USER MOD reduce.3.24.130724 H: found=0, std=0, add=1332, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1332 hydrogens (0 hets) HEADER RIBOSOME 14-JUL-99 1C05 TITLE SOLUTION STRUCTURE OF RIBOSOMAL PROTEIN S4 DELTA 41, TITLE 2 REFINED WITH DIPOLAR COUPLINGS (MINIMIZED AVERAGE TITLE 3 STRUCTURE) COMPND MOL_ID: 1; COMPND 2 MOLECULE: RIBOSOMAL PROTEIN S4 DELTA 41; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: S4 DELTA 41 (S4 RESIDUES 42-200); COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS STEAROTHERMOPHILUS; SOURCE 3 ORGANISM_TAXID: 1422; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: PET13A KEYWDS TWO SUBDOMAINS, UNIQUE TOPOLOGY, POSSIBLE HELIX-TURN-HELIX KEYWDS 2 MOTIF, RIBOSOME EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR M.A.MARKUS,R.B.GERSTNER,D.E.DRAPER,D.A.TORCHIA REVDAT 2 24-FEB-09 1C05 1 VERSN REVDAT 1 29-SEP-99 1C05 0 JRNL AUTH M.A.MARKUS,R.B.GERSTNER,D.E.DRAPER,D.A.TORCHIA JRNL TITL REFINING THE OVERALL STRUCTURE AND SUBDOMAIN JRNL TITL 2 ORIENTATION OF RIBOSOMAL PROTEIN S4 DELTA41 WITH JRNL TITL 3 DIPOLAR COUPLINGS MEASURED BY NMR IN UNIAXIAL JRNL TITL 4 LIQUID CRYSTALLINE PHASES. JRNL REF J.MOL.BIOL. V. 292 375 1999 JRNL REFN ISSN 0022-2836 JRNL PMID 10493882 JRNL DOI 10.1006/JMBI.1999.3061 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH M.A.MARKUS,R.B.GERSTNER,D.E.DRAPER,D.A.TORCHIA REMARK 1 TITL THE SOLUTION STRUCTURE OF RIBOSOMAL PROTEIN S4 REMARK 1 TITL 2 DELTA 41 REVEALS TWO SUBDOMAINS AND A POSITIVELY REMARK 1 TITL 3 CHARGED SURFACE THAT MAY INTERACT WITH RNA REMARK 1 REF EMBO J. V. 17 4559 1998 REMARK 1 REFN ISSN 0261-4189 REMARK 1 DOI 10.1093/EMBOJ/17.16.4559 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.8, 4.0 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: SUMMARY OF RESTRAINTS: 2170 NOE, 86 REMARK 3 HYDROGEN BOND, 114 DIHEDRAL ANGLE, AND 101 DIPOLAR COUPLINGS REMARK 4 REMARK 4 1C05 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 15-JUL-99. REMARK 100 THE RCSB ID CODE IS RCSB009341. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 310; 310; 310 REMARK 210 PH : 5.4; 6.0; 6.5 REMARK 210 IONIC STRENGTH : 250 MM KCL; 80 MM KCL; 300 MM REMARK 210 KCL REMARK 210 PRESSURE : 1 ATM; 1 ATM; 1 ATM REMARK 210 SAMPLE CONTENTS : 1.1 MM S4 DELTA 41, U-15N, REMARK 210 13C; 20 MM D4-ACETATE PH 5.4, REMARK 210 250 MM KCL, 0.1 MM SODIUM REMARK 210 AZIDE; 0.8 MM S4 DELTA 41, U- REMARK 210 15N; 20 MM D4-ACETATE PH 5.4, REMARK 210 250 MM KCL, 0.1 MM SODIUM REMARK 210 AZIDE; 0.45 MM S4 DELTA 41, U- REMARK 210 15N,13C; 20 MM D4-ACETATE PH REMARK 210 5.4, 250 MM KCL; 0.62 MM S4 REMARK 210 DELTA 41, 10% 13C; 20 MM D4- REMARK 210 ACETATE PH 5.4, 250 MM KCL; REMARK 210 0.10 MM S4 DELTA 41, U-15N; 7 REMARK 210 MM D4-ACETATE PH 5.4, 7 MM REMARK 210 KH2PO4 PH 6.5, 80 MM KCL, 5% REMARK 210 W/V DMPC:DHPC (3:1); 0.21 MM REMARK 210 S4 DELTA 41, U-15N, 85% 2H; REMARK 210 15N,13C,1H METHIONINE; EPSILON