138 CG MET A 115 16.646 -15.028 3.321 1.00 0.67 C ATOM 1139 SD MET A 115 16.990 -13.808 4.604 1.00 1.04 S ATOM 1140 CE MET A 115 16.007 -12.426 4.030 1.00 0.84 C ATOM 0 H MET A 115 17.417 -14.284 -0.505 1.00 0.74 H new ATOM 0 HA MET A 115 18.084 -16.449 1.286 1.00 0.74 H new ATOM 0 HB2 MET A 115 18.175 -14.172 2.093 1.00 0.79 H new ATOM 0 HB3 MET A 115 16.544 -13.843 1.542 1.00 0.79 H new ATOM 0 HG2 MET A 115 15.569 -15.179 3.248 1.00 0.67 H new ATOM 0 HG3 MET A 115 17.083 -15.984 3.608 1.00 0.67 H new ATOM 0 HE1 MET A 115 16.059 -11.616 4.757 1.00 0.84 H new ATOM 0 HE2 MET A 115 16.392 -12.079 3.071 1.00 0.84 H new ATOM 0 HE3 MET A 115 14.970 -12.741 3.912 1.00 0.84 H new ATOM 1150 N SER A 116 15.068 -16.132 0.064 1.00 0.69 N ATOM 1151 CA SER A 116 13.773 -16.790 -0.064 1.00 0.75 C ATOM 1152 C SER A 116 13.940 -18.301 -0.184 1.00 0.80 C ATOM 1153 O SER A 116 13.088 -19.067 0.264 1.00 0.86 O ATOM 1154 CB SER A 116 13.022 -16.250 -1.283 1.00 0.88 C ATOM 1155 OG SER A 116 11.783 -16.916 -1.455 1.00 1.64 O ATOM 0 H SER A 116 15.203 -15.340 -0.565 1.00 0.69 H new ATOM 0 HA SER A 116 13.195 -16.577 0.835 1.00 0.75 H new ATOM 0 HB2 SER A 116 12.850 -15.180 -1.164 1.00 0.88 H new ATOM 0 HB3 SER A 116 13.634 -16.377 -2.176 1.00 0.88 H new ATOM 0 HG SER A 116 11.933 -17.778 -1.897 1.00 1.64 H new ATOM 1161 N SER A 117 15.045 -18.722 -0.791 1.00 0.86 N ATOM 1162 CA SER A 117 15.325 -20.142 -0.968 1.00 1.02 C ATOM 1163 C SER A 117 15.131 -20.902 0.340 1.00 1.00 C ATOM 1164 O SER A 117 14.741 -22.070 0.339 1.00 1.31 O ATOM 1165 CB SER A 117 16.753 -20.342 -1.480 1.00 1.19 C ATOM 1166 OG SER A 117 16.931 -21.649 -1.999 1.00 2.15 O ATOM 0 H SER A 117 15.760 -18.100 -1.168 1.00 0.86 H new ATOM 0 HA SER A 117 14.624 -20.536 -1.704 1.00 1.02 H new ATOM 0 HB2 SER A 117 16.971 -19.607 -2.255 1.00 1.19 H new ATOM 0 HB3 SER A 117 17.461 -20.170 -0.669 1.00 1.19 H new ATOM 0 HG SER A 117 17.851 -21.751 -2.321 1.00 2.15 H new ATOM 1172 N GLN A 118 15.405 -20.231 1.454 1.00 0.95 N ATOM 1173 CA GLN A 118 15.260 -20.843 2.770 1.00 0.98 C ATOM 1174 C GLN A 118 13.859 -20.608 3.326 1.00 1.06 C ATOM 1175 O GLN A 118 13.696 -20.039 4.405 1.00 1.76 O ATOM 1176 CB GLN A 118 16.305 -20.281 3.735 1.00 1.10 C ATOM 1177 CG GLN A 118 17.656 -20.973 3.638 1.00 1.41 C ATOM 1178 CD GLN A 118 18.044 -21.676 4.923 1.00 1.89 C ATOM 1179 OE1 GLN A 118 17.516 -22.741 5.246 1.00 2.62 O ATOM 1180 NE2 GLN A 118 18.971 -21.083 5.666 1.00 2.32 N ATOM 0 H GLN A 118 15.729 -19.264 1.472 1.00 0.95 H new ATOM 0 HA GLN A 118 15.415 -21.917 2.664 1.00 0.98 H new ATOM 0 HB2 GLN A 118 16.436 -19.217 3.537 1.00 1.10 H new ATOM 0 HB3 GLN A 118 15.932 -20.372 4.755 1.00 1.10 H new ATOM 0 HG2 GLN A 118 17.631 -21.698 2.825 1.00 1.41 H new ATOM 0 HG3 GLN A 118 18.420 -20.237 3.386 1.00 1.41 H new ATOM 0 HE21 GLN A 118 19.382 -20.201 5.360 1.00 2.32 H new ATOM 0 HE22 GLN A 118 19.272 -21.510 6.542 1.00 2.32 H new ATOM 1189 N LEU A 119 12.851 -21.051 2.582 1.00 0.83 N ATOM 1190 CA LEU A 119 11.463 -20.890 3.001 1.00 0.90 C ATOM 1191 C LEU A 119 10.606 -22.047 2.498 1.00 1.10 C ATOM 1192 O LEU A 119 9.977 -21.954 1.444 1.00 1.81 O ATOM 1193 CB LEU A 119 10.904 -19.563 2.485 1.00 1.04 C ATOM 1194 CG LEU A 119 9.909 -18.873 3.419 1.00 0.93 C ATOM 1195 CD1 LEU A 119 10.292 -17.416 3.626 1.00 1.53 C ATOM 1196 CD2 LEU A 119 8.496 -18.981 2.864 1.00 1.16 C ATOM 0 H LEU A 119 12.969 -21.524 1.686 1.00 0.83 H new ATOM 0 HA LEU A 119 11.435 -20.888 4.091 1.00 0.90 H new ATOM 0 HB2 LEU A 119 11.736 -18.884 2.299 1.00 1.04 H new ATOM 0 HB3 LEU A 119 10.417 -19.740 1.526 1.00 1.04 H new ATOM 0 HG LEU A 119 9.939 -19.375 4.386 1.00 0.93 H new ATOM 0 HD11 LEU A 119 9.572 -16.942 4.293 1.00 1.53 H new ATOM 0 HD12 LEU A 119 11.287 -17.361 4.067 1.00 1.53 H new ATOM 0 HD13 LEU A 119 10.291 -16.900 2.666 1.00 1.53 H new ATOM 0 HD21 LEU A 119 7.800 -18.485 3.541 1.00 1.16 H new ATOM 0 HD22 LEU A 119 8.452 -18.504 1.885 1.00 1.16 H new ATOM 0 HD23 LEU A 119 8.222 -20.032 2.768 1.00 1.16 H new ATOM 1208 N HIS A 120 10.585 -23.136 3.260 1.00 1.32 N ATOM 1209 CA HIS A 120 9.804 -24.311 2.892 1.00 1.60 C ATOM 1210 C HIS A 120 8.364 -23.929 2.566 1.00 1.55 C ATOM 1211 O HIS A 120 7.754 -23.119 3.262 1.00 2.28 O ATOM 1212 CB HIS A 120 9.827 -25.339 4.024 1.00 2.02 C ATOM 1213 CG HIS A 120 10.830 -26.432 3.820 1.00 2.47 C ATOM 1214 ND1 HIS A 120 12.027 -26.493 4.503 1.00 3.13 N ATOM 1215 CD2 HIS A 120 10.810 -27.513 3.004 1.00 2.96 C ATOM 1216 CE1 HIS A 120 12.699 -27.562 4.115 1.00 3.66 C ATOM 1217 NE2 HIS A 120 11.982 -28.198 3.207 1.00 3.55 N ATOM 0 H HIS A 120 11.100 -23.229 4.136 1.00 1.32 H new ATOM 0 HA HIS A 120 10.254 -24.750 2.002 1.00 1.60 H new ATOM 0 HB2 HIS A 120 10.044 -24.829 4.963 1.00 2.02 H new ATOM 0 HB3 HIS A 120 8.835 -25.781 4.123 1.00 2.02 H new ATOM 0 HD2 HIS A 120 10.019 -27.785 2.321 1.00 2.96 H new ATOM 0 HE1 HIS A 120 13.670 -27.864 4.479 1.00 3.66 H new ATOM 0 HE2 HIS A 120 12.255 -29.059 2.733 1.00 3.55 H new ATOM 1225 N LEU A 121 7.827 -24.519 1.502 1.00 1.22 N ATOM 1226 CA LEU A 121 6.458 -24.241 1.084 1.00 1.17 C ATOM 1227 C LEU A 121 5.513 -25.346 1.546 1.00 1.21 C ATOM 1228 O LEU A 121 5.451 -26.416 0.941 1.00 1.63 O ATOM 1229 CB LEU A 121 6.386 -24.096 -0.438 1.00 1.37 C ATOM 1230 CG LEU A 121 5.404 -23.039 -0.942 1.00 1.38 C ATOM 1231 CD1 LEU A 121 4.098 -23.109 -0.165 1.00 2.12 C ATOM 1232 CD2 LEU A 121 6.016 -21.650 -0.835 1.00 1.57 C ATOM 0 H LEU A 121 8.319 -25.192 0.914 1.00 1.22 H new ATOM 0 HA LEU A 121 6.147 -23.304 1.546 1.00 1.17 H new ATOM 0 HB2 LEU A 121 7.381 -23.853 -0.812 1.00 1.37 H new ATOM 0 HB3 LEU A 121 6.111 -25.060 -0.867 1.00 1.37 H new ATOM 0 HG LEU A 121 5.189 -23.241 -1.991 1.00 1.38 H new ATOM 0 HD11 LEU A 121 3.412 -22.349 -0.538 1.00 2.12 H new ATOM 0 HD12 LEU A 121 3.651 -24.095 -0.292 1.00 2.12 H new ATOM 0 HD13 LEU A 121 4.294 -22.933 0.893 1.00 2.12 H new ATOM 0 HD21 LEU A 121 5.303 -20.909 -1.198 1.00 1.57 H new ATOM 0 HD22 LEU A 121 6.260 -21.439 0.206 1.00 1.57 H new ATOM 0 HD23 LEU A 121 6.924 -21.605 -1.436 1.00 1.57 H new ATOM 1244 N THR A 122 4.780 -25.078 2.622 1.00 1.09 N ATOM 1245 CA THR A 122 3.839 -26.050 3.166 1.00 1.12 C ATOM 1246 C THR A 122 2.845 -25.375 4.106 1.00 1.04 C ATOM 1247 O THR A 122 3.152 -24.356 4.724 1.00 0.97 O ATOM 1248 CB THR A 122 4.588 -27.158 3.907 1.00 1.21 C ATOM 1249 OG1 THR A 122 3.889 -27.539 5.079 1.00 1.36 O ATOM 1250 CG2 THR A 122 5.990 -26.762 4.316 1.00 1.53 C ATOM 0 H THR A 122 4.820 -24.197 3.134 1.00 1.09 H new ATOM 0 HA THR A 122 3.287 -26.489 2.335 1.00 1.12 H new ATOM 0 HB THR A 122 4.653 -27.985 3.200 1.00 1.21 H new ATOM 0 HG1 THR A 122 4.383 -28.250 5.538 1.00 1.36 H new ATOM 0 HG21 THR A 122 6.465 -27.593 4.837 1.00 1.53 H new ATOM 0 HG22 THR A 122 6.571 -26.510 3.428 1.00 1.53 H new ATOM 0 HG23 THR A 122 5.945 -25.897 4.978 1.00 1.53 H new ATOM 1258 N PRO A 123 1.636 -25.943 4.225 1.00 1.20 N ATOM 1259 CA PRO A 123 0.587 -25.400 5.093 1.00 1.28 C ATOM 1260 C PRO A 123 0.911 -25.573 6.573 1.00 1.27 C ATOM 1261 O PRO A 123 0.193 -26.260 7.300 1.00 1.92 O ATOM 1262 CB PRO A 123 -0.647 -26.223 4.715 1.00 1.58 C ATOM 1263 CG PRO A 123 -0.100 -27.506 4.192 1.00 1.62 C ATOM 1264 CD PRO A 123 1.199 -27.160 3.519 1.00 1.44 C ATOM 0 HA PRO A 123 0.459 -24.326 4.955 1.00 1.28 H new ATOM 0 HB2 PRO A 123 -1.291 -26.390 5.578 1.00 1.58 H new ATOM 0 HB3 PRO A 123 -1.248 -25.713 3.962 1.00 1.58 H new ATOM 0 HG2 PRO A 123 0.057 -28.221 5.000 1.00 1.62 H new ATOM 0 HG3 PRO A 123 -0.793 -27.967 3.488 1.00 1.62 H new ATOM 0 HD2 PRO A 123 1.928 -27.964 3.616 1.00 1.44 H new ATOM 0 HD3 PRO A 123 1.063 -26.979 2.453 1.00 1.44 H new ATOM 1272 N PHE A 124 1.996 -24.945 7.013 1.00 1.36 N ATOM 1273 CA PHE A 124 2.416 -25.028 8.407 1.00 1.44 C ATOM 1274 C PHE A 124 3.654 -24.172 8.653 1.00 1.29 C ATOM 1275 O PHE A 124 4.481 -23.988 7.760 1.00 2.03 O ATOM 1276 CB PHE A 124 2.703 -26.481 8.792 1.00 1.70 C ATOM 1277 CG PHE A 124 2.537 -26.757 10.259 1.00 2.24 C ATOM 1278 CD1 PHE A 124 1.420 -26.301 10.941 1.00 2.75 C ATOM 1279 CD2 PHE A 124 3.497 -27.472 10.956 1.00 2.98 C ATOM 1280 CE1 PHE A 124 1.265 -26.553 12.291 1.00 3.54 C ATOM 1281 CE2 PHE A 124 3.348 -27.727 12.306 1.00 3.79 C ATOM 1282 CZ PHE A 124 2.230 -27.267 12.974 1.00 3.94 C ATOM 0 H PHE A 124 2.601 -24.373 6.424 1.00 1.36 H new ATOM 0 HA PHE A 124 1.604 -24.650 9.027 1.00 1.44 H new ATOM 0 HB2 PHE A 124 2.037 -27.136 8.230 1.00 1.70 H new ATOM 0 HB3 PHE A 124 3.722 -26.732 8.496 1.00 1.70 H new ATOM 0 HD1 PHE A 124 0.662 -25.743 10.412 1.00 2.75 H new ATOM 0 HD2 PHE A 124 4.373 -27.835 10.438 1.00 2.98 H new ATOM 0 HE1 PHE A 124 0.390 -26.192 12.811 1.00 3.54 H new ATOM 0 HE2 PHE A 124 4.104 -28.285 12.838 1.00 3.79 H new ATOM 0 HZ PHE A 124 2.111 -27.465 14.029 1.00 3.94 H new ATOM 1292 N THR A 125 3.775 -23.651 9.870 1.00 1.23 N ATOM 1293 CA THR A 125 4.912 -22.814 10.233 1.00 1.25 C ATOM 1294 C THR A 125 5.152 -21.736 9.180 1.00 0.99 C ATOM 1295 O THR A 125 6.287 -21.314 8.957 1.00 1.05 O ATOM 1296 CB THR A 125 6.169 -23.669 10.400 1.00 1.59 C ATOM 1297 OG1 THR A 125 6.508 -24.306 9.180 1.00 1.93 O ATOM 1298 CG2 THR A 125 6.026 -24.744 11.455 1.00 2.37 C ATOM 0 H THR A 125 3.100 -23.794 10.621 1.00 1.23 H new ATOM 0 HA THR A 125 4.684 -22.327 11.181 1.00 1.25 H new ATOM 0 HB THR A 125 6.950 -22.976 10.714 1.00 1.59 H new ATOM 0 HG1 THR A 125 6.018 -23.884 8.443 1.00 1.93 H new ATOM 0 HG21 THR A 125 6.953 -25.313 11.522 1.00 2.37 H new ATOM 0 HG22 THR A 125 5.813 -24.282 12.419 1.00 2.37 H new ATOM 0 HG23 THR A 125 5.208 -25.412 11.185 1.00 2.37 H new ATOM 1306 N ALA A 126 4.077 -21.294 8.536 1.00 0.93 N ATOM 1307 CA ALA A 126 4.171 -20.265 7.508 1.00 0.74 C ATOM 1308 C ALA A 126 4.429 -18.896 8.126 1.00 0.52 C ATOM 1309 O ALA A 126 5.290 -18.146 7.664 1.00 0.53 O ATOM 1310 CB ALA A 126 2.901 -20.237 6.671 1.00 0.81 C ATOM 0 H ALA A 126 3.130 -21.633 8.708 1.00 0.93 H new ATOM 0 HA ALA A 126 5.014 -20.508 6.861 1.00 0.74 H new ATOM 0 HB1 ALA A 126 2.985 -19.464 5.907 1.00 0.81 H new ATOM 0 HB2 ALA A 126 2.759 -21.206 6.192 1.00 0.81 H new ATOM 0 HB3 ALA A 126 2.047 -20.021 7.313 1.00 0.81 H new ATOM 1316 N ARG A 127 3.679 -18.576 9.176 1.00 0.48 N ATOM 1317 CA ARG A 127 3.827 -17.298 9.861 1.00 0.39 C ATOM 1318 C ARG A 127 5.063 -17.300 10.754 1.00 0.35 C ATOM 1319 O ARG A 127 5.702 -16.266 10.951 1.00 0.33 O ATOM 1320 CB ARG A 127 2.581 -16.995 10.695 