REMARK 210 -13C, 1H TYRSOINE; BETA,GAMMA, REMARK 210 DELTA 2H PROLINE; 10 MM KH2PO4 REMARK 210 PH 6.5, 300 MM KCL, 0.2 MM REMARK 210 SODIUM AZIDE, 2.5 MG/ML PF1 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 3D_ REMARK 210 13C-SEPARATED_NOESY, 4D_13C- REMARK 210 SEPARATED_NOESY, HNHA, IPAP REMARK 210 15N HSQC REMARK 210 SPECTROMETER FIELD STRENGTH : 750 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : DMX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : XWINNMR 2.5, NMRPIPE 1.7, REMARK 210 PIPP 4.2.8 REMARK 210 METHOD USED : HYBRID DGSA PROTOCOL WITHOUT REMARK 210 THE DIPOLAR COUPLING REMARK 210 RESTRAINTS FOLLOWED BY REMARK 210 ADDITIONAL SA WITH THE DIPOLAR REMARK 210 COUPLING RESTRAINTS ADD 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 : 1 REMARK 210 REMARK 210 REMARK: THIS STRUCTURE WAS DETERMINED WITH NOE RESTRAINTS FROM REMARK 210 MULTIDIMENSIONAL HETERONUCLEAR EXPERIMENTS, DIHEDRAL ANGLE REMARK 210 RESTRAINTS BASED ON MEASUREMENTS OF SCALAR COUPLING CONSTANTS, REMARK 210 AND DIPOLAR COUPLING RESTRAINTS MEASURED ON SAMPLES IN REMARK 210 PARTIALLY ALIGNED PHASES. REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: 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 LEU A 16 -16.45 -48.42 REMARK 500 MET A 19 -90.88 -69.63 REMARK 500 PHE A 31 -76.82 -74.00 REMARK 500 GLU A 32 -13.60 -48.97 REMARK 500 LYS A 40 102.38 52.34 REMARK 500 LEU A 60 -103.55 -57.65 REMARK 500 ASP A 81 20.62 45.17 REMARK 500 TYR A 90 179.53 -55.62 REMARK 500 PRO A 94 147.65 -36.04 REMARK 500 GLU A 102 -78.44 -46.50 REMARK 500 SER A 104 48.14 -98.66 REMARK 500 ALA A 116 3.55 -63.93 REMARK 500 ASN A 118 26.21 -157.51 REMARK 500 TYR A 119 88.92 -178.65 REMARK 500 PRO A 121 172.50 -42.24 REMARK 500 SER A 142 -0.51 -55.06 REMARK 500 PRO A 145 120.02 -36.28 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1C06 RELATED DB: PDB REMARK 900 16 CONFORMERS DBREF 1C05 A 1 159 UNP P81288 RS4_BACST 41 198 SEQRES 1 A 159 MET LYS LEU SER GLU TYR GLY LEU GLN LEU GLN GLU LYS SEQRES 2 A 159 GLN LYS LEU ARG HIS MET TYR GLY VAL ASN GLU ARG GLN SEQRES 3 A 159 PHE ARG LYS THR PHE GLU GLU ALA GLY LYS MET PRO GLY SEQRES 4 A 159 LYS HIS GLY GLU ASN PHE MET ILE LEU LEU GLU SER ARG SEQRES 5 A 159 LEU ASP ASN LEU VAL TYR ARG LEU GLY LEU ALA ARG THR SEQRES 6 A 159 ARG ARG GLN ALA ARG GLN LEU VAL THR HIS GLY HIS ILE SEQRES 7 A 159 LEU VAL ASP GLY SER ARG VAL ASN ILE PRO SER TYR ARG SEQRES 8 A 159 VAL LYS PRO GLY GLN THR ILE ALA VAL ARG GLU LYS SER SEQRES 9 A 159 ARG ASN LEU GLN VAL ILE LYS GLU ALA LEU GLU ALA ASN SEQRES 10 A 159 ASN TYR ILE PRO ASP TYR LEU SER PHE ASP PRO GLU LYS SEQRES 11 A 159 MET GLU GLY THR TYR THR ARG LEU PRO GLU ARG SER GLU SEQRES 12 A 159 LEU PRO ALA GLU ILE ASN GLU ALA LEU ILE VAL GLU PHE SEQRES 13 A 159 TYR SER ARG HELIX 1 1 SER A 4 MET A 19 1 16 HELIX 2 2 ASN A 23 GLY A 35 1 13 HELIX 3 3 LYS A 40 ARG A 52 1 13 HELIX 4 4 ARG A 52 LEU A 60 1 9 HELIX 5 5 