1.00 0.58 C ATOM 1321 CG ARG A 127 2.580 -15.603 11.304 1.00 0.85 C ATOM 1322 CD ARG A 127 1.185 -15.189 11.745 1.00 0.91 C ATOM 1323 NE ARG A 127 0.816 -15.787 13.026 1.00 1.52 N ATOM 1324 CZ ARG A 127 -0.247 -15.419 13.739 1.00 1.95 C ATOM 1325 NH1 ARG A 127 -1.051 -14.456 13.304 1.00 2.38 N ATOM 1326 NH2 ARG A 127 -0.507 -16.017 14.894 1.00 2.56 N ATOM 0 H ARG A 127 2.962 -19.185 9.571 1.00 0.48 H new ATOM 0 HA ARG A 127 3.948 -16.521 9.106 1.00 0.39 H new ATOM 0 HB2 ARG A 127 1.697 -17.108 10.067 1.00 0.58 H new ATOM 0 HB3 ARG A 127 2.501 -17.732 11.494 1.00 0.58 H new ATOM 0 HG2 ARG A 127 3.255 -15.578 12.159 1.00 0.85 H new ATOM 0 HG3 ARG A 127 2.961 -14.886 10.576 1.00 0.85 H new ATOM 0 HD2 ARG A 127 1.137 -14.103 11.825 1.00 0.91 H new ATOM 0 HD3 ARG A 127 0.462 -15.485 10.985 1.00 0.91 H new ATOM 0 HE ARG A 127 1.408 -16.531 13.396 1.00 1.52 H new ATOM 0 HH11 ARG A 127 -0.857 -13.991 12.417 1.00 2.38 H new ATOM 0 HH12 ARG A 127 -1.863 -14.181 13.857 1.00 2.38 H new ATOM 0 HH21 ARG A 127 0.107 -16.757 15.235 1.00 2.56 H new ATOM 0 HH22 ARG A 127 -1.321 -15.737 15.442 1.00 2.56 H new ATOM 1340 N GLY A 128 5.395 -18.470 11.291 1.00 0.42 N ATOM 1341 CA GLY A 128 6.554 -18.586 12.157 1.00 0.43 C ATOM 1342 C GLY A 128 7.848 -18.248 11.443 1.00 0.41 C ATOM 1343 O GLY A 128 8.789 -17.743 12.055 1.00 0.45 O ATOM 0 H GLY A 128 4.882 -19.339 11.142 1.00 0.42 H new ATOM 0 HA2 GLY A 128 6.431 -17.923 13.013 1.00 0.43 H new ATOM 0 HA3 GLY A 128 6.612 -19.602 12.546 1.00 0.43 H new ATOM 1347 N ARG A 129 7.895 -18.527 10.144 1.00 0.39 N ATOM 1348 CA ARG A 129 9.083 -18.248 9.345 1.00 0.42 C ATOM 1349 C ARG A 129 9.095 -16.797 8.878 1.00 0.39 C ATOM 1350 O ARG A 129 10.156 -16.192 8.724 1.00 0.46 O ATOM 1351 CB ARG A 129 9.141 -19.186 8.138 1.00 0.47 C ATOM 1352 CG ARG A 129 9.743 -20.546 8.452 1.00 0.86 C ATOM 1353 CD ARG A 129 11.248 -20.459 8.640 1.00 0.90 C ATOM 1354 NE ARG A 129 11.789 -21.652 9.288 1.00 1.55 N ATOM 1355 CZ ARG A 129 12.030 -22.798 8.655 1.00 2.11 C ATOM 1356 NH1 ARG A 129 11.781 -22.916 7.355 1.00 2.48 N ATOM 1357 NH2 ARG A 129 12.522 -23.832 9.323 1.00 2.96 N ATOM 0 H ARG A 129 7.125 -18.946 9.623 1.00 0.39 H new ATOM 0 HA ARG A 129 9.960 -18.416 9.970 1.00 0.42 H new ATOM 0 HB2 ARG A 129 8.133 -19.326 7.748 1.00 0.47 H new ATOM 0 HB3 ARG A 129 9.725 -18.713 7.349 1.00 0.47 H new ATOM 0 HG2 ARG A 129 9.285 -20.948 9.356 1.00 0.86 H new ATOM 0 HG3 ARG A 129 9.516 -21.241 7.644 1.00 0.86 H new ATOM 0 HD2 ARG A 129 11.727 -20.324 7.670 1.00 0.90 H new ATOM 0 HD3 ARG A 129 11.488 -19.581 9.239 1.00 0.90 H new ATOM 0 HE ARG A 129 11.994 -21.604 10.286 1.00 1.55 H new ATOM 0 HH11 ARG A 129 11.402 -22.125 6.834 1.00 2.48 H new ATOM 0 HH12 ARG A 129 11.969 -23.798 6.878 1.00 2.48 H new ATOM 0 HH21 ARG A 129 12.716 -23.749 10.321 1.00 2.96 H new ATOM 0 HH22 ARG A 129 12.707 -24.711 8.839 1.00 2.96 H new ATOM 1371 N PHE A 130 7.908 -16.242 8.656 1.00 0.39 N ATOM 1372 CA PHE A 130 7.781 -14.861 8.207 1.00 0.38 C ATOM 1373 C PHE A 130 8.250 -13.894 9.290 1.00 0.33 C ATOM 1374 O PHE A 130 9.004 -12.960 9.018 1.00 0.33 O ATOM 1375 CB PHE A 130 6.330 -14.557 7.828 1.00 0.40 C ATOM 1376 CG PHE A 130 5.816 -13.269 8.405 1.00 0.36 C ATOM 1377 CD1 PHE A 130 5.233 -13.242 9.661 1.00 1.08 C ATOM 1378 CD2 PHE A 130 5.918 -12.086 7.691 1.00 1.15 C ATOM 1379 CE1 PHE A 130 4.762 -12.058 10.196 1.00 1.09 C ATOM 1380 CE2 PHE A 130 5.448 -10.899 8.220 1.00 1.13 C ATOM 1381 CZ PHE A 130 4.869 -10.885 9.474 1.00 0.33 C ATOM 0 H PHE A 130 7.020 -16.728 8.780 1.00 0.39 H new ATOM 0 HA PHE A 130 8.413 -14.730 7.328 1.00 0.38 H new ATOM 0 HB2 PHE A 130 6.247 -14.518 6.742 1.00 0.40 H new ATOM 0 HB3 PHE A 130 5.695 -15.376 8.166 1.00 0.40 H new ATOM 0 HD1 PHE A 130 5.145 -14.157 10.229 1.00 1.08 H new ATOM 0 HD2 PHE A 130 6.370 -12.092 6.710 1.00 1.15 H new ATOM 0 HE1 PHE A 130 4.311 -12.050 11.177 1.00 1.09 H new ATOM 0 HE2 PHE A 130 5.533 -9.983 7.654 1.00 1.13 H new ATOM 0 HZ PHE A 130 4.501 -9.959 9.889 1.00 0.33 H new ATOM 1391 N ALA A 131 7.797 -14.124 10.518 1.00 0.33 N ATOM 1392 CA ALA A 131 8.169 -13.274 11.642 1.00 0.32 C ATOM 1393 C ALA A 131 9.683 -13.216 11.809 1.00 0.31 C ATOM 1394 O ALA A 131 10.245 -12.159 12.093 1.00 0.32 O ATOM 1395 CB ALA A 131 7.513 -13.774 12.920 1.00 0.37 C ATOM 0 H ALA A 131 7.171 -14.893 10.760 1.00 0.33 H new ATOM 0 HA ALA A 131 7.815 -12.264 11.436 1.00 0.32 H new ATOM 0 HB1 ALA A 131 7.799 -13.130 13.752 1.00 0.37 H new ATOM 0 HB2 ALA A 131 6.429 -13.756 12.804 1.00 0.37 H new ATOM 0 HB3 ALA A 131 7.840 -14.794 13.122 1.00 0.37 H new ATOM 1401 N THR A 132 10.338 -14.359 11.635 1.00 0.33 N ATOM 1402 CA THR A 132 11.788 -14.437 11.769 1.00 0.35 C ATOM 1403 C THR A 132 12.483 -13.544 10.746 1.00 0.35 C ATOM 1404 O THR A 132 13.535 -12.969 11.023 1.00 0.41 O ATOM 1405 CB THR A 132 12.258 -15.883 11.602 1.00 0.41 C ATOM 1406 OG1 THR A 132 13.005 -16.301 12.731 1.00 0.51 O ATOM 1407 CG2 THR A 132 13.121 -16.094 10.376 1.00 0.50 C ATOM 0 H THR A 132 9.888 -15.244 11.401 1.00 0.33 H new ATOM 0 HA THR A 132 12.053 -14.086 12.766 1.00 0.35 H new ATOM 0 HB THR A 132 11.348 -16.472 11.491 1.00 0.41 H new ATOM 0 HG1 THR A 132 13.295 -17.229 12.606 1.00 0.51 H new ATOM 0 HG21 THR A 132 13.420 -17.141 10.317 1.00 0.50 H new ATOM 0 HG22 THR A 132 12.556 -15.827 9.483 1.00 0.50 H new ATOM 0 HG23 THR A 132 14.009 -15.466 10.444 1.00 0.50 H new ATOM 1415 N VAL A 133 11.890 -13.436 9.561 1.00 0.33 N ATOM 1416 CA VAL A 133 12.455 -12.616 8.497 1.00 0.34 C ATOM 1417 C VAL A 133 12.333 -11.130 8.817 1.00 0.30 C ATOM 1418 O VAL A 133 13.323 -10.396 8.793 1.00 0.30 O ATOM 1419 CB VAL A 133 11.766 -12.894 7.148 1.00 0.36 C ATOM 1420 CG1 VAL A 133 12.475 -12.153 6.024 1.00 0.39 C ATOM 1421 CG2 VAL A 133 11.723 -14.389 6.868 1.00 0.47 C ATOM 0 H VAL A 133 11.019 -13.906 9.314 1.00 0.33 H new ATOM 0 HA VAL A 133 13.509 -12.882 8.423 1.00 0.34 H new ATOM 0 HB VAL A 133 10.740 -12.529 7.202 1.00 0.36 H new ATOM 0 HG11 VAL A 133 11.974 -12.361 5.078 1.00 0.39 H new ATOM 0 HG12 VAL A 133 12.448 -11.081 6.221 1.00 0.39 H new ATOM 0 HG13 VAL A 133 13.512 -12.485 5.967 1.00 0.39 H new ATOM 0 HG21 VAL A 133 11.233 -14.566 5.911 1.00 0.47 H new ATOM 0 HG22 VAL A 133 12.739 -14.782 6.833 1.00 0.47 H new ATOM 0 HG23 VAL A 133 11.166 -14.891 7.659 1.00 0.47 H new ATOM 1431 N VAL A 134 11.115 -10.690 9.116 1.00 0.29 N ATOM 1432 CA VAL A 134 10.869 -9.290 9.438 1.00 0.28 C ATOM 1433 C VAL A 134 11.565 -8.890 10.734 1.00 0.28 C ATOM 1434 O VAL A 134 11.955 -7.737 10.907 1.00 0.33 O ATOM 1435 CB VAL A 134 9.364 -8.995 9.570 1.00 0.28 C ATOM 1436 CG1 VAL A 134 9.113 -7.497 9.540 1.00 0.31 C ATOM 1437 CG2 VAL A 134 8.583 -9.698 8.471 1.00 0.36 C ATOM 0 H VAL A 134 10.285 -11.282 9.142 1.00 0.29 H new ATOM 0 HA VAL A 134 11.276 -8.705 8.613 1.00 0.28 H new ATOM 0 HB VAL A 134 9.018 -9.380 10.529 1.00 0.28 H new ATOM 0 HG11 VAL A 134 8.044 -7.305 9.634 1.00 0.31 H new ATOM 0 HG12 VAL A 134 9.641 -7.023 10.367 1.00 0.31 H new ATOM 0 HG13 VAL A 134 9.473 -7.087 8.597 1.00 0.31 H new ATOM 0 HG21 VAL A 134 7.521 -9.477 8.581 1.00 0.36 H new ATOM 0 HG22 VAL A 134 8.928 -9.347 7.498 1.00 0.36 H new ATOM 0 HG23 VAL A 134 8.740 -10.774 8.545 1.00 0.36 H new ATOM 1447 N GLU A 135 11.726 -9.846 11.639 1.00 0.27 N ATOM 1448 CA GLU A 135 12.385 -9.581 12.911 1.00 0.27 C ATOM 1449 C GLU A 135 13.833 -9.170 12.677 1.00 0.29 C ATOM 1450 O GLU A 135 14.334 -8.235 13.302 1.00 0.30 O ATOM 1451 CB GLU A 135 12.327 -10.817 13.810 1.00 0.29 C ATOM 1452 CG GLU A 135 11.213 -10.767 14.842 1.00 0.70 C ATOM 1453 CD GLU A 135 11.711 -10.369 16.218 1.00 1.25 C ATOM 1454 OE1 GLU A 135 12.703 -10.967 16.686 1.00 2.03 O ATOM 1455 OE2 GLU A 135 11.109 -9.460 16.827 1.00 1.92 O ATOM 0 H GLU A 135 11.411 -10.808 11.517 1.00 0.27 H new ATOM 0 HA GLU A 135 11.863 -8.764 13.409 1.00 0.27 H new ATOM 0 HB2 GLU A 135 12.195 -11.702 13.188 1.00 0.29 H new ATOM 0 HB3 GLU A 135 13.282 -10.927 14.324 1.00 0.29 H new ATOM 0 HG2 GLU A 135 10.452 -10.058 14.516 1.00 0.70 H new ATOM 0 HG3 GLU A 135 10.734 -11.744 14.902 1.00 0.70 H new ATOM 1462 N GLU A 136 14.499 -9.872 11.765 1.00 0.30 N ATOM 1463 CA GLU A 136 15.887 -9.576 11.439 1.00 0.33 C ATOM 1464 C GLU A 136 15.990 -8.234 10.725 1.00 0.32 C ATOM 1465 O GLU A 136 16.964 -7.501 10.894 1.00 0.34 O ATOM 1466 CB GLU A 136 16.477 -10.682 10.562 1.00 0.38 C ATOM 1467 CG GLU A 136 16.968 -11.886 11.350 1.00 0.83 C ATOM 1468 CD GLU A 136 18.252 -12.466 10.789 1.00 1.49 C ATOM 1469 OE1 GLU A 136 18.382 -12.530 9.549 1.00 2.29 O ATOM 1470 OE2 GLU A 136 19.127 -12.856 11.590 1.00 2.07 O ATOM 0 H GLU A 136 14.099 -10.649 11.240 1.00 0.30 H new ATOM 0 HA GLU A 136 16.455 -9.524 12.368 1.00 0.33 H new ATOM 0 HB2 GLU A 136 15.722 -11.009 9.847 1.00 0.38 H new ATOM 0 HB3 GLU A 136 17.306 -10.273 9.985 1.00 0.38 H new ATOM 0 HG2 GLU A 136 17.128 -11.595 12.388 1.00 0.83 H new ATOM 0 HG3 GLU A 136 16.196 -12.655 11.350 1.00 0.83 H new ATOM 1477 N LEU A 137 14.972 -7.916 9.932 1.00 0.32 N ATOM 1478 CA LEU A 137 14.940 -6.657 9.198 1.00 0.33 C ATOM 1479 C LEU A 137 15.079 -5.482 10.160 1.00 0.33 C ATOM 1480 O LEU A 137 15.897 -4.587 9.950 1.00 0.39 O ATOM 1481 CB LEU A 137 13.634 -6.529 8.406 1.00 0.32 C ATOM 1482 CG LEU A 137 13.563 -7.315 7.092 1.00 0.34 C ATOM 1483 CD1 LEU A 137 13.498 -6.360 5.912 1.00 0.59 C ATOM 1484 CD2 LEU A 137 14.747 -8.262 6.947 1.00 0.39 C ATOM 0 H LEU A 137 14.159 -8.513 9.782 1.00 0.32 H new ATOM 0 HA LEU A 137 15.776 -6.646 8.499 1.00 0.33 H new ATOM 0 HB2 LEU A 137 12.812 -6.853 9.045 1.00 0.32 H new ATOM 0 HB3 LEU A 137 13.469 -5.475 8.185 1.00 0.32 H new ATOM 0 HG LEU A 137 12.656 -7.919 7.109 1.00 0.34 H new ATOM 0 HD11 LEU A 137 13.448 -6.930 4.985 1.00 0.59 H new ATOM 0 HD12 LEU A 137 12.611 -5.732 6.000 1.00 0.59 H new ATOM 0 HD13 LEU A 137 14.388 -5.731 5.903 1.00 0.59 H new ATOM 0 HD21 LEU A 137 14.666 -8.804 6.005 1.00 0.39 H new ATOM 0 HD22 LEU A 137 15.674 -7.689 6.958 1.00 0.39 H new ATOM 0 HD23 LEU A 137 14.749 -8.971 7.775 1.00 0.39 H new ATOM 1496 N PHE A 138 14.273 -5.494 11.217 1.00 0.30 N ATOM 1497 CA PHE A 138 14.306 -4.430 12.215 1.00 0.33 C ATOM 1498 C PHE A 138 14.834 -4.949 13.548 1.00 0.39 C ATOM 1499 O PHE A 138 14.105 -5.000 14.539 1.00 0.52 O ATOM 1500 CB PHE A 138 12.910 -3.832 12.403 1.00 0.30 C ATOM 1501 CG PHE A 138 12.183 -3.588 11.112 1.00 0.28 C ATOM 1502 CD1 PHE A 138 11.456 -4.602 10.510 1.00 1.05 C ATOM 1503 CD2 PHE A 138 12.227 -2.346 10.501 1.00 0.94 C ATOM 1504 CE1 PHE A 138 10.786 -4.382 9.322 1.00 1.07 C ATOM 1505 CE2 PHE A 138 11.559 -2.119 9.312 1.00 0.94 C ATOM 1506 CZ PHE A 138 10.837 -3.139 8.722 1.00 0.33 C ATOM 0 H PHE A 138 13.590 -6.228 11.405 1.00 0.30 H new ATOM 0 HA PHE A 138 14.980 -3.652 11.856 1.00 0.33 H new ATOM 0 HB2 PHE A 138 12.317 -4.503 13.023 1.00 0.30 H new ATOM 0 HB3 PHE A 138 12.997 -2.890 12.945 1.00 0.30 H new ATOM 0 HD1 PHE A 138 11.412 -5.576 10.975 1.00 1.05 H new ATOM 0 HD2 PHE A 138 12.790 -1.546 10.959 1.00 0.94 H new ATOM 0 HE1 PHE A 138 10.223 -5.181 8.863 1.00 1.07 H new ATOM 0 HE2 PHE A 138 11.601 -1.146 8.845 1.00 0.94 H new ATOM 0 HZ PHE A 138 10.314 -2.965 7.794 1.00 0.33 H new ATOM 1516 N ARG A 139 16.106 -5.334 13.565 1.00 0.48 N ATOM 1517 CA ARG A 139 16.732 -5.850 14.777 1.00 0.57 C ATOM 1518 C ARG A 139 17.006 -4.724 15.769 1.00 0.61 C ATOM 1519 O ARG A 139 16.489 -4.729 16.886 1.00 1.24 O ATOM 1520 CB ARG A 139 18.037 -6.571 14.433 1.00 0.80 C ATOM 1521 CG ARG A 139 18.331 -7.760 15.335 1.00 0.99 C ATOM 1522 CD ARG A 139 18.496 -9.041 14.533 1.00 1.51 C ATOM 1523 NE ARG A 139 19.563 -9.886 15.064 1.00 2.05 N ATOM 1524 CZ ARG A 139 19.523 -10.470 16.260 1.00 2.95 C ATOM 1525 NH1 ARG A 139 18.474 -10.305 17.058 1.00 3.61 N ATOM 1526 NH2 ARG A 139 20.538 -11.224 16.661 1.00 3.54 N ATOM 0 H ARG A 139 16.723 -5.298 12.754 1.00 0.48 H new ATOM 0 HA ARG A 139 16.044 -6.558 15.239 1.00 0.57 H new ATOM 0 HB2 ARG A 139 17.992 -6.912 13.399 1.00 0.80 H new ATOM 0 HB3 ARG A 139 18.862 -5.862 14.499 1.00 0.80 H new ATOM 0 HG2 ARG A 139 19.239 -7.568 15.907 1.00 0.99 H new ATOM 0 HG3 ARG A 139 17.521 -7.882 16.054 1.00 0.99 H new ATOM 0 HD2 ARG A 139 17.558 -9.596 14.539 1.00 1.51 H new ATOM 0 HD3 ARG A 139 18.713 -8.793 13.494 1.00 1.51 H new ATOM 0 HE ARG A 139 20.388 -10.038 14.484 1.00 2.05 H new ATOM 0 HH11 ARG A 139 17.690 -9.727 16.756 1.00 3.61 H new ATOM 0 HH12 ARG A 139 18.453 -10.757 17.972 1.00 3.61 H new ATOM 0 HH21 ARG A 139 21.347 -11.355 16.054 1.00 3.54 H new ATOM 0 HH22 ARG A 139 20.510 -11.672 17.577 1.00 3.54 H new ATOM 1540 N ASP A 140 17.823 -3.762 15.353 1.00 0.79 N ATOM 1541 CA ASP A 140 18.167 -2.630 16.205 1.00 0.81 C ATOM 1542 C ASP A 140 17.066 -1.575 16.182 1.00 0.53 C ATOM 1543 O ASP A 140 16.304 -1.437 17.139 1.00 1.24 O ATOM 1544 CB ASP A 140 19.491 -2.011 15.755 1.00 1.28 C ATOM 1545 CG ASP A 140 20.689 -2.660 16.420 1.00 2.16 C ATOM 1546 OD1 ASP A 140 20.488 -3.604 17.214 1.00 2.84 O ATOM 1547 OD2 ASP A 140 21.828 -2.226 16.148 1.00 2.84 O ATOM 0 H ASP A 140 18.259 -3.744 14.431 1.00 0.79 H new ATOM 0 HA ASP A 140 18.272 -2.996 17.226 1.00 0.81 H new ATOM 0 HB2 ASP A 140 19.584 -2.106 14.673 1.00 1.28 H new ATOM 0 HB3 ASP A 140 19.486 -0.945 15.982 1.00 1.28 H new ATOM 1552 N GLY A 141 16.990 -0.832 15.083 1.00 0.66 N ATOM 1553 CA GLY A 141 15.981 0.202 14.955 1.00 0.50 C ATOM 1554 C GLY A 141 15.288 0.173 13.608 1.00 0.48 C ATOM 1555 O GLY A 141 15.722 -0.529 12.694 1.00 0.67 O ATOM 0 H GLY A 141 17.610 -0.928 14.278 1.00 0.66 H new ATOM 0 HA2 GLY A 141 15.239 0.081 15.744 1.00 0.50 H new ATOM 0 HA3 GLY A 141 16.445 1.178 15.100 1.00 0.50 H new ATOM 1559 N VAL A 142 14.205 0.932 13.486 1.00 0.38 N ATOM 1560 CA VAL A 142 13.445 0.987 12.244 1.00 0.35 C ATOM 1561 C VAL A 142 13.736 2.270 11.470 1.00 0.33 C ATOM 1562 O VAL A 142 14.195 3.261 12.037 1.00 0.34 O ATOM 1563 CB VAL A 142 11.930 0.889 12.514 1.00 0.35 C ATOM 1564 CG1 VAL A 142 11.147 0.843 11.211 1.00 0.35 C ATOM 1565 CG2 VAL A 142 11.620 -0.330 13.368 1.00 0.36 C ATOM 0 H VAL A 142 13.834 1.518 14.233 1.00 0.38 H new ATOM 0 HA VAL A 142 13.757 0.133 11.643 1.00 0.35 H new ATOM 0 HB VAL A 142 11.624 1.781 13.060 1.00 0.35 H new ATOM 0 HG11 VAL A 142 10.081 0.774 11.429 1.00 0.35 H new ATOM 0 HG12 VAL A 142 11.342 1.749 10.637 1.00 0.35 H new ATOM 0 HG13 VAL A 142 11.456 -0.027 10.631 1.00 0.35 H new ATOM 0 HG21 VAL A 142 10.546 -0.384 13.549 1.00 0.36 H new ATOM 0 HG22 VAL A 142 11.946 -1.231 12.848 1.00 0.36 H new ATOM 0 HG23 VAL A 142 12.145 -0.250 14.320 1.00 0.36 H new ATOM 1575 N ASN A 143 13.455 2.240 10.172 1.00 0.31 N ATOM 1576 CA ASN A 143 13.668 3.390 9.302 1.00 0.32 C ATOM 1577 C ASN A 143 12.964 3.160 7.971 1.00 0.28 C ATOM 1578 O ASN A 143 12.638 2.022 7.634 1.00 0.34 O ATOM 1579 CB ASN A 143 15.164 3.621 9.076 1.00 0.36 C ATOM 1580 CG ASN A 143 15.458 5.003 8.526 1.00 1.39 C ATOM 1581 OD1 ASN A 143 14.546 5.784 8.256 1.00 2.37 O ATOM 1582 ND2 ASN A 143 16.739 5.312 8.358 1.00 1.89 N ATOM 0 H ASN A 143 13.075 1.422 9.695 1.00 0.31 H new ATOM 0 HA ASN A 143 13.253 4.277 9.780 1.00 0.32 H new ATOM 0 HB2 ASN A 143 15.696 3.487 10.018 1.00 0.36 H new ATOM 0 HB3 ASN A 143 15.545 2.869 8.385 1.00 0.36 H new ATOM 0 HD21 ASN A 143 16.999 6.228 7.992 1.00 1.89 H new ATOM 0 HD22 ASN A 143 17.463 4.633 8.595 1.00 1.89 H new ATOM 1589 N TRP A 144 12.717 4.236 7.223 1.00 0.30 N ATOM 1590 CA TRP A 144 12.035 4.128 5.935 1.00 0.28 C ATOM 1591 C TRP A 144 12.605 2.981 5.109 1.00 0.27 C ATOM 1592 O TRP A 144 11.887 2.037 4.778 1.00 0.27 O ATOM 1593 CB TRP A 144 12.141 5.443 5.164 1.00 0.32 C ATOM 1594 CG TRP A 144 11.395 6.568 5.814 1.00 0.28 C ATOM 1595 CD1 TRP A 144 11.879 7.809 6.112 1.00 0.30 C ATOM 1596 CD2 TRP A 144 10.030 6.554 6.251 1.00 0.24 C ATOM 1597 NE1 TRP A 144 10.901 8.567 6.708 1.00 0.28 N ATOM 1598 CE2 TRP A 144 9.756 7.820 6.804 1.00 0.25 C ATOM 1599 CE3 TRP A 144 9.011 5.595 6.228 1.00 0.24 C ATOM 1600 CZ2 TRP A 144 8.509 8.150 7.330 1.00 0.27 C ATOM 1601 CZ3 TRP A 144 7.774 5.925 6.750 1.00 0.27 C ATOM 1602 CH2 TRP A 144 7.532 7.193 7.294 1.00 0.28 C ATOM 0 H TRP A 144 12.978 5.187 7.486 1.00 0.30 H new ATOM 0 HA TRP A 144 10.983 3.918 6.126 1.00 0.28 H new ATOM 0 HB2 TRP A 144 13.191 5.718 5.070 1.00 0.32 H new ATOM 0 HB3 TRP A 144 11.758 5.297 4.154 1.00 0.32 H new ATOM 0 HD1 TRP A 144 12.885 8.146 5.909 1.00 0.30 H new ATOM 0 HE1 TRP A 144 11.009 9.530 7.027 1.00 0.28 H new ATOM 0 HE3 TRP A 144 9.188 4.615 5.810 1.00 0.24 H new ATOM 0 HZ2 TRP A 144 8.320 9.126 7.751 1.00 0.27 H new ATOM 0 HZ3 TRP A 144 6.981 5.192 6.738 1.00 0.27 H new ATOM 0 HH2 TRP A 144 6.554 7.420 7.693 1.00 0.28 H new ATOM 1613 N GLY A 145 13.893 3.072 4.779 1.00 0.30 N ATOM 1614 CA GLY A 145 14.541 2.031 3.996 1.00 0.34 C ATOM 1615 C GLY A 145 14.162 0.641 4.470 1.00 0.31 C ATOM 1616 O GLY A 145 13.777 -0.213 3.671 1.00 0.30 O ATOM 0 H GLY A 145 14.500 3.849 5.040 1.00 0.30 H new ATOM 0 HA2 GLY A 145 14.267 2.143 2.947 1.00 0.34 H new ATOM 0 HA3 GLY A 145 15.623 2.152 4.057 1.00 0.34 H new ATOM 1620 N ARG A 146 14.257 0.421 5.778 1.00 0.30 N ATOM 1621 CA ARG A 146 13.906 -0.866 6.362 1.00 0.27 C ATOM 1622 C ARG A 146 12.444 -1.194 6.077 1.00 0.23 C ATOM 1623 O ARG A 146 12.134 -2.236 5.498 1.00 0.23 O ATOM 1624 CB ARG A 146 14.155 -0.851 7.871 1.00 0.29 C ATOM 1625 CG ARG A 146 15.598 -0.558 8.246 1.00 0.46 C ATOM 1626 CD ARG A 146 16.154 -1.614 9.186 1.00 0.49 C ATOM 1627 NE ARG A 146 17.589 -1.815 8.997 1.00 1.19 N ATOM 1628 CZ ARG A 146 18.358 -2.516 9.829 1.00 1.31 C ATOM 1629 NH1 ARG A 146 17.838 -3.085 10.911 1.00 1.55 N ATOM 1630 NH2 ARG A 146 19.653 -2.649 9.578 1.00 2.00 N ATOM 0 H ARG A 146 14.574 1.118 6.452 1.00 0.30 H new ATOM 0 HA ARG A 146 14.534 -1.634 5.911 1.00 0.27 H new ATOM 0 HB2 ARG A 146 13.510 -0.102 8.330 1.00 0.29 H new ATOM 0 HB3 ARG A 146 13.869 -1.817 8.288 1.00 0.29 H new ATOM 0 HG2 ARG A 146 16.208 -0.515 7.344 1.00 0.46 H new ATOM 0 HG3 ARG A 146 15.660 0.422 8.720 1.00 0.46 H new ATOM 0 HD2 ARG A 146 15.962 -1.318 10.217 1.00 0.49 H new ATOM 0 HD3 ARG A 146 15.631 -2.556 9.022 1.00 0.49 H new ATOM 0 HE ARG A 146 18.028 -1.393 8.179 1.00 1.19 H new ATOM 0 HH11 ARG A 146 16.842 -2.987 11.110 1.00 1.55 H new ATOM 0 HH12 ARG A 146 18.434 -3.620 11.542 1.00 1.55 H new ATOM 0 HH21 ARG A 146 20.059 -2.215 8.749 1.00 2.00 H new ATOM 0 HH22 ARG A 146 20.243 -3.185 10.214 1.00 2.00 H new ATOM 1644 N ILE A 147 11.551 -0.292 6.482 1.00 0.23 N ATOM 1645 CA ILE A 147 10.121 -0.477 6.264 1.00 0.23 C ATOM 1646 C ILE A 147 9.845 -0.903 4.827 1.00 0.24 C ATOM 1647 O ILE A 147 9.117 -1.864 4.581 1.00 0.29 O ATOM 1648 CB ILE A 147 9.334 0.814 6.561 1.00 0.26 C ATOM 1649 CG1 ILE A 147 9.421 1.160 8.048 1.00 0.31 C ATOM 1650 CG2 ILE A 147 7.882 0.661 6.131 1.00 0.31 C ATOM 1651 CD1 ILE A 147 8.567 2.345 8.441 1.00 0.28 C ATOM 0 H ILE A 147 11.795 0.574 6.963 1.00 0.23 H new ATOM 0 HA ILE A 147 9.792 -1.258 6.949 1.00 0.23 H new ATOM 0 HB ILE A 147 9.777 1.631 5.991 1.00 0.26 H new ATOM 0 HG12 ILE A 147 9.117 0.292 8.634 1.00 0.31 H new ATOM 0 HG13 ILE A 147 10.460 1.369 8.304 1.00 0.31 H new ATOM 0 HG21 ILE A 147 7.340 1.581 6.347 1.00 0.31 H new ATOM 0 HG22 ILE A 147 7.839 0.457 5.061 1.00 0.31 H new ATOM 0 HG23 ILE A 147 7.426 -0.166 6.676 1.00 0.31 H new ATOM 0 HD11 ILE A 147 8.677 2.534 9.509 1.00 0.28 H new ATOM 0 HD12 ILE A 147 8.886 3.225 7.882 1.00 0.28 H new ATOM 0 HD13 ILE A 147 7.522 2.131 8.216 1.00 0.28 H new ATOM 1663 N VAL A 148 10.444 -0.185 3.883 1.00 0.24 N ATOM 1664 CA VAL A 148 10.277 -0.489 2.467 1.00 0.28 C ATOM 1665 C VAL A 148 10.807 -1.883 2.140 1.00 0.32 C ATOM 1666 O VAL A 148 10.344 -2.529 1.199 1.00 0.56 O ATOM 1667 CB VAL A 148 11.002 0.545 1.586 1.00 0.31 C ATOM 1668 CG1 VAL A 148 11.662 -0.132 0.395 1.00 0.49 C ATOM 1669 CG2 VAL A 148 10.036 1.627 1.127 1.00 0.36 C ATOM 0 H VAL A 148 11.050 0.613 4.074 1.00 0.24 H new ATOM 0 HA VAL A 148 9.208 -0.451 2.255 1.00 0.28 H new ATOM 0 HB VAL A 148 11.783 1.017 2.182 1.00 0.31 H new ATOM 0 HG11 VAL A 148 12.169 0.616 -0.214 1.00 0.49 H new ATOM 0 HG12 VAL A 148 12.388 -0.864 0.749 1.00 0.49 H new ATOM 0 HG13 VAL A 148 10.903 -0.635 -0.204 1.00 0.49 H new ATOM 0 HG21 VAL A 148 10.566 2.349 0.506 1.00 0.36 H new ATOM 0 HG22 VAL A 148 9.230 1.174 0.550 1.00 0.36 H new ATOM 0 HG23 VAL A 148 9.618 2.135 1.997 1.00 0.36 H new ATOM 1679 N ALA A 149 11.770 -2.348 2.931 1.00 0.28 N ATOM 1680 CA ALA A 149 12.349 -3.669 2.729 1.00 0.28 C ATOM 1681 C ALA A 149 11.345 -4.754 3.096 1.00 0.24 C ATOM 1682 O ALA A 149 10.910 -5.526 2.240 1.00 0.23 O ATOM 1683 CB ALA A 149 13.622 -3.817 3.549 1.00 0.30 C ATOM 0 H ALA A 149 12.164 -1.829 3.716 1.00 0.28 H new ATOM 0 HA ALA A 149 12.602 -3.781 1.675 1.00 0.28 H new ATOM 0 HB1 ALA A 149 14.045 -4.809 3.389 1.00 0.30 H new ATOM 0 HB2 ALA A 149 14.344 -3.061 3.240 1.00 0.30 H new ATOM 0 HB3 ALA A 149 13.391 -3.687 4.606 1.00 0.30 H new ATOM 1689 N PHE A 150 10.973 -4.802 4.372 1.00 0.27 N ATOM 1690 CA PHE A 150 10.011 -5.788 4.850 1.00 0.28 C ATOM 1691 C PHE A 150 8.784 -5.816 3.947 1.00 0.25 C ATOM 1692 O PHE A 150 8.246 -6.881 3.645 1.00 0.24 O ATOM 1693 CB PHE A 150 9.598 -5.473 6.288 1.00 0.38 C ATOM 1694 CG PHE A 150 8.117 -5.571 6.529 1.00 0.37 C ATOM 1695 CD1 PHE A 150 7.292 -4.481 6.301 1.00 1.25 C ATOM 1696 CD2 PHE A 150 7.553 -6.750 6.990 1.00 0.97 C ATOM 1697 CE1 PHE A 150 5.931 -4.566 6.530 1.00 1.36 C ATOM 1698 CE2 PHE A 150 6.193 -6.840 7.219 1.00 0.92 C ATOM 1699 CZ PHE A 150 5.381 -5.747 6.989 1.00 0.56 C ATOM 0 H PHE A 150 11.323 -4.170 5.092 1.00 0.27 H new ATOM 0 HA PHE A 150 10.483 -6.770 4.827 1.00 0.28 H new ATOM 0 HB2 PHE A 150 10.113 -6.158 6.962 1.00 0.38 H new ATOM 0 HB3 PHE A 150 9.932 -4.466 6.540 1.00 0.38 H new ATOM 0 HD1 PHE A 150 7.717 -3.556 5.941 1.00 1.25 H new ATOM 0 HD2 PHE A 150 8.183 -7.608 7.172 1.00 0.97 H new ATOM 0 HE1 PHE A 150 5.298 -3.709 6.350 1.00 1.36 H new ATOM 0 HE2 PHE A 150 5.766 -7.765 7.578 1.00 0.92 H new ATOM 0 HZ PHE A 150 4.318 -5.815 7.168 1.00 0.56 H new ATOM 1709 N PHE A 151 8.354 -4.636 3.509 1.00 0.30 N ATOM 1710 CA PHE A 151 7.199 -4.526 2.628 1.00 0.34 C ATOM 1711 C PHE A 151 7.403 -5.377 1.381 1.00 0.33 C ATOM 1712 O PHE A 151 6.536 -6.166 1.004 1.00 0.41 O ATOM 1713 CB PHE A 151 6.970 -3.067 2.228 1.00 0.42 C ATOM 1714 CG PHE A 151 5.770 -2.443 2.879 1.00 0.33 C ATOM 1715 CD1 PHE A 151 4.505 -2.974 2.684 1.00 1.07 C ATOM 1716 CD2 PHE A 151 5.906 -1.323 3.682 1.00 1.14 C ATOM 1717 CE1 PHE A 151 3.398 -2.400 3.279 1.00 1.02 C ATOM 1718 CE2 PHE A 151 4.803 -0.743 4.279 1.00 1.21 C ATOM 1719 CZ PHE A 151 3.548 -1.282 4.078 1.00 0.42 C ATOM 0 H PHE A 151 8.788 -3.745 3.750 1.00 0.30 H new ATOM 0 HA PHE A 151 6.322 -4.887 3.165 1.00 0.34 H new ATOM 0 HB2 PHE A 151 7.855 -2.486 2.486 1.00 0.42 H new ATOM 0 HB3 PHE A 151 6.856 -3.010 1.146 1.00 0.42 H new ATOM 0 HD1 PHE A 151 4.383 -3.847 2.060 1.00 1.07 H new ATOM 0 HD2 PHE A 151 6.886 -0.898 3.844 1.00 1.14 H new ATOM 0 HE1 PHE A 151 2.417 -2.824 3.120 1.00 1.02 H new ATOM 0 HE2 PHE A 151 4.923 0.131 4.902 1.00 1.21 H new ATOM 0 HZ PHE A 151 2.685 -0.831 4.544 1.00 0.42 H new ATOM 1729 N GLU A 152 8.560 -5.212 0.749 1.00 0.29 N ATOM 1730 CA GLU A 152 8.887 -5.967 -0.455 1.00 0.31 C ATOM 1731 C GLU A 152 9.001 -7.456 -0.143 1.00 0.27 C ATOM 1732 O GLU A 152 8.629 -8.301 -0.957 1.00 0.28 O ATOM 1733 CB GLU A 152 10.196 -5.460 -1.062 1.00 0.36 C ATOM 1734 CG GLU A 152 10.005 -4.667 -2.345 1.00 0.77 C ATOM 1735 CD GLU A 152 9.670 -5.549 -3.531 1.00 1.41 C ATOM 1736 OE1 GLU A 152 9.593 -6.783 -3.351 1.00 2.21 O ATOM 1737 OE2 GLU A 152 9.485 -5.006 -4.641 1.00 2.08 O ATOM 0 H GLU A 152 9.287 -4.563 1.050 1.00 0.29 H new ATOM 0 HA GLU A 152 8.083 -5.823 -1.176 1.00 0.31 H new ATOM 0 HB2 GLU A 152 10.707 -4.834 -0.331 1.00 0.36 H new ATOM 0 HB3 GLU A 152 10.847 -6.311 -1.264 1.00 0.36 H new ATOM 0 HG2 GLU A 152 9.207 -3.938 -2.202 1.00 0.77 H new ATOM 0 HG3 GLU A 152 10.914 -4.106 -2.560 1.00 0.77 H new ATOM 1744 N PHE A 153 9.515 -7.769 1.043 1.00 0.25 N ATOM 1745 CA PHE A 153 9.674 -9.156 1.462 1.00 0.26 C ATOM 1746 C PHE A 153 8.319 -9.849 1.546 1.00 0.27 C ATOM 1747 O PHE A 153 8.116 -10.908 0.951 1.00 0.33 O ATOM 1748 CB PHE A 153 10.380 -9.229 2.817 1.00 0.26 C ATOM 1749 CG PHE A 153 9.888 -10.349 3.687 1.00 0.34 C ATOM 1750 CD1 PHE A 153 10.266 -11.657 3.433 1.00 1.08 C ATOM 1751 CD2 PHE A 153 9.046 -10.093 4.757 1.00 1.02 C ATOM 1752 CE1 PHE A 153 9.815 -12.690 4.231 1.00 1.16 C ATOM 1753 CE2 PHE A 153 8.591 -11.122 5.558 1.00 1.11 C ATOM 1754 CZ PHE A 153 8.975 -12.422 5.295 1.00 0.69 C ATOM 0 H PHE A 153 9.828 -7.082 1.729 1.00 0.25 H new ATOM 0 HA PHE A 153 10.285 -9.667 0.718 1.00 0.26 H new ATOM 0 HB2 PHE A 153 11.451 -9.349 2.654 1.00 0.26 H new ATOM 0 HB3 PHE A 153 10.242 -8.284 3.342 1.00 0.26 H new ATOM 0 HD1 PHE A 153 10.921 -11.872 2.601 1.00 1.08 H new ATOM 0 HD2 PHE A 153 8.742 -9.078 4.967 1.00 1.02 H new ATOM 0 HE1 PHE A 153 10.118 -13.706 4.024 1.00 1.16 H new ATOM 0 HE2 PHE A 153 7.935 -10.910 6.390 1.00 1.11 H new ATOM 0 HZ PHE A 153 8.619 -13.228 5.920 1.00 0.69 H new ATOM 1764 N GLY A 154 7.395 -9.242 2.286 1.00 0.27 N ATOM 1765 CA GLY A 154 6.069 -9.812 2.431 1.00 0.33 C ATOM 1766 C GLY A 154 5.474 -10.214 1.098 1.00 0.33 C ATOM 1767 O GLY A 154 4.885 -11.287 0.971 1.00 0.46 O ATOM 0 H GLY A 154 7.542 -8.366 2.787 1.00 0.27 H new ATOM 0 HA2 GLY A 154 6.119 -10.684 3.083 1.00 0.33 H new ATOM 0 HA3 GLY A 154 5.415 -9.088 2.916 1.00 0.33 H new ATOM 1771 N GLY A 155 5.639 -9.355 0.097 1.00 0.26 N ATOM 1772 CA GLY A 155 5.118 -9.650 -1.223 1.00 0.28 C ATOM 1773 C GLY A 155 5.802 -10.852 -1.838 1.00 0.26 C ATOM 1774 O GLY A 155 5.148 -11.731 -2.399 1.00 0.28 O ATOM 0 H GLY A 155 6.124 -8.461 0.177 1.00 0.26 H new ATOM 0 HA2 GLY A 155 4.046 -9.835 -1.158 1.00 0.28 H new ATOM 0 HA3 GLY A 155 5.254 -8.783 -1.870 1.00 0.28 H new ATOM 1778 N VAL A 156 7.125 -10.894 -1.719 1.00 0.24 N ATOM 1779 CA VAL A 156 7.905 -12.000 -2.252 1.00 0.26 C ATOM 1780 C VAL A 156 7.360 -13.328 -1.739 1.00 0.25 C ATOM 1781 O VAL A 156 7.238 -14.296 -2.489 1.00 0.28 O ATOM 1782 CB VAL A 156 9.391 -11.873 -1.862 1.00 0.26 C ATOM 1783 CG1 VAL A 156 10.049 -13.242 -1.781 1.00 0.72 C ATOM 1784 CG2 VAL A 156 10.127 -10.977 -2.846 1.00 0.89 C ATOM 0 H VAL A 156 7.678 -10.172 -1.257 1.00 0.24 H new ATOM 0 HA VAL A 156 7.825 -11.968 -3.339 1.00 0.26 H new ATOM 0 HB VAL A 156 9.446 -11.414 -0.875 1.00 0.26 H new ATOM 0 HG11 VAL A 156 11.097 -13.126 -1.504 1.00 0.72 H new ATOM 0 HG12 VAL A 156 9.540 -13.846 -1.030 1.00 0.72 H new ATOM 0 HG13 VAL A 156 9.982 -13.736 -2.750 1.00 0.72 H new ATOM 0 HG21 VAL A 156 11.174 -10.899 -2.554 1.00 0.89 H new ATOM 0 HG22 VAL A 156 10.060 -11.403 -3.847 1.00 0.89 H new ATOM 0 HG23 VAL A 156 9.675 -9.985 -2.843 1.00 0.89 H new ATOM 1794 N MET A 157 7.030 -13.358 -0.451 1.00 0.23 N ATOM 1795 CA MET A 157 6.490 -14.557 0.177 1.00 0.27 C ATOM 1796 C MET A 157 5.032 -14.766 -0.217 1.00 0.29 C ATOM 1797 O MET A 157 4.600 -15.893 -0.459 1.00 0.33 O ATOM 1798 CB MET A 157 6.603 -14.453 1.697 1.00 0.29 C ATOM 1799 CG MET A 157 7.804 -15.186 2.272 1.00 0.88 C ATOM 1800 SD MET A 157 7.803 -15.215 4.075 1.00 1.27 S ATOM 1801 CE MET A 157 6.741 -16.623 4.389 1.00 0.43 C ATOM 0 H MET A 157 7.128 -12.562 0.179 1.00 0.23 H new ATOM 0 HA MET A 157 7.070 -15.412 -0.170 1.00 0.27 H new ATOM 0 HB2 MET A 157 6.662 -13.401 1.977 1.00 0.29 H new ATOM 0 HB3 MET A 157 5.695 -14.852 2.148 1.00 0.29 H new ATOM 0 HG2 MET A 157 7.814 -16.209 1.896 1.00 0.88 H new ATOM 0 HG3 MET A 157 8.719 -14.708 1.921 1.00 0.88 H new ATOM 0 HE1 MET A 157 5.832 -16.289 4.889 1.00 0.43 H new ATOM 0 HE2 MET A 157 6.481 -17.101 3.444 1.00 0.43 H new ATOM 0 HE3 MET A 157 7.263 -17.338 5.025 1.00 0.43 H new ATOM 1811 N CYS A 158 4.278 -13.673 -0.280 1.00 0.29 N ATOM 1812 CA CYS A 158 2.869 -13.739 -0.646 1.00 0.32 C ATOM 1813 C CYS A 158 2.698 -14.402 -2.006 1.00 0.32 C ATOM 1814 O CYS A 158 1.774 -15.189 -2.213 1.00 0.36 O ATOM 1815 CB CYS A 158 2.257 -12.337 -0.666 1.00 0.35 C ATOM 1816 SG CYS A 158 1.719 -11.789 -2.303 1.00 0.92 S ATOM 0 H CYS A 158 4.619 -12.732 -0.082 1.00 0.29 H new ATOM 0 HA CYS A 158 2.350 -14.339 0.101 1.00 0.32 H new ATOM 0 HB2 CYS A 158 1.403 -12.315 0.011 1.00 0.35 H new ATOM 0 HB3 CYS A 158 2.989 -11.627 -0.279 1.00 0.35 H new ATOM 0 HG CYS A 158 2.377 -10.720 -2.641 1.00 0.92 H new ATOM 1822 N VAL A 159 3.597 -14.083 -2.929 1.00 0.30 N ATOM 1823 CA VAL A 159 3.548 -14.653 -4.268 1.00 0.33 C ATOM 1824 C VAL A 159 4.070 -16.084 -4.265 1.00 0.36 C ATOM 1825 O VAL A 159 3.607 -16.928 -5.034 1.00 0.38 O ATOM 1826 CB VAL A 159 4.362 -13.812 -5.269 1.00 0.36 C ATOM 1827 CG1 VAL A 159 5.637 -14.538 -5.674 1.00 0.66 C ATOM 1828 CG2 VAL A 159 3.517 -13.480 -6.489 1.00 0.67 C ATOM 0 H VAL A 159 4.368 -13.433 -2.774 1.00 0.30 H new ATOM 0 HA VAL A 159 2.504 -14.651 -4.581 1.00 0.33 H new ATOM 0 HB VAL A 159 4.648 -12.879 -4.784 1.00 0.36 H new ATOM 0 HG11 VAL A 159 6.196 -13.925 -6.381 1.00 0.66 H new ATOM 0 HG12 VAL A 159 6.248 -14.720 -4.790 1.00 0.66 H new ATOM 0 HG13 VAL A 159 5.381 -15.489 -6.141 1.00 0.66 H new ATOM 0 HG21 VAL A 159 4.105 -12.885 -7.188 1.00 0.67 H new ATOM 0 HG22 VAL A 159 3.201 -14.403 -6.975 1.00 0.67 H new ATOM 0 HG23 VAL A 159 2.639 -12.913 -6.180 1.00 0.67 H new ATOM 1838 N GLU A 160 5.033 -16.353 -3.388 1.00 0.40 N ATOM 1839 CA GLU A 160 5.612 -17.685 -3.278 1.00 0.45 C ATOM 1840 C GLU A 160 4.512 -18.734 -3.180 1.00 0.44 C ATOM 1841 O GLU A 160 4.530 -19.738 -3.892 1.00 0.45 O ATOM 1842 CB GLU A 160 6.527 -17.769 -2.055 1.00 0.52 C ATOM 1843 CG GLU A 160 7.666 -18.763 -2.215 1.00 1.04 C ATOM 1844 CD GLU A 160 8.990 -18.216 -1.721 1.00 1.51 C ATOM 1845 OE1 GLU A 160 8.978 -17.209 -0.982 1.00 2.33 O ATOM 1846 OE2 GLU A 160 10.040 -18.795 -2.072 1.00 1.97 O ATOM 0 H GLU A 160 5.427 -15.666 -2.745 1.00 0.40 H new ATOM 0 HA GLU A 160 6.204 -17.879 -4.173 1.00 0.45 H new ATOM 0 HB2 GLU A 160 6.943 -16.782 -1.854 1.00 0.52 H new ATOM 0 HB3 GLU A 160 5.932 -18.047 -1.185 1.00 0.52 H new ATOM 0 HG2 GLU A 160 7.427 -19.675 -1.668 1.00 1.04 H new ATOM 0 HG3 GLU A 160 7.760 -19.037 -3.266 1.00 1.04 H new ATOM 1853 N SER A 161 3.549 -18.489 -2.296 1.00 0.45 N ATOM 1854 CA SER A 161 2.434 -19.409 -2.111 1.00 0.46 C ATOM 1855 C SER A 161 1.715 -19.653 -3.433 1.00 0.42 C ATOM 1856 O SER A 161 1.243 -20.758 -3.700 1.00 0.48 O ATOM 1857 CB SER A 161 1.453 -18.854 -1.078 1.00 0.51 C ATOM 1858 OG SER A 161 2.099 -17.959 -0.189 1.00 1.47 O ATOM 0 H SER A 161 3.519 -17.663 -1.698 1.00 0.45 H new ATOM 0 HA SER A 161 2.830 -20.358 -1.749 1.00 0.46 H new ATOM 0 HB2 SER A 161 0.637 -18.340 -1.586 1.00 0.51 H new ATOM 0 HB3 SER A 161 1.011 -19.675 -0.514 1.00 0.51 H new ATOM 0 HG SER A 161 1.711 -17.064 -0.287 1.00 1.47 H new ATOM 1864 N VAL A 162 1.645 -18.615 -4.262 1.00 0.36 N ATOM 1865 CA VAL A 162 0.994 -18.715 -5.562 1.00 0.35 C ATOM 1866 C VAL A 162 1.831 -19.542 -6.536 1.00 0.35 C ATOM 1867 O VAL A 162 1.310 -20.075 -7.516 1.00 0.51 O ATOM 1868 CB VAL A 162 0.745 -17.323 -6.176 1.00 0.32 C ATOM 1869 CG1 VAL A 162 -0.154 -17.431 -7.398 1.00 0.38 C ATOM 1870 CG2 VAL A 162 0.142 -16.381 -5.145 1.00 0.48 C ATOM 0 H VAL A 162 2.032 -17.694 -4.055 1.00 0.36 H new ATOM 0 HA VAL A 162 0.037 -19.209 -5.397 1.00 0.35 H new ATOM 0 HB VAL A 162 1.703 -16.911 -6.492 1.00 0.32 H new ATOM 0 HG11 VAL A 162 -0.318 -16.439 -7.818 1.00 0.38 H new ATOM 0 HG12 VAL A 162 0.322 -18.066 -8.145 1.00 0.38 H new ATOM 0 HG13 VAL A 162 -1.111 -17.866 -7.109 1.00 0.38 H new ATOM 0 HG21 VAL A 162 -0.026 -15.404 -5.599 1.00 0.48 H new ATOM 0 HG22 VAL A 162 -0.807 -16.786 -4.793 1.00 0.48 H new ATOM 0 HG23 VAL A 162 0.826 -16.277 -4.303 1.00 0.48 H new ATOM 1880 N ASN A 163 3.129 -19.647 -6.260 1.00 0.47 N ATOM 1881 CA ASN A 163 4.027 -20.412 -7.114 1.00 0.53 C ATOM 1882 C ASN A 163 3.539 -21.850 -7.262 1.00 0.46 C ATOM 1883 O ASN A 163 3.282 -22.319 -8.370 1.00 0.44 O ATOM 1884 CB ASN A 163 5.446 -20.397 -6.543 1.00 0.72 C ATOM 1885 CG ASN A 163 6.505 -20.370 -7.629 1.00 1.02 C ATOM 1886 OD1 ASN A 163 6.201 -20.151 -8.802 1.00 1.56 O ATOM 1887 ND2 ASN A 163 7.755 -20.593 -7.242 1.00 1.58 N ATOM 0 H ASN A 163 3.579 -19.213 -5.454 1.00 0.47 H new ATOM 0 HA ASN A 163 4.037 -19.947 -8.100 1.00 0.53 H new ATOM 0 HB2 ASN A 163 5.567 -19.526 -5.900 1.00 0.72 H new ATOM 0 HB3 ASN A 163 5.593 -21.278 -5.918 1.00 0.72 H new ATOM 0 HD21 ASN A 163 8.510 -20.587 -7.928 1.00 1.58 H new ATOM 0 HD22 ASN A 163 7.961 -20.770 -6.259 1.00 1.58 H new ATOM 1894 N ARG A 164 3.416 -22.544 -6.135 1.00 0.53 N ATOM 1895 CA ARG A 164 2.960 -23.930 -6.134 1.00 0.59 C ATOM 1896 C ARG A 164 1.444 -24.009 -6.282 1.00 0.60 C ATOM 1897 O ARG A 164 0.932 -24.353 -7.348 1.00 1.25 O ATOM 1898 CB ARG A 164 3.395 -24.631 -4.846 1.00 0.73 C ATOM 1899 CG ARG A 164 4.446 -25.707 -5.064 1.00 1.37 C ATOM 1900 CD ARG A 164 4.348 -26.802 -4.015 1.00 1.33 C ATOM 1901 NE ARG A 164 4.626 -28.123 -4.574 1.00 1.94 N ATOM 1902 CZ ARG A 164 5.849 -28.574 -4.845 1.00 2.38 C ATOM 1903 NH1 ARG A 164 6.915 -27.816 -4.611 1.00 2.62 N ATOM 1904 NH2 ARG A 164 6.008 -29.789 -5.351 1.00 3.20 N ATOM 0 H ARG A 164 3.626 -22.169 -5.210 1.00 0.53 H new ATOM 0 HA ARG A 164 3.415 -24.434 -6.987 1.00 0.59 H new ATOM 0 HB2 ARG A 164 3.787 -23.887 -4.152 1.00 0.73 H new ATOM 0 HB3 ARG A 164 2.521 -25.079 -4.373 1.00 0.73 H new ATOM 0 HG2 ARG A 164 4.324 -26.141 -6.057 1.00 1.37 H new ATOM 0 HG3 ARG A 164 5.439 -25.259 -5.032 1.00 1.37 H new ATOM 0 HD2 ARG A 164 5.051 -26.595 -3.208 1.00 1.33 H new ATOM 0 HD3 ARG A 164 3.350 -26.796 -3.577 1.00 1.33 H new ATOM 0 HE ARG A 164 3.835 -28.737 -4.768 1.00 1.94 H new ATOM 0 HH11 ARG A 164 6.800 -26.881 -4.221 1.00 2.62 H new ATOM 0 HH12 ARG A 164 7.848 -28.170 -4.822 1.00 2.62 H new ATOM 0 HH21 ARG A 164 5.194 -30.377 -5.532 1.00 3.20 H new ATOM 0 HH22 ARG A 164 6.944 -30.136 -5.559 1.00 3.20 H new ATOM 1918 N GLU A 165 0.729 -23.693 -5.206 1.00 0.72 N ATOM 1919 CA GLU A 165 -0.729 -23.733 -5.220 1.00 0.68 C ATOM 1920 C GLU A 165 -1.302 -23.227 -3.900 1.00 0.64 C ATOM 1921 O GLU A 165 -1.954 -23.971 -3.168 1.00 0.91 O ATOM 1922 CB GLU A 165 -1.217 -25.158 -5.486 1.00 0.80 C ATOM 1923 CG GLU A 165 -2.541 -25.220 -6.229 1.00 0.88 C ATOM 1924 CD GLU A 165 -2.760 -26.551 -6.921 1.00 1.58 C ATOM 1925 OE1 GLU A 165 -1.790 -27.088 -7.496 1.00 2.20 O ATOM 1926 OE2 GLU A 165 -3.901 -27.057 -6.887 1.00 2.34 O ATOM 0 H GLU A 165 1.135 -23.407 -4.315 1.00 0.72 H new ATOM 0 HA GLU A 165 -1.077 -23.080 -6.020 1.00 0.68 H new ATOM 0 HB2 GLU A 165 -0.461 -25.690 -6.063 1.00 0.80 H new ATOM 0 HB3 GLU A 165 -1.319 -25.681 -4.535 1.00 0.80 H new ATOM 0 HG2 GLU A 165 -3.356 -25.041 -5.527 1.00 0.88 H new ATOM 0 HG3 GLU A 165 -2.576 -24.420 -6.969 1.00 0.88 H new ATOM 1933 N MET A 166 -1.055 -21.956 -3.602 1.00 0.56 N ATOM 1934 CA MET A 166 -1.547 -21.349 -2.371 1.00 0.50 C ATOM 1935 C MET A 166 -1.815 -19.860 -2.569 1.00 0.43 C ATOM 1936 O MET A 166 -1.473 -19.037 -1.722 1.00 0.47 O ATOM 1937 CB MET A 166 -0.539 -21.553 -1.239 1.00 0.54 C ATOM 1938 CG MET A 166 -0.443 -22.992 -0.760 1.00 0.72 C ATOM 1939 SD MET A 166 0.860 -23.917 -1.594 1.00 1.42 S ATOM 1940 CE MET A 166 0.861 -25.435 -0.644 1.00 1.36 C ATOM 0 H MET A 166 -0.517 -21.326 -4.197 1.00 0.56 H new ATOM 0 HA MET A 166 -2.485 -21.836 -2.104 1.00 0.50 H new ATOM 0 HB2 MET A 166 0.444 -21.225 -1.576 1.00 0.54 H new ATOM 0 HB3 MET A 166 -0.816 -20.917 -0.398 1.00 0.54 H new ATOM 0 HG2 MET A 166 -0.259 -23.002 0.314 1.00 0.72 H new ATOM 0 HG3 MET A 166 -1.399 -23.490 -0.924 1.00 0.72 H new ATOM 0 HE1 MET A 166 1.618 -26.112 -1.041 1.00 1.36 H new ATOM 0 HE2 MET A 166 1.085 -25.211 0.399 1.00 1.36 H new ATOM 0 HE3 MET A 166 -0.119 -25.907 -0.711 1.00 1.36 H new ATOM 1950 N SER A 167 -2.425 -19.524 -3.698 1.00 0.49 N ATOM 1951 CA SER A 167 -2.738 -18.135 -4.017 1.00 0.50 C ATOM 1952 C SER A 167 -3.401 -17.430 -2.836 1.00 0.46 C ATOM 1953 O SER A 167 -2.947 -16.372 -2.400 1.00 0.46 O ATOM 1954 CB SER A 167 -3.646 -18.064 -5.246 1.00 0.63 C ATOM 1955 OG SER A 167 -2.940 -17.583 -6.376 1.00 1.57 O ATOM 0 H SER A 167 -2.714 -20.195 -4.410 1.00 0.49 H new ATOM 0 HA SER A 167 -1.800 -17.623 -4.234 1.00 0.50 H new ATOM 0 HB2 SER A 167 -4.051 -19.053 -5.460 1.00 0.63 H new ATOM 0 HB3 SER A 167 -4.494 -17.411 -5.038 1.00 0.63 H new ATOM 0 HG SER A 167 -3.278 -16.696 -6.619 1.00 1.57 H new ATOM 1961 N PRO A 168 -4.490 -18.006 -2.303 1.00 0.50 N ATOM 1962 CA PRO A 168 -5.218 -17.425 -1.170 1.00 0.51 C ATOM 1963 C PRO A 168 -4.296 -17.021 -0.023 1.00 0.45 C ATOM 1964 O PRO A 168 -4.602 -16.101 0.736 1.00 0.45 O ATOM 1965 CB PRO A 168 -6.147 -18.558 -0.732 1.00 0.60 C ATOM 1966 CG PRO A 168 -6.372 -19.359 -1.967 1.00 0.71 C ATOM 1967 CD PRO A 168 -5.099 -19.267 -2.765 1.00 0.58 C ATOM 0 HA PRO A 168 -5.736 -16.508 -1.449 1.00 0.51 H new ATOM 0 HB2 PRO A 168 -5.693 -19.161 0.054 1.00 0.60 H new ATOM 0 HB3 PRO A 168 -7.085 -18.170 -0.335 1.00 0.60 H new ATOM 0 HG2 PRO A 168 -6.604 -20.395 -1.722 1.00 0.71 H new ATOM 0 HG3 PRO A 168 -7.217 -18.969 -2.535 1.00 0.71 H new ATOM 0 HD2 PRO A 168 -4.446 -20.120 -2.578 1.00 0.58 H new ATOM 0 HD3 PRO A 168 -5.298 -19.247 -3.836 1.00 0.58 H new ATOM 1975 N LEU A 169 -3.170 -17.716 0.102 1.00 0.44 N ATOM 1976 CA LEU A 169 -2.208 -17.431 1.162 1.00 0.41 C ATOM 1977 C LEU A 169 -1.862 -15.944 1.213 1.00 0.37 C ATOM 1978 O LEU A 169 -1.628 -15.392 2.288 1.00 0.36 O ATOM 1979 CB LEU A 169 -0.938 -18.260 0.961 1.00 0.44 C ATOM 1980 CG LEU A 169 -0.174 -18.600 2.241 1.00 0.64 C ATOM 1981 CD1 LEU A 169 0.580 -19.911 2.080 1.00 1.26 C ATOM 1982 CD2 LEU A 169 0.781 -17.475 2.606 1.00 1.71 C ATOM 0 H LEU A 169 -2.901 -18.481 -0.517 1.00 0.44 H new ATOM 0 HA LEU A 169 -2.666 -17.704 2.113 1.00 0.41 H new ATOM 0 HB2 LEU A 169 -1.206 -19.190 0.459 1.00 0.44 H new ATOM 0 HB3 LEU A 169 -0.271 -17.717 0.292 1.00 0.44 H new ATOM 0 HG LEU A 169 -0.894 -18.716 3.051 1.00 0.64 H new ATOM 0 HD11 LEU A 169 1.118 -20.137 3.001 1.00 1.26 H new ATOM 0 HD12 LEU A 169 -0.126 -20.713 1.866 1.00 1.26 H new ATOM 0 HD13 LEU A 169 1.290 -19.824 1.257 1.00 1.26 H new ATOM 0 HD21 LEU A 169 1.316 -17.734 3.519 1.00 1.71 H new ATOM 0 HD22 LEU A 169 1.496 -17.327 1.796 1.00 1.71 H new ATOM 0 HD23 LEU A 169 0.217 -16.556 2.764 1.00 1.71 H new ATOM 1994 N VAL A 170 -1.835 -15.297 0.050 1.00 0.36 N ATOM 1995 CA VAL A 170 -1.522 -13.876 -0.022 1.00 0.36 C ATOM 1996 C VAL A 170 -2.353 -13.089 0.985 1.00 0.35 C ATOM 1997 O VAL A 170 -1.905 -12.073 1.515 1.00 0.35 O ATOM 1998 CB VAL A 170 -1.772 -13.311 -1.432 1.00 0.40 C ATOM 1999 CG1 VAL A 170 -1.129 -14.200 -2.484 1.00 0.43 C ATOM 2000 CG2 VAL A 170 -3.263 -13.159 -1.689 1.00 0.40 C ATOM 0 H VAL A 170 -2.026 -15.734 -0.851 1.00 0.36 H new ATOM 0 HA VAL A 170 -0.463 -13.770 0.214 1.00 0.36 H new ATOM 0 HB VAL A 170 -1.314 -12.324 -1.496 1.00 0.40 H new ATOM 0 HG11 VAL A 170 -1.316 -13.785 -3.475 1.00 0.43 H new ATOM 0 HG12 VAL A 170 -0.054 -14.252 -2.309 1.00 0.43 H new ATOM 0 HG13 VAL A 170 -1.555 -15.202 -2.424 1.00 0.43 H new ATOM 0 HG21 VAL A 170 -3.421 -12.758 -2.690 1.00 0.40 H new ATOM 0 HG22 VAL A 170 -3.747 -14.132 -1.607 1.00 0.40 H new ATOM 0 HG23 VAL A 170 -3.691 -12.477 -0.954 1.00 0.40 H new ATOM 2010 N ASP A 171 -3.561 -13.575 1.254 1.00 0.35 N ATOM 2011 CA ASP A 171 -4.447 -12.925 2.209 1.00 0.37 C ATOM 2012 C ASP A 171 -3.871 -13.036 3.614 1.00 0.35 C ATOM 2013 O ASP A 171 -3.736 -12.039 4.324 1.00 0.36 O ATOM 2014 CB ASP A 171 -5.840 -13.556 2.160 1.00 0.42 C ATOM 2015 CG ASP A 171 -6.936 -12.564 2.495 1.00 0.94 C ATOM 2016 OD1 ASP A 171 -6.658 -11.601 3.241 1.00 1.53 O ATOM 2017 OD2 ASP A 171 -8.073 -12.749 2.011 1.00 1.72 O ATOM 0 H ASP A 171 -3.947 -14.416 0.824 1.00 0.35 H new ATOM 0 HA ASP A 171 -4.533 -11.871 1.943 1.00 0.37 H new ATOM 0 HB2 ASP A 171 -6.016 -13.965 1.165 1.00 0.42 H new ATOM 0 HB3 ASP A 171 -5.883 -14.391 2.860 1.00 0.42 H new ATOM 2022 N ASN A 172 -3.519 -14.257 4.003 1.00 0.34 N ATOM 2023 CA ASN A 172 -2.941 -14.503 5.318 1.00 0.34 C ATOM 2024 C ASN A 172 -1.636 -13.730 5.482 1.00 0.31 C ATOM 2025 O ASN A 172 -1.264 -13.348 6.591 1.00 0.32 O ATOM 2026 CB ASN A 172 -2.693 -15.999 5.520 1.00 0.37 C ATOM 2027 CG ASN A 172 -3.957 -16.751 5.886 1.00 0.99 C ATOM 2028 OD1 ASN A 172 -5.057 -16.371 5.486 1.00 1.96 O ATOM 2029 ND2 ASN A 172 -3.806 -17.825 6.653 1.00 1.44 N ATOM 0 H ASN A 172 -3.624 -15.091 3.426 1.00 0.34 H new ATOM 0 HA ASN A 172 -3.648 -14.159 6.073 1.00 0.34 H new ATOM 0 HB2 ASN A 172 -2.274 -16.421 4.607 1.00 0.37 H new ATOM 0 HB3 ASN A 172 -1.950 -16.138 6.306 1.00 0.37 H new ATOM 0 HD21 ASN A 172 -4.621 -18.370 6.933 1.00 1.44 H new ATOM 0 HD22 ASN A 172 -2.875 -18.104 6.962 1.00 1.44 H new ATOM 2036 N ILE A 173 -0.948 -13.496 4.367 1.00 0.32 N ATOM 2037 CA ILE A 173 0.308 -12.759 4.390 1.00 0.30 C ATOM 2038 C ILE A 173 0.054 -11.287 4.685 1.00 0.29 C ATOM 2039 O ILE A 173 0.517 -10.763 5.698 1.00 0.28 O ATOM 2040 CB ILE A 173 1.065 -12.896 3.053 1.00 0.33 C ATOM 2041 CG1 ILE A 173 1.461 -14.355 2.804 1.00 0.47 C ATOM 2042 CG2 ILE A 173 2.293 -11.998 3.046 1.00 0.49 C ATOM 2043 CD1 ILE A 173 1.915 -15.087 4.048 1.00 0.39 C ATOM 0 H ILE A 173 -1.240 -13.806 3.440 1.00 0.32 H new ATOM 0 HA ILE A 173 0.926 -13.186 5.180 1.00 0.30 H new ATOM 0 HB ILE A 173 0.402 -12.581 2.247 1.00 0.33 H new ATOM 0 HG12 ILE A 173 0.611 -14.884 2.373 1.00 0.47 H new ATOM 0 HG13 ILE A 173 2.262 -14.383 2.065 1.00 0.47 H new ATOM 0 HG21 ILE A 173 2.817 -12.105 2.096 1.00 0.49 H new ATOM 0 HG22 ILE A 173 1.986 -10.960 3.175 1.00 0.49 H new ATOM 0 HG23 ILE A 173 2.958 -12.284 3.861 1.00 0.49 H new ATOM 0 HD11 ILE A 173 2.178 -16.113 3.791 1.00 0.39 H new ATOM 0 HD12 ILE A 173 2.785 -14.584 4.469 1.00 0.39 H new ATOM 0 HD13 ILE A 173 1.109 -15.092 4.782 1.00 0.39 H new ATOM 2055 N ALA A 174 -0.696 -10.629 3.804 1.00 0.32 N ATOM 2056 CA ALA A 174 -1.026 -9.221 3.988 1.00 0.33 C ATOM 2057 C ALA A 174 -1.521 -8.980 5.409 1.00 0.31 C ATOM 2058 O ALA A 174 -1.284 -7.924 5.995 1.00 0.31 O ATOM 2059 CB ALA A 174 -2.078 -8.787 2.978 1.00 0.38 C ATOM 0 H ALA A 174 -1.085 -11.048 2.959 1.00 0.32 H new ATOM 0 HA ALA A 174 -0.127 -8.626 3.826 1.00 0.33 H new ATOM 0 HB1 ALA A 174 -2.314 -7.733 3.128 1.00 0.38 H new ATOM 0 HB2 ALA A 174 -1.695 -8.933 1.968 1.00 0.38 H new ATOM 0 HB3 ALA A 174 -2.980 -9.384 3.113 1.00 0.38 H new ATOM 2065 N LEU A 175 -2.200 -9.982 5.959 1.00 0.30 N ATOM 2066 CA LEU A 175 -2.724 -9.907 7.314 1.00 0.30 C ATOM 2067 C LEU A 175 -1.589 -9.713 8.313 1.00 0.28 C ATOM 2068 O LEU A 175 -1.529 -8.703 9.015 1.00 0.29 O ATOM 2069 CB LEU A 175 -3.500 -11.187 7.640 1.00 0.32 C ATOM 2070 CG LEU A 175 -3.893 -11.366 9.107 1.00 0.37 C ATOM 2071 CD1 LEU A 175 -5.056 -10.456 9.454 1.00 0.54 C ATOM 2072 CD2 LEU A 175 -4.249 -12.818 9.388 1.00 0.36 C ATOM 0 H LEU A 175 -2.400 -10.861 5.481 1.00 0.30 H new ATOM 0 HA LEU A 175 -3.397 -9.052 7.385 1.00 0.30 H new ATOM 0 HB2 LEU A 175 -4.406 -11.205 7.035 1.00 0.32 H new ATOM 0 HB3 LEU A 175 -2.897 -12.043 7.337 1.00 0.32 H new ATOM 0 HG LEU A 175 -3.042 -11.094 9.732 1.00 0.37 H new ATOM 0 HD11 LEU A 175 -5.326 -10.593 10.501 1.00 0.54 H new ATOM 0 HD12 LEU A 175 -4.768 -9.418 9.287 1.00 0.54 H new ATOM 0 HD13 LEU A 175 -5.911 -10.702 8.824 1.00 0.54 H new ATOM 0 HD21 LEU A 175 -4.526 -12.928 10.436 1.00 0.36 H new ATOM 0 HD22 LEU A 175 -5.087 -13.116 8.758 1.00 0.36 H new ATOM 0 HD23 LEU A 175 -3.389 -13.452 9.172 1.00 0.36 H new ATOM 2084 N TRP A 176 -0.688 -10.688 8.367 1.00 0.26 N ATOM 2085 CA TRP A 176 0.450 -10.629 9.276 1.00 0.25 C ATOM 2086 C TRP A 176 1.271 -9.370 9.027 1.00 0.24 C ATOM 2087 O TRP A 176 1.636 -8.659 9.964 1.00 0.23 O ATOM 2088 CB TRP A 176 1.332 -11.868 9.111 1.00 0.27 C ATOM 2089 CG TRP A 176 0.553 -13.146 9.038 1.00 0.27 C ATOM 2090 CD1 TRP A 176 -0.640 -13.412 9.645 1.00 0.28 C ATOM 2091 CD2 TRP A 176 0.912 -14.330 8.318 1.00 0.29 C ATOM 2092 NE1 TRP A 176 -1.045 -14.691 9.347 1.00 0.31 N ATOM 2093 CE2 TRP A 176 -0.109 -15.275 8.534 1.00 0.32 C ATOM 2094 CE3 TRP A 176 1.997 -14.684 7.511 1.00 0.30 C ATOM 2095 CZ2 TRP A 176 -0.076 -16.549 7.973 1.00 0.36 C ATOM 2096 CZ3 TRP A 176 2.029 -15.949 6.955 1.00 0.34 C ATOM 2097 CH2 TRP A 176 0.998 -16.868 7.187 1.00 0.37 C ATOM 0 H TRP A 176 -0.724 -11.529 7.791 1.00 0.26 H new ATOM 0 HA TRP A 176 0.068 -10.602 10.297 1.00 0.25 H new ATOM 0 HB2 TRP A 176 1.929 -11.762 8.205 1.00 0.27 H new ATOM 0 HB3 TRP A 176 2.029 -11.923 9.947 1.00 0.27 H new ATOM 0 HD1 TRP A 176 -1.186 -12.719 10.268 1.00 0.28 H new ATOM 0 HE1 TRP A 176 -1.903 -15.134 9.677 1.00 0.31 H new ATOM 0 HE3 TRP A 176 2.796 -13.982 7.325 1.00 0.30 H new ATOM 0 HZ2 TRP A 176 -0.869 -17.260 8.152 1.00 0.36 H new ATOM 0 HZ3 TRP A 176 2.863 -16.234 6.331 1.00 0.34 H new ATOM 0 HH2 TRP A 176 1.052 -17.848 6.737 1.00 0.37 H new ATOM 2108 N MET A 177 1.553 -9.097 7.758 1.00 0.26 N ATOM 2109 CA MET A 177 2.324 -7.917 7.387 1.00 0.26 C ATOM 2110 C MET A 177 1.755 -6.678 8.068 1.00 0.25 C ATOM 2111 O MET A 177 2.494 -5.778 8.467 1.00 0.26 O ATOM 2112 CB MET A 177 2.315 -7.729 5.869 1.00 0.32 C ATOM 2113 CG MET A 177 2.991 -8.860 5.112 1.00 0.86 C ATOM 2114 SD MET A 177 2.806 -8.706 3.325 1.00 1.59 S ATOM 2115 CE MET A 177 3.759 -7.222 3.012 1.00 1.18 C ATOM 0 H MET A 177 1.260 -9.675 6.971 1.00 0.26 H new ATOM 0 HA MET A 177 3.353 -8.060 7.717 1.00 0.26 H new ATOM 0 HB2 MET A 177 1.283 -7.641 5.528 1.00 0.32 H new ATOM 0 HB3 MET A 177 2.813 -6.791 5.625 1.00 0.32 H new ATOM 0 HG2 MET A 177 4.051 -8.878 5.364 1.00 0.86 H new ATOM 0 HG3 MET A 177 2.570 -9.812 5.436 1.00 0.86 H new ATOM 0 HE1 MET A 177 3.935 -7.122 1.941 1.00 1.18 H new ATOM 0 HE2 MET A 177 3.208 -6.353 3.372 1.00 1.18 H new ATOM 0 HE3 MET A 177 4.715 -7.287 3.532 1.00 1.18 H new ATOM 2125 N THR A 178 0.434 -6.644 8.201 1.00 0.27 N ATOM 2126 CA THR A 178 -0.244 -5.523 8.836 1.00 0.29 C ATOM 2127 C THR A 178 -0.032 -5.547 10.347 1.00 0.27 C ATOM 2128 O THR A 178 0.134 -4.504 10.979 1.00 0.29 O ATOM 2129 CB THR A 178 -1.739 -5.563 8.519 1.00 0.33 C ATOM 2130 OG1 THR A 178 -2.164 -4.340 7.945 1.00 0.48 O ATOM 2131 CG2 THR A 178 -2.602 -5.825 9.735 1.00 0.31 C ATOM 0 H THR A 178 -0.189 -7.383 7.876 1.00 0.27 H new ATOM 0 HA THR A 178 0.181 -4.600 8.442 1.00 0.29 H new ATOM 0 HB THR A 178 -1.863 -6.390 7.820 1.00 0.33 H new ATOM 0 HG1 THR A 178 -2.712 -3.848 8.592 1.00 0.48 H new ATOM 0 HG21 THR A 178 -3.651 -5.841 9.440 1.00 0.31 H new ATOM 0 HG22 THR A 178 -2.333 -6.787 10.171 1.00 0.31 H new ATOM 0 HG23 THR A 178 -2.444 -5.036 10.470 1.00 0.31 H new ATOM 2139 N GLU A 179 -0.047 -6.747 10.919 1.00 0.25 N ATOM 2140 CA GLU A 179 0.135 -6.916 12.356 1.00 0.26 C ATOM 2141 C GLU A 179 1.506 -6.421 12.806 1.00 0.25 C ATOM 2142 O GLU A 179 1.608 -5.594 13.711 1.00 0.29 O ATOM 2143 CB GLU A 179 -0.040 -8.386 12.742 1.00 0.31 C ATOM 2144 CG GLU A 179 -1.485 -8.781 12.994 1.00 0.50 C ATOM 2145 CD GLU A 179 -1.764 -9.066 14.457 1.00 0.82 C ATOM 2146 OE1 GLU A 179 -1.282 -8.295 15.314 1.00 1.62 O ATOM 2147 OE2 GLU A 179 -2.462 -10.060 14.745 1.00 1.23 O ATOM 0 H GLU A 179 -0.184 -7.619 10.407 1.00 0.25 H new ATOM 0 HA GLU A 179 -0.624 -6.317 12.860 1.00 0.26 H new ATOM 0 HB2 GLU A 179 0.366 -9.012 11.948 1.00 0.31 H new ATOM 0 HB3 GLU A 179 0.545 -8.590 13.639 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -2.142 -7.981 12.652 1.00 0.50 H new ATOM 0 HG3 GLU A 179 -1.725 -9.665 12.403 1.00 0.50 H new ATOM 2154 N TYR A 180 2.557 -6.934 12.176 1.00 0.25 N ATOM 2155 CA TYR A 180 3.909 -6.539 12.524 1.00 0.26 C ATOM 2156 C TYR A 180 4.138 -5.068 12.202 1.00 0.26 C ATOM 2157 O TYR A 180 4.507 -4.282 13.075 1.00 0.28 O ATOM 2158 CB TYR A 180 4.928 -7.403 11.784 1.00 0.28 C ATOM 2159 CG TYR A 180 6.354 -7.006 12.069 1.00 0.31 C ATOM 2160 CD1 TYR A 180 6.909 -5.889 11.468 1.00 1.24 C ATOM 2161 CD2 TYR A 180 7.138 -7.741 12.946 1.00 1.12 C ATOM 2162 CE1 TYR A 180 8.211 -5.510 11.730 1.00 1.31 C ATOM 2163 CE2 TYR A 180 8.441 -7.370 13.219 1.00 1.16 C ATOM 2164 CZ TYR A 180 8.974 -6.254 12.608 1.00 0.57 C ATOM 2165 OH TYR A 180 10.271 -5.881 12.876 1.00 0.73 O ATOM 0 H TYR A 180 2.495 -7.621 11.425 1.00 0.25 H new ATOM 0 HA TYR A 180 4.040 -6.685 13.596 1.00 0.26 H new ATOM 0 HB2 TYR A 180 4.784 -8.446 12.065 1.00 0.28 H new ATOM 0 HB3 TYR A 180 4.745 -7.334 10.712 1.00 0.28 H new ATOM 0 HD1 TYR A 180 6.314 -5.304 10.783 1.00 1.24 H new ATOM 0 HD2 TYR A 180 6.724 -8.617 13.423 1.00 1.12 H new ATOM 0 HE1 TYR A 180 8.630 -4.637 11.251 1.00 1.31 H new ATOM 0 HE2 TYR A 180 9.038 -7.950 13.907 1.00 1.16 H new ATOM 0 HH TYR A 180 10.491 -5.073 12.367 1.00 0.73 H new ATOM 2175 N LEU A 181 3.928 -4.712 10.936 1.00 0.25 N ATOM 2176 CA LEU A 181 4.117 -3.340 10.474 1.00 0.28 C ATOM 2177 C LEU A 181 3.541 -2.329 11.461 1.00 0.29 C ATOM 2178 O LEU A 181 4.181 -1.327 11.779 1.00 0.31 O ATOM 2179 CB LEU A 181 3.468 -3.149 9.102 1.00 0.29 C ATOM 2180 CG LEU A 181 3.596 -1.740 8.520 1.00 0.40 C ATOM 2181 CD1 LEU A 181 3.832 -1.801 7.020 1.00 0.53 C ATOM 2182 CD2 LEU A 181 2.355 -0.919 8.833 1.00 0.64 C ATOM 0 H LEU A 181 3.625 -5.360 10.209 1.00 0.25 H new ATOM 0 HA LEU A 181 5.190 -3.165 10.397 1.00 0.28 H new ATOM 0 HB2 LEU A 181 3.914 -3.857 8.403 1.00 0.29 H new ATOM 0 HB3 LEU A 181 2.410 -3.400 9.178 1.00 0.29 H new ATOM 0 HG LEU A 181 4.455 -1.254 8.982 1.00 0.40 H new ATOM 0 HD11 LEU A 181 3.920 -0.789 6.624 1.00 0.53 H new ATOM 0 HD12 LEU A 181 4.751 -2.351 6.818 1.00 0.53 H new ATOM 0 HD13 LEU A 181 2.994 -2.306 6.540 1.00 0.53 H new ATOM 0 HD21 LEU A 181 2.464 0.080 8.411 1.00 0.64 H new ATOM 0 HD22 LEU A 181 1.480 -1.403 8.399 1.00 0.64 H new ATOM 0 HD23 LEU A 181 2.230 -0.845 9.913 1.00 0.64 H new ATOM 2194 N ASN A 182 2.331 -2.591 11.941 1.00 0.30 N ATOM 2195 CA ASN A 182 1.680 -1.692 12.888 1.00 0.33 C ATOM 2196 C ASN A 182 2.216 -1.896 14.301 1.00 0.35 C ATOM 2197 O ASN A 182 2.327 -0.950 15.080 1.00 0.38 O ATOM 2198 CB ASN A 182 0.165 -1.909 12.867 1.00 0.37 C ATOM 2199 CG ASN A 182 -0.533 -1.225 14.026 1.00 1.07 C ATOM 2200 OD1 ASN A 182 -0.089 -0.182 14.506 1.00 1.63 O ATOM 2201 ND2 ASN A 182 -1.635 -1.811 14.482 1.00 1.81 N ATOM 0 H ASN A 182 1.783 -3.414 11.692 1.00 0.30 H new ATOM 0 HA ASN A 182 1.901 -0.668 12.585 1.00 0.33 H new ATOM 0 HB2 ASN A 182 -0.240 -1.531 11.928 1.00 0.37 H new ATOM 0 HB3 ASN A 182 -0.047 -2.978 12.899 1.00 0.37 H new ATOM 0 HD21 ASN A 182 -2.148 -1.397 15.260 1.00 1.81 H new ATOM 0 HD22 ASN A 182 -1.967 -2.675 14.054 1.00 1.81 H new ATOM 2208 N ARG A 183 2.531 -3.140 14.630 1.00 0.35 N ATOM 2209 CA ARG A 183 3.039 -3.481 15.953 1.00 0.39 C ATOM 2210 C ARG A 183 4.468 -2.980 16.180 1.00 0.45 C ATOM 2211 O ARG A 183 4.989 -3.091 17.290 1.00 0.70 O ATOM 2212 CB ARG A 183 2.989 -4.995 16.157 1.00 0.39 C ATOM 2213 CG ARG A 183 1.620 -5.510 16.567 1.00 0.50 C ATOM 2214 CD ARG A 183 1.644 -6.102 17.967 1.00 0.98 C ATOM 2215 NE ARG A 183 0.319 -6.538 18.399 1.00 1.69 N ATOM 2216 CZ ARG A 183 0.073 -7.117 19.573 1.00 2.22 C ATOM 2217 NH1 ARG A 183 1.057 -7.333 20.439 1.00 2.50 N ATOM 2218 NH2 ARG A 183 -1.163 -7.481 19.884 1.00 3.07 N ATOM 0 H ARG A 183 2.444 -3.934 13.996 1.00 0.35 H new ATOM 0 HA ARG A 183 2.398 -2.982 16.680 1.00 0.39 H new ATOM 0 HB2 ARG A 183 3.291 -5.488 15.233 1.00 0.39 H new ATOM 0 HB3 ARG A 183 3.716 -5.274 16.920 1.00 0.39 H new ATOM 0 HG2 ARG A 183 0.897 -4.695 16.528 1.00 0.50 H new ATOM 0 HG3 ARG A 183 1.287 -6.267 15.857 1.00 0.50 H new ATOM 0 HD2 ARG A 183 2.330 -6.949 17.991 1.00 0.98 H new ATOM 0 HD3 ARG A 183 2.028 -5.361 18.668 1.00 0.98 H new ATOM 0 HE ARG A 183 -0.465 -6.390 17.764 1.00 1.69 H new ATOM 0 HH11 ARG A 183 2.011 -7.055 20.207 1.00 2.50 H new ATOM 0 HH12 ARG A 183 0.859 -7.777 21.336 1.00 2.50 H new ATOM 0 HH21 ARG A 183 -1.924 -7.318 19.225 1.00 3.07 H new ATOM 0 HH22 ARG A 183 -1.353 -7.925 20.783 1.00 3.07 H new ATOM 2232 N HIS A 184 5.117 -2.452 15.141 1.00 0.39 N ATOM 2233 CA HIS A 184 6.493 -1.981 15.293 1.00 0.48 C ATOM 2234 C HIS A 184 6.799 -0.723 14.474 1.00 0.41 C ATOM 2235 O HIS A 184 7.573 0.126 14.916 1.00 0.40 O ATOM 2236 CB HIS A 184 7.466 -3.094 14.904 1.00 0.65 C ATOM 2237 CG HIS A 184 7.191 -4.394 15.594 1.00 0.70 C ATOM 2238 ND1 HIS A 184 6.486 -5.479 15.192 1.00 0.97 N flip ATOM 2239 CD2 HIS A 184 7.658 -4.689 16.857 1.00 0.62 C flip ATOM 2240 CE1 HIS A 184 6.542 -6.399 16.210 1.00 0.96 C flip ATOM 2241 NE2 HIS A 184 7.254 -5.899 17.202 1.00 0.73 N flip ATOM 0 H HIS A 184 4.723 -2.341 14.207 1.00 0.39 H new ATOM 0 HA HIS A 184 6.616 -1.712 16.342 1.00 0.48 H new ATOM 0 HB2 HIS A 184 7.419 -3.247 13.826 1.00 0.65 H new ATOM 0 HB3 HIS A 184 8.482 -2.776 15.137 1.00 0.65 H new ATOM 0 HD1 HIS A 184 6.004 -5.591 14.300 1.00 0.97 H new ATOM 0 HD2 HIS A 184 8.260 -4.034 17.469 1.00 0.62 H new ATOM 0 HE1 HIS A 184 6.078 -7.374 16.200 1.00 0.96 H new ATOM 2249 N LEU A 185 6.223 -0.603 13.280 1.00 0.39 N ATOM 2250 CA LEU A 185 6.489 0.555 12.432 1.00 0.37 C ATOM 2251 C LEU A 185 5.517 1.698 12.703 1.00 0.39 C ATOM 2252 O LEU A 185 5.933 2.850 12.806 1.00 0.72 O ATOM 2253 CB LEU A 185 6.434 0.159 10.956 1.00 0.38 C ATOM 2254 CG LEU A 185 7.048 -1.204 10.631 1.00 0.35 C ATOM 2255 CD1 LEU A 185 6.925 -1.504 9.145 1.00 0.44 C ATOM 2256 CD2 LEU A 185 8.504 -1.249 11.066 1.00 0.53 C ATOM 0 H LEU A 185 5.577 -1.285 12.882 1.00 0.39 H new ATOM 0 HA LEU A 185 7.491 0.909 12.674 1.00 0.37 H new ATOM 0 HB2 LEU A 185 5.393 0.158 10.634 1.00 0.38 H new ATOM 0 HB3 LEU A 185 6.948 0.922 10.371 1.00 0.38 H new ATOM 0 HG LEU A 185 6.500 -1.969 11.182 1.00 0.35 H new ATOM 0 HD11 LEU A 185 7.367 -2.477 8.933 1.00 0.44 H new ATOM 0 HD12 LEU A 185 5.873 -1.514 8.862 1.00 0.44 H new ATOM 0 HD13 LEU A 185 7.447 -0.736 8.574 1.00 0.44 H new ATOM 0 HD21 LEU A 185 8.925 -2.226 10.827 1.00 0.53 H new ATOM 0 HD22 LEU A 185 9.064 -0.474 10.542 1.00 0.53 H new ATOM 0 HD23 LEU A 185 8.568 -1.079 12.141 1.00 0.53 H new ATOM 2268 N HIS A 186 4.226 1.385 12.802 1.00 0.38 N ATOM 2269 CA HIS A 186 3.211 2.409 13.047 1.00 0.40 C ATOM 2270 C HIS A 186 3.641 3.348 14.170 1.00 0.37 C ATOM 2271 O HIS A 186 3.304 4.532 14.164 1.00 0.47 O ATOM 2272 CB HIS A 186 1.864 1.767 13.386 1.00 0.51 C ATOM 2273 CG HIS A 186 0.814 2.752 13.800 1.00 0.66 C ATOM 2274 ND1 HIS A 186 0.745 3.581 14.869 1.00 1.58 N flip ATOM 2275 CD2 HIS A 186 -0.342 2.966 13.078 1.00 0.74 C flip ATOM 2276 CE1 HIS A 186 -0.437 4.271 14.773 1.00 1.59 C flip ATOM 2277 NE2 HIS A 186 -1.074 3.883 13.685 1.00 0.83 N flip ATOM 0 H HIS A 186 3.859 0.437 12.717 1.00 0.38 H new ATOM 0 HA HIS A 186 3.100 2.992 12.133 1.00 0.40 H new ATOM 0 HB2 HIS A 186 1.507 1.213 12.518 1.00 0.51 H new ATOM 0 HB3 HIS A 186 2.008 1.044 14.189 1.00 0.51 H new ATOM 0 HD2 HIS A 186 -0.607 2.463 12.160 1.00 0.74 H new ATOM 0 HE1 HIS A 186 -0.789 5.012 15.475 1.00 1.59 H new ATOM 0 HE2 HIS A 186 -1.978 4.232 13.367 1.00 0.83 H new ATOM 2285 N THR A 187 4.397 2.817 15.124 1.00 0.37 N ATOM 2286 CA THR A 187 4.882 3.614 16.244 1.00 0.42 C ATOM 2287 C THR A 187 6.030 4.511 15.794 1.00 0.37 C ATOM 2288 O THR A 187 6.055 5.706 16.087 1.00 0.39 O ATOM 2289 CB THR A 187 5.344 2.705 17.384 1.00 0.54 C ATOM 2290 OG1 THR A 187 4.246 2.315 18.189 1.00 1.30 O ATOM 2291 CG2 THR A 187 6.370 3.353 18.289 1.00 1.07 C ATOM 0 H THR A 187 4.687 1.839 15.144 1.00 0.37 H new ATOM 0 HA THR A 187 4.065 4.239 16.604 1.00 0.42 H new ATOM 0 HB THR A 187 5.804 1.844 16.899 1.00 0.54 H new ATOM 0 HG1 THR A 187 4.561 1.733 18.912 1.00 1.30 H new ATOM 0 HG21 THR A 187 6.654 2.654 19.076 1.00 1.07 H new ATOM 0 HG22 THR A 187 7.251 3.622 17.706 1.00 1.07 H new ATOM 0 HG23 THR A 187 5.944 4.251 18.738 1.00 1.07 H new ATOM 2299 N TRP A 188 6.976 3.918 15.074 1.00 0.34 N ATOM 2300 CA TRP A 188 8.133 4.646 14.568 1.00 0.34 C ATOM 2301 C TRP A 188 7.717 5.650 13.495 1.00 0.32 C ATOM 2302 O TRP A 188 8.361 6.683 13.312 1.00 0.40 O ATOM 2303 CB TRP A 188 9.153 3.661 13.993 1.00 0.36 C ATOM 2304 CG TRP A 188 10.442 4.303 13.578 1.00 0.38 C ATOM 2305 CD1 TRP A 188 11.633 4.251 14.242 1.00 0.43 C ATOM 2306 CD2 TRP A 188 10.670 5.092 12.405 1.00 0.43 C ATOM 2307 NE1 TRP A 188 12.588 4.960 13.554 1.00 0.49 N ATOM 2308 CE2 TRP A 188 12.022 5.486 12.423 1.00 0.49 C ATOM 2309 CE3 TRP A 188 9.864 5.504 11.340 1.00 0.46 C ATOM 2310 CZ2 TRP A 188 12.583 6.270 11.419 1.00 0.58 C ATOM 2311 CZ3 TRP A 188 10.422 6.283 10.343 1.00 0.55 C ATOM 2312 CH2 TRP A 188 11.771 6.658 10.389 1.00 0.60 C ATOM 0 H TRP A 188 6.963 2.929 14.827 1.00 0.34 H new ATOM 0 HA TRP A 188 8.585 5.195 15.394 1.00 0.34 H new ATOM 0 HB2 TRP A 188 9.363 2.893 14.737 1.00 0.36 H new ATOM 0 HB3 TRP A 188 8.714 3.158 13.131 1.00 0.36 H new ATOM 0 HD1 TRP A 188 11.801 3.729 15.172 1.00 0.43 H new ATOM 0 HE1 TRP A 188 13.560 5.076 13.839 1.00 0.49 H new ATOM 0 HE3 TRP A 188 8.823 5.219 11.296 1.00 0.46 H new ATOM 0 HZ2 TRP A 188 13.622 6.562 11.452 1.00 0.58 H new ATOM 0 HZ3 TRP A 188 9.808 6.607 9.516 1.00 0.55 H new ATOM 0 HH2 TRP A 188 12.178 7.266 9.595 1.00 0.60 H new ATOM 2323 N ILE A 189 6.638 5.332 12.786 1.00 0.37 N ATOM 2324 CA ILE A 189 6.130 6.191 11.726 1.00 0.36 C ATOM 2325 C ILE A 189 5.277 7.324 12.289 1.00 0.38 C ATOM 2326 O ILE A 189 5.540 8.499 12.033 1.00 0.39 O ATOM 2327 CB ILE A 189 5.285 5.385 10.723 1.00 0.38 C ATOM 2328 CG1 ILE A 189 6.155 4.876 9.573 1.00 0.43 C ATOM 2329 CG2 ILE A 189 4.139 6.231 10.194 1.00 0.39 C ATOM 2330 CD1 ILE A 189 5.634 3.604 8.941 1.00 0.47 C ATOM 0 H ILE A 189 6.097 4.479 12.929 1.00 0.37 H new ATOM 0 HA ILE A 189 6.996 6.614 11.218 1.00 0.36 H new ATOM 0 HB ILE A 189 4.865 4.522 11.241 1.00 0.38 H new ATOM 0 HG12 ILE A 189 6.224 5.651 8.809 1.00 0.43 H new ATOM 0 HG13 ILE A 189 7.166 4.702 9.942 1.00 0.43 H new ATOM 0 HG21 ILE A 189 3.552 5.646 9.486 1.00 0.39 H new ATOM 0 HG22 ILE A 189 3.504 6.542 11.023 1.00 0.39 H new ATOM 0 HG23 ILE A 189 4.539 7.112 9.693 1.00 0.39 H new ATOM 0 HD11 ILE A 189 6.299 3.300 8.133 1.00 0.47 H new ATOM 0 HD12 ILE A 189 5.592 2.815 9.692 1.00 0.47 H new ATOM 0 HD13 ILE A 189 4.635 3.779 8.542 1.00 0.47 H new ATOM 2342 N GLN A 190 4.250 6.963 13.053 1.00 0.43 N ATOM 2343 CA GLN A 190 3.355 7.949 13.646 1.00 0.50 C ATOM 2344 C GLN A 190 4.111 8.881 14.585 1.00 0.54 C ATOM 2345 O GLN A 190 4.100 10.100 14.408 1.00 0.68 O ATOM 2346 CB GLN A 190 2.224 7.252 14.404 1.00 0.62 C ATOM 2347 CG GLN A 190 0.956 8.084 14.506 1.00 1.25 C ATOM 2348 CD GLN A 190 0.297 7.978 15.867 1.00 1.94 C ATOM 2349 OE1 GLN A 190 0.564 7.048 16.629 1.00 2.52 O ATOM 2350 NE2 GLN A 190 -0.570 8.933 16.180 1.00 2.73 N ATOM 0 H GLN A 190 4.018 5.995 13.275 1.00 0.43 H new ATOM 0 HA GLN A 190 2.930 8.545 12.838 1.00 0.50 H new ATOM 0 HB2 GLN A 190 1.991 6.310 13.907 1.00 0.62 H new ATOM 0 HB3 GLN A 190 2.569 7.006 15.408 1.00 0.62 H new ATOM 0 HG2 GLN A 190 1.194 9.128 14.302 1.00 1.25 H new ATOM 0 HG3 GLN A 190 0.252 7.761 13.739 1.00 1.25 H new ATOM 0 HE21 GLN A 190 -0.761 9.685 15.518 1.00 2.73 H new ATOM 0 HE22 GLN A 190 -1.045 8.915 17.082 1.00 2.73 H new ATOM 2359 N ASP A 191 4.770 8.302 15.582 1.00 0.56 N ATOM 2360 CA ASP A 191 5.532 9.084 16.547 1.00 0.64 C ATOM 2361 C ASP A 191 6.451 10.074 15.838 1.00 0.68 C ATOM 2362 O ASP A 191 6.735 11.154 16.355 1.00 0.79 O ATOM 2363 CB ASP A 191 6.354 8.161 17.448 1.00 0.74 C ATOM 2364 CG ASP A 191 7.046 8.912 18.569 1.00 1.32 C ATOM 2365 OD1 ASP A 191 6.654 10.067 18.840 1.00 1.69 O ATOM 2366 OD2 ASP A 191 7.979 8.345 19.175 1.00 2.21 O ATOM 0 H ASP A 191 4.792 7.295 15.743 1.00 0.56 H new ATOM 0 HA ASP A 191 4.828 9.645 17.161 1.00 0.64 H new ATOM 0 HB2 ASP A 191 5.702 7.399 17.874 1.00 0.74 H new ATOM 0 HB3 ASP A 191 7.101 7.642 16.847 1.00 0.74 H new ATOM 2371 N ASN A 192 6.916 9.695 14.651 1.00 0.71 N ATOM 2372 CA ASN A 192 7.805 10.546 13.870 1.00 0.94 C ATOM 2373 C ASN A 192 7.103 11.078 12.624 1.00 0.82 C ATOM 2374 O ASN A 192 7.612 10.947 11.510 1.00 1.50 O ATOM 2375 CB ASN A 192 9.062 9.770 13.471 1.00 1.30 C ATOM 2376 CG ASN A 192 10.124 10.663 12.860 1.00 1.81 C ATOM 2377 OD1 ASN A 192 10.070 11.887 12.985 1.00 2.46 O ATOM 2378 ND2 ASN A 192 11.098 10.053 12.195 1.00 2.15 N ATOM 0 H ASN A 192 6.691 8.803 14.210 1.00 0.71 H new ATOM 0 HA ASN A 192 8.090 11.396 14.490 1.00 0.94 H new ATOM 0 HB2 ASN A 192 9.472 9.272 14.349 1.00 1.30 H new ATOM 0 HB3 ASN A 192 8.793 8.990 12.758 1.00 1.30 H new ATOM 0 HD21 ASN A 192 11.841 10.601 11.763 1.00 2.15 H new ATOM 0 HD22 ASN A 192 11.103 9.036 12.117 1.00 2.15 H new ATOM 2385 N GLY A 193 5.934 11.681 12.818 1.00 0.84 N ATOM 2386 CA GLY A 193 5.187 12.228 11.700 1.00 1.00 C ATOM 2387 C GLY A 193 4.030 11.341 11.277 1.00 1.03 C ATOM 2388 O GLY A 193 2.912 11.491 11.769 1.00 1.79 O ATOM 0 H GLY A 193 5.491 11.800 13.729 1.00 0.84 H new ATOM 0 HA2 GLY A 193 4.805 13.212 11.971 1.00 1.00 H new ATOM 0 HA3 GLY A 193 5.859 12.369 10.854 1.00 1.00 H new ATOM 2392 N GLY A 194 4.301 10.418 10.360 1.00 0.58 N ATOM 2393 CA GLY A 194 3.266 9.518 9.882 1.00 0.54 C ATOM 2394 C GLY A 194 3.547 9.003 8.484 1.00 0.48 C ATOM 2395 O GLY A 194 4.699 8.966 8.050 1.00 0.55 O ATOM 0 H GLY A 194 5.219 10.277 9.939 1.00 0.58 H new ATOM 0 HA2 GLY A 194 3.178 8.674 10.566 1.00 0.54 H new ATOM 0 HA3 GLY A 194 2.307 10.036 9.889 1.00 0.54 H new ATOM 2399 N TRP A 195 2.495 8.605 7.774 1.00 0.39 N ATOM 2400 CA TRP A 195 2.641 8.091 6.417 1.00 0.37 C ATOM 2401 C TRP A 195 3.078 9.198 5.463 1.00 0.35 C ATOM 2402 O TRP A 195 3.799 8.951 4.496 1.00 0.37 O ATOM 2403 CB TRP A 195 1.327 7.473 5.938 1.00 0.37 C ATOM 2404 CG TRP A 195 1.093 6.093 6.471 1.00 0.40 C ATOM 2405 CD1 TRP A 195 0.096 5.699 7.316 1.00 0.48 C ATOM 2406 CD2 TRP A 195 1.875 4.924 6.199 1.00 0.42 C ATOM 2407 NE1 TRP A 195 0.208 4.356 7.585 1.00 0.54 N ATOM 2408 CE2 TRP A 195 1.293 3.858 6.911 1.00 0.50 C ATOM 2409 CE3 TRP A 195 3.009 4.674 5.422 1.00 0.45 C ATOM 2410 CZ2 TRP A 195 1.808 2.564 6.868 1.00 0.59 C ATOM 2411 CZ3 TRP A 195 3.519 3.390 5.380 1.00 0.55 C ATOM 2412 CH2 TRP A 195 2.919 2.349 6.099 1.00 0.61 C ATOM 0 H TRP A 195 1.534 8.629 8.116 1.00 0.39 H new ATOM 0 HA TRP A 195 3.411 7.320 6.426 1.00 0.37 H new ATOM 0 HB2 TRP A 195 0.500 8.116 6.239 1.00 0.37 H new ATOM 0 HB3 TRP A 195 1.325 7.440 4.849 1.00 0.37 H new ATOM 0 HD1 TRP A 195 -0.669 6.348 7.715 1.00 0.48 H new ATOM 0 HE1 TRP A 195 -0.414 3.818 8.188 1.00 0.54 H new ATOM 0 HE3 TRP A 195 3.479 5.470 4.864 1.00 0.45 H new ATOM 0 HZ2 TRP A 195 1.347 1.760 7.422 1.00 0.59 H new ATOM 0 HZ3 TRP A 195 4.395 3.186 4.782 1.00 0.55 H new ATOM 0 HH2 TRP A 195 3.342 1.357 6.045 1.00 0.61 H new ATOM 2423 N ASP A 196 2.645 10.422 5.748 1.00 0.36 N ATOM 2424 CA ASP A 196 3.000 11.571 4.924 1.00 0.37 C ATOM 2425 C ASP A 196 4.452 11.980 5.161 1.00 0.34 C ATOM 2426 O ASP A 196 5.093 12.564 4.288 1.00 0.37 O ATOM 2427 CB ASP A 196 2.071 12.748 5.224 1.00 0.42 C ATOM 2428 CG ASP A 196 2.549 14.038 4.586 1.00 1.25 C ATOM 2429 OD1 ASP A 196 3.527 14.625 5.094 1.00 2.08 O ATOM 2430 OD2 ASP A 196 1.944 14.461 3.578 1.00 1.93 O ATOM 0 H ASP A 196 2.047 10.643 6.544 1.00 0.36 H new ATOM 0 HA ASP A 196 2.886 11.286 3.878 1.00 0.37 H new ATOM 0 HB2 ASP A 196 1.068 12.517 4.864 1.00 0.42 H new ATOM 0 HB3 ASP A 196 1.998 12.884 6.303 1.00 0.42 H new ATOM 2435 N ALA A 197 4.967 11.662 6.347 1.00 0.31 N ATOM 2436 CA ALA A 197 6.343 11.992 6.691 1.00 0.30 C ATOM 2437 C ALA A 197 7.309 11.419 5.659 1.00 0.26 C ATOM 2438 O ALA A 197 8.335 12.024 5.349 1.00 0.29 O ATOM 2439 CB ALA A 197 6.679 11.473 8.081 1.00 0.34 C ATOM 0 H ALA A 197 4.452 11.178 7.082 1.00 0.31 H new ATOM 0 HA ALA A 197 6.447 13.077 6.690 1.00 0.30 H new ATOM 0 HB1 ALA A 197 7.711 11.727 8.325 1.00 0.34 H new ATOM 0 HB2 ALA A 197 6.011 11.929 8.811 1.00 0.34 H new ATOM 0 HB3 ALA A 197 6.557 10.390 8.104 1.00 0.34 H new ATOM 2445 N PHE A 198 6.968 10.248 5.129 1.00 0.24 N ATOM 2446 CA PHE A 198 7.798 9.587 4.128 1.00 0.27 C ATOM 2447 C PHE A 198 7.579 10.197 2.746 1.00 0.34 C ATOM 2448 O PHE A 198 8.528 10.407 1.992 1.00 0.47 O ATOM 2449 CB PHE A 198 7.488 8.088 4.093 1.00 0.26 C ATOM 2450 CG PHE A 198 7.859 7.423 2.797 1.00 0.27 C ATOM 2451 CD1 PHE A 198 9.158 7.000 2.567 1.00 1.15 C ATOM 2452 CD2 PHE A 198 6.907 7.219 1.811 1.00 1.18 C ATOM 2453 CE1 PHE A 198 9.501 6.386 1.378 1.00 1.18 C ATOM 2454 CE2 PHE A 198 7.244 6.605 0.620 1.00 1.18 C ATOM 2455 CZ PHE A 198 8.543 6.188 0.403 1.00 0.38 C ATOM 0 H PHE A 198 6.121 9.737 5.377 1.00 0.24 H new ATOM 0 HA PHE A 198 8.843 9.731 4.404 1.00 0.27 H new ATOM 0 HB2 PHE A 198 8.020 7.597 4.908 1.00 0.26 H new ATOM 0 HB3 PHE A 198 6.423 7.942 4.274 1.00 0.26 H new ATOM 0 HD1 PHE A 198 9.911 7.152 3.326 1.00 1.15 H new ATOM 0 HD2 PHE A 198 5.890 7.544 1.975 1.00 1.18 H new ATOM 0 HE1 PHE A 198 10.517 6.061 1.211 1.00 1.18 H new ATOM 0 HE2 PHE A 198 6.493 6.451 -0.140 1.00 1.18 H new ATOM 0 HZ PHE A 198 8.809 5.708 -0.527 1.00 0.38 H new ATOM 2465 N VAL A 199 6.320 10.474 2.419 1.00 0.36 N ATOM 2466 CA VAL A 199 5.974 11.054 1.126 1.00 0.49 C ATOM 2467 C VAL A 199 6.614 12.426 0.935 1.00 0.50 C ATOM 2468 O VAL A 199 6.853 12.854 -0.195 1.00 0.62 O ATOM 2469 CB VAL A 199 4.449 11.190 0.958 1.00 0.59 C ATOM 2470 CG1 VAL A 199 4.001 12.610 1.268 1.00 1.02 C ATOM 2471 CG2 VAL A 199 4.032 10.787 -0.448 1.00 0.84 C ATOM 0 H VAL A 199 5.522 10.306 3.032 1.00 0.36 H new ATOM 0 HA VAL A 199 6.361 10.370 0.370 1.00 0.49 H new ATOM 0 HB VAL A 199 3.962 10.519 1.665 1.00 0.59 H new ATOM 0 HG11 VAL A 199 2.921 12.686 1.144 1.00 1.02 H new ATOM 0 HG12 VAL A 199 4.266 12.859 2.295 1.00 1.02 H new ATOM 0 HG13 VAL A 199 4.494 13.304 0.587 1.00 1.02 H new ATOM 0 HG21 VAL A 199 2.952 10.889 -0.550 1.00 0.84 H new ATOM 0 HG22 VAL A 199 4.528 11.432 -1.173 1.00 0.84 H new ATOM 0 HG23 VAL A 199 4.318 9.751 -0.629 1.00 0.84 H new ATOM 2481 N GLU A 200 6.891 13.113 2.039 1.00 0.43 N ATOM 2482 CA GLU A 200 7.504 14.435 1.979 1.00 0.49 C ATOM 2483 C GLU A 200 9.007 14.327 1.750 1.00 0.51 C ATOM 2484 O GLU A 200 9.613 15.191 1.116 1.00 0.56 O ATOM 2485 CB GLU A 200 7.226 15.210 3.269 1.00 0.57 C ATOM 2486 CG GLU A 200 6.480 16.514 3.046 1.00 1.09 C ATOM 2487 CD GLU A 200 6.525 17.426 4.256 1.00 1.48 C ATOM 2488 OE1 GLU A 200 7.616 17.578 4.845 1.00 2.04 O ATOM 2489 OE2 GLU A 200 5.469 17.989 4.615 1.00 2.06 O ATOM 0 H GLU A 200 6.701 12.777 2.983 1.00 0.43 H new ATOM 0 HA GLU A 200 7.065 14.974 1.139 1.00 0.49 H new ATOM 0 HB2 GLU A 200 6.646 14.580 3.944 1.00 0.57 H new ATOM 0 HB3 GLU A 200 8.172 15.423 3.766 1.00 0.57 H new ATOM 0 HG2 GLU A 200 6.910 17.032 2.189 1.00 1.09 H new ATOM 0 HG3 GLU A 200 5.441 16.296 2.798 1.00 1.09 H new ATOM 2496 N LEU A 201 9.603 13.258 2.269 1.00 0.51 N ATOM 2497 CA LEU A 201 11.034 13.032 2.121 1.00 0.59 C ATOM 2498 C LEU A 201 11.354 12.442 0.754 1.00 0.64 C ATOM 2499 O LEU A 201 12.452 12.625 0.230 1.00 0.74 O ATOM 2500 CB LEU A 201 11.538 12.094 3.219 1.00 0.63 C ATOM 2501 CG LEU A 201 11.500 12.672 4.632 1.00 0.82 C ATOM 2502 CD1 LEU A 201 11.358 11.561 5.660 1.00 0.84 C ATOM 2503 CD2 LEU A 201 12.751 13.495 4.901 1.00 1.31 C ATOM 0 H LEU A 201 9.115 12.534 2.796 1.00 0.51 H new ATOM 0 HA LEU A 201 11.538 13.994 2.210 1.00 0.59 H new ATOM 0 HB2 LEU A 201 10.940 11.183 3.200 1.00 0.63 H new ATOM 0 HB3 LEU A 201 12.564 11.807 2.988 1.00 0.63 H new ATOM 0 HG LEU A 201 10.632 13.326 4.715 1.00 0.82 H new ATOM 0 HD11 LEU A 201 11.333 11.992 6.661 1.00 0.84 H new ATOM 0 HD12 LEU A 201 10.434 11.013 5.478 1.00 0.84 H new ATOM 0 HD13 LEU A 201 12.206 10.880 5.580 1.00 0.84 H new ATOM 0 HD21 LEU A 201 12.709 13.900 5.912 1.00 1.31 H new ATOM 0 HD22 LEU A 201 13.632 12.861 4.800 1.00 1.31 H new ATOM 0 HD23 LEU A 201 12.809 14.314 4.184 1.00 1.31 H new ATOM 2515 N TYR A 202 10.390 11.727 0.181 1.00 0.63 N ATOM 2516 CA TYR A 202 10.579 11.109 -1.122 1.00 0.76 C ATOM 2517 C TYR A 202 9.636 11.713 -2.159 1.00 0.94 C ATOM 2518 O TYR A 202 9.255 11.053 -3.125 1.00 1.76 O ATOM 2519 CB TYR A 202 10.360 9.599 -1.023 1.00 0.88 C ATOM 2520 CG TYR A 202 11.341 8.907 -0.103 1.00 0.79 C ATOM 2521 CD1 TYR A 202 11.384 9.207 1.254 1.00 1.42 C ATOM 2522 CD2 TYR A 202 12.228 7.956 -0.592 1.00 1.42 C ATOM 2523 CE1 TYR A 202 12.281 8.579 2.096 1.00 1.50 C ATOM 2524 CE2 TYR A 202 13.128 7.323 0.244 1.00 1.43 C ATOM 2525 CZ TYR A 202 13.151 7.638 1.586 1.00 0.93 C ATOM 2526 OH TYR A 202 14.046 7.010 2.422 1.00 1.11 O ATOM 0 H TYR A 202 9.474 11.563 0.599 1.00 0.63 H new ATOM 0 HA TYR A 202 11.602 11.301 -1.445 1.00 0.76 H new ATOM 0 HB2 TYR A 202 9.346 9.409 -0.670 1.00 0.88 H new ATOM 0 HB3 TYR A 202 10.438 9.162 -2.019 1.00 0.88 H new ATOM 0 HD1 TYR A 202 10.704 9.944 1.657 1.00 1.42 H new ATOM 0 HD2 TYR A 202 12.214 7.707 -1.643 1.00 1.42 H new ATOM 0 HE1 TYR A 202 12.301 8.823 3.148 1.00 1.50 H new ATOM 0 HE2 TYR A 202 13.810 6.585 -0.152 1.00 1.43 H new ATOM 0 HH TYR A 202 14.585 6.375 1.906 1.00 1.11 H new ATOM 2536 N GLY A 203 9.267 12.975 -1.954 1.00 0.72 N ATOM 2537 CA GLY A 203 8.379 13.650 -2.879 1.00 0.78 C ATOM 2538 C GLY A 203 8.871 13.565 -4.315 1.00 1.22 C ATOM 2539 O GLY A 203 9.863 14.205 -4.662 1.00 1.90 O ATOM 0 H GLY A 203 9.569 13.541 -1.161 1.00 0.72 H new ATOM 0 HA2 GLY A 203 7.384 13.210 -2.811 1.00 0.78 H new ATOM 0 HA3 GLY A 203 8.285 14.697 -2.591 1.00 0.78 H new ATOM 2543 N PRO A 204 8.200 12.777 -5.177 1.00 1.45 N ATOM 2544 CA PRO A 204 8.591 12.621 -6.581 1.00 2.09 C ATOM 2545 C PRO A 204 8.998 13.942 -7.229 1.00 2.36 C ATOM 2546 O PRO A 204 8.656 15.016 -6.736 1.00 2.87 O ATOM 2547 CB PRO A 204 7.322 12.073 -7.227 1.00 2.52 C ATOM 2548 CG PRO A 204 6.670 11.280 -6.148 1.00 2.45 C ATOM 2549 CD PRO A 204 7.008 11.970 -4.850 1.00 1.81 C ATOM 0 HA PRO A 204 9.464 11.978 -6.696 1.00 2.09 H new ATOM 0 HB2 PRO A 204 6.674 12.877 -7.576 1.00 2.52 H new ATOM 0 HB3 PRO A 204 7.553 11.452 -8.092 1.00 2.52 H new ATOM 0 HG2 PRO A 204 5.591 11.237 -6.296 1.00 2.45 H new ATOM 0 HG3 PRO A 204 7.033 10.252 -6.148 1.00 2.45 H new ATOM 0 HD2 PRO A 204 6.185 12.595 -4.504 1.00 1.81 H new ATOM 0 HD3 PRO A 204 7.217 11.251 -4.058 1.00 1.81 H new ATOM 2557 N SER A 205 9.736 13.850 -8.331 1.00 2.78 N ATOM 2558 CA SER A 205 10.200 15.033 -9.048 1.00 3.60 C ATOM 2559 C SER A 205 9.068 16.034 -9.258 1.00 3.70 C ATOM 2560 O SER A 205 8.306 15.930 -10.219 1.00 4.30 O ATOM 2561 CB SER A 205 10.796 14.632 -10.399 1.00 4.35 C ATOM 2562 OG SER A 205 11.755 15.580 -10.835 1.00 5.09 O ATOM 0 H SER A 205 10.026 12.966 -8.748 1.00 2.78 H new ATOM 0 HA SER A 205 10.969 15.511 -8.441 1.00 3.60 H new ATOM 0 HB2 SER A 205 11.262 13.650 -10.317 1.00 4.35 H new ATOM 0 HB3 SER A 205 10.001 14.547 -11.140 1.00 4.35 H new ATOM 0 HG SER A 205 12.122 15.300 -11.699 1.00 5.09 H new ATOM 2568 N MET A 206 8.972 17.006 -8.354 1.00 3.57 N ATOM 2569 CA MET A 206 7.940 18.036 -8.432 1.00 4.08 C ATOM 2570 C MET A 206 6.574 17.427 -8.735 1.00 3.98 C ATOM 2571 O MET A 206 6.111 17.454 -9.875 1.00 4.70 O ATOM 2572 CB MET A 206 8.300 19.067 -9.504 1.00 4.52 C ATOM 2573 CG MET A 206 7.288 20.194 -9.631 1.00 5.43 C ATOM 2574 SD MET A 206 6.874 20.940 -8.042 1.00 6.00 S ATOM 2575 CE MET A 206 8.506 21.176 -7.342 1.00 6.19 C ATOM 0 H MET A 206 9.600 17.102 -7.556 1.00 3.57 H new ATOM 0 HA MET A 206 7.886 18.530 -7.462 1.00 4.08 H new ATOM 0 HB2 MET A 206 9.277 19.492 -9.274 1.00 4.52 H new ATOM 0 HB3 MET A 206 8.391 18.562 -10.466 1.00 4.52 H new ATOM 0 HG2 MET A 206 7.686 20.961 -10.295 1.00 5.43 H new ATOM 0 HG3 MET A 206 6.380 19.810 -10.095 1.00 5.43 H new ATOM 0 HE1 MET A 206 8.484 22.010 -6.641 1.00 6.19 H new ATOM 0 HE2 MET A 206 8.812 20.270 -6.819 1.00 6.19 H new ATOM 0 HE3 MET A 206 9.217 21.391 -8.140 1.00 6.19 H new ATOM 2585 N ARG A 207 5.935 16.878 -7.708 1.00 3.48 N ATOM 2586 CA ARG A 207 4.622 16.263 -7.867 1.00 4.02 C ATOM 2587 C ARG A 207 4.686 15.088 -8.837 1.00 4.54 C ATOM 2588 O ARG A 207 3.619 14.682 -9.344 1.00 4.96 O ATOM 2589 CB ARG A 207 3.610 17.296 -8.365 1.00 4.30 C ATOM 2590 CG ARG A 207 3.663 18.614 -7.609 1.00 4.81 C ATOM 2591 CD ARG A 207 3.052 19.746 -8.419 1.00 5.35 C ATOM 2592 NE ARG A 207 3.859 20.963 -8.356 1.00 6.08 N ATOM 2593 CZ ARG A 207 3.883 21.786 -7.310 1.00 6.79 C ATOM 2594 NH1 ARG A 207 3.151 21.529 -6.232 1.00 6.92 N ATOM 2595 NH2 ARG A 207 4.644 22.872 -7.340 1.00 7.63 N ATOM 2596 OXT ARG A 207 5.802 14.583 -9.081 1.00 4.95 O ATOM 0 H ARG A 207 6.304 16.846 -6.758 1.00 3.48 H new ATOM 0 HA ARG A 207 4.302 15.890 -6.894 1.00 4.02 H new ATOM 0 HB2 ARG A 207 3.789 17.486 -9.423 1.00 4.30 H new ATOM 0 HB3 ARG A 207 2.606 16.879 -8.281 1.00 4.30 H new ATOM 0 HG2 ARG A 207 3.131 18.514 -6.663 1.00 4.81 H new ATOM 0 HG3 ARG A 207 4.698 18.855 -7.368 1.00 4.81 H new ATOM 0 HD2 ARG A 207 2.948 19.433 -9.458 1.00 5.35 H new ATOM 0 HD3 ARG A 207 2.049 19.957 -8.048 1.00 5.35 H new ATOM 0 HE ARG A 207 4.439 21.196 -9.162 1.00 6.08 H new ATOM 0 HH11 ARG A 207 2.564 20.695 -6.201 1.00 6.92 H new ATOM 0 HH12 ARG A 207 3.176 22.165 -5.435 1.00 6.92 H new ATOM 0 HH21 ARG A 207 5.210 23.076 -8.164 1.00 7.63 H new ATOM 0 HH22 ARG A 207 4.663 23.503 -6.539 1.00 7.63 H new TER 2610 ARG A 207 END