THR A 65 HIS A 75 1 11 HELIX 6 6 LEU A 107 ALA A 116 1 10 HELIX 7 7 GLU A 150 ARG A 159 1 10 SHEET 1 A 5 SER A 83 ARG A 84 0 SHEET 2 A 5 ILE A 78 VAL A 80 -1 N VAL A 80 O SER A 83 SHEET 3 A 5 THR A 97 VAL A 100 -1 O ALA A 99 N LEU A 79 SHEET 4 A 5 GLU A 132 TYR A 135 -1 N GLY A 133 O ILE A 98 SHEET 5 A 5 LEU A 124 ASP A 127 -1 O SER A 125 N THR A 134 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 77 HIS : no HD1:sc= -6.37! C(o=-8.5!,f=-15!) USER MOD Set 1.2: A 104 SER OG : rot 173:sc= -2.16! USER MOD Set 2.1: A 90 TYR OH : rot 30:sc= 0 USER MOD Set 2.2: A 96 GLN : amide:sc= -0.541! C(o=-0.54!,f=-7.8!) USER MOD Set 3.1: A 26 GLN : amide:sc= 1.85 K(o=4,f=0.069) USER MOD Set 3.2: A 30 THR OG1 : rot 71:sc= 0.909 USER MOD Set 3.3: A 89 SER OG : rot 62:sc= 1.21 USER MOD Set 4.1: A 74 THR OG1 : rot 2:sc= 0.0421 USER MOD Set 4.2: A 75 HIS : no HD1:sc= -4.65! C(o=-4.6!,f=-3.3!) USER MOD Set 5.1: A 65 THR OG1 : rot -51:sc= 1.07 USER MOD Set 5.2: A 68 GLN : amide:sc= -0.702! C(o=0.36!,f=-7.8!) USER MOD Single : A 1 MET CE :methyl -148:sc= -0.369 (180deg=-1.69!) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.281 (180deg=-1.04!) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.522! USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -2.53! C(o=-2.5!,f=-7.9!) USER MOD Single : A 11 GLN : amide:sc= -2.56 K(o=-2.6,f=0) USER MOD Single : A 13 LYS NZ :NH3+ -132:sc= 0.748 (180deg=-0.818) USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ -143:sc= 0.823 (180deg=-0.192!) USER MOD Single : A 18 HIS : no HD1:sc= -0.381 X(o=-0.38,f=0.0012) USER MOD Single : A 19 MET CE :methyl -141:sc= -0.372 (180deg=-1.96!) USER MOD Single : A 20 TYR OH : rot 15:sc= -3.47! USER MOD Single : A 23 ASN : amide:sc= -0.374 K(o=-0.37,f=-4!) USER MOD Single : A 29 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.115) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -160:sc= -0.21 (180deg=-1.17) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -1.86 K(o=-1.9,f=-0.68) USER MOD Single : A 44 ASN : amide:sc= -2.27! C(o=-2.3!,f=-7.2!) USER MOD Single : A 46 MET CE :methyl -143:sc= -0.0788 (180deg=-0.172) USER MOD Single : A 51 SER OG : rot 66:sc= 0.485 USER MOD Single : A 55 ASN : amide:sc= -6.57! K(o=-6.6!,f=-2.1) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -0.346 K(o=-0.35,f=-1.8!) USER MOD Single : A 83 SER OG : rot 9:sc= 0.256 USER MOD Single : A 86 ASN : amide:sc= 0.714 K(o=0.71,f=-4.4!) USER MOD Single : A 93 LYS NZ :NH3+ 157:sc= -0.065 (180deg=-0.496) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0901) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -5.04! C(o=-5!,f=-6.3!) USER MOD Single : A 118 ASN : amide:sc= -0.477 X(o=-0.48,f=-0.15) USER MOD Single : A 119 TYR OH : rot -123:sc= -1.6! USER MOD Single : A 123 TYR OH : rot 157:sc= -0.0428 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl 155:sc= -0.947 (180deg=-1.22) USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.612 USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -0.386 K(o=-0.39,f=-5.8!) USER MOD Single : A 157 TYR OH : rot 180:sc= -0.048 USER MOD Single : A 158 SER OG : rot -28:sc= 0.0813 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.752 -4.321 17.203 1.00 6.32 N ATOM 2 CA MET A 1 31.867 -3.487 18.065 1.00 5.84 C ATOM 3 C MET A 1 31.184 -2.424 17.195 1.00 4.83 C ATOM 4 O MET A 1 29.974 -2.314 17.168 1.00 4.68 O ATOM 5 CB MET A 1 32.697 -2.813 19.188 1.00 6.61 C ATOM 6 CG MET A 1 34.187 -2.805 18.820 1.00 7.53 C ATOM 7 SD MET A 1 34.865 -4.485 18.920 1.00 8.03 S ATOM 8 CE MET A 1 34.640 -4.740 20.698 1.00 8.59 C ATOM 0 H1 MET A 1 33.437 -4.829 17.798 1.00 6.32 H new ATOM 0 H2 MET A 1 32.176 -5.007 16.675 1.00 6.32 H new ATOM 0 H3 MET A 1 33.261 -3.709 16.534 1.00 6.32 H new ATOM 0 HA MET A 1 31.109 -4.116 18.532 1.00 5.84 H new ATOM 0 HB2 MET A 1 32.349 -1.792 19.344 1.00 6.61 H new ATOM 0 HB3 MET A 1 32.551 -3.346 20.127 1.00 6.61 H new ATOM 0 HG2 MET A 1 34.318 -2.411 17.812 1.00 7.53 H new ATOM 0 HG3 MET A 1 34.732 -2.144 19.494 1.00 7.53 H new ATOM 0 HE1 MET A 1 35.434 -5.383 21.077 1.00 8.59 H new ATOM 0 HE2 MET A 1 34.676 -3.779 21.211 1.00 8.59 H new ATOM 0 HE3 MET A 1 33.674 -5.212 20.879 1.00 8.59 H new ATOM 20 N LYS A 2 31.950 -1.642 16.484 1.00 4.51 N ATOM 21 CA LYS A 2 31.345 -0.591 15.619 1.00 3.82 C ATOM 22 C LYS A 2 30.761 -1.238 14.362 1.00 2.95 C ATOM 23 O LYS A 2 31.481 -1.681 13.489 1.00 2.84 O ATOM 24 CB LYS A 2 32.420 0.423 15.220 1.00 4.22 C ATOM 25 CG LYS A 2 32.977 1.100 16.474 1.00 5.05 C ATOM 26 CD LYS A 2 33.761 2.354 16.076 1.00 5.66 C ATOM 27 CE LYS A 2 34.981 1.956 15.243 1.00 6.59 C ATOM 28 NZ LYS A 2 35.936 3.098 15.184 1.00 7.21 N ATOM 0 H LYS A 2 32.969 -1.686 16.465 1.00 4.51 H new ATOM 0 HA LYS A 2 30.552 -0.082 16.167 1.00 3.82 H new ATOM 0 HB2 LYS A 2 33.222 -0.077 14.677 1.00 4.22 H new ATOM 0 HB3 LYS A 2 31.998 1.170 14.548 1.00 4.22 H new ATOM 0 HG2 LYS A 2 32.163 1.367 17.148 1.00 5.05 H new ATOM 0 HG3 LYS A 2 33.625 0.410 17.015 1.00 5.05 H new ATOM 0 HD2 LYS A 2 33.123 3.028 15.505 1.00 5.66 H new ATOM 0 HD3 LYS A 2 34.078 2.895 16.968 1.00 5.66 H new ATOM 0 HE2 LYS A 2 35.466 1.085 15.683 1.00 6.59 H new ATOM 0 HE3 LYS A 2 34.671 1.675 14.237 1.00 6.59 H new ATOM 0 HZ1 LYS A 2 36.766 2.828 14.618 1.00 7.21 H new ATOM 0 HZ2 LYS A 2 35.470 3.918 14.746 1.00 7.21 H new ATOM 0 HZ3 LYS A 2 36.240 3.346 16.147 1.00 7.21 H new ATOM 42 N LEU A 3 29.462 -1.296 14.261 1.00 2.67 N ATOM 43 CA LEU A 3 28.834 -1.914 13.060 1.00 2.16 C ATOM 44 C LEU A 3 29.193 -1.088 11.820 1.00 1.53 C ATOM 45 O LEU A 3 29.137 0.126 11.834 1.00 1.87 O ATOM 46 CB LEU A 3 27.309 -1.953 13.249 1.00 2.65 C ATOM 47 CG LEU A 3 26.906 -3.243 13.995 1.00 3.34 C ATOM 48 CD1 LEU A 3 25.600 -3.015 14.748 1.00 4.10 C ATOM 49 CD2 LEU A 3 26.713 -4.389 12.993 1.00 3.68 C ATOM 0 H LEU A 3 28.808 -0.942 14.959 1.00 2.67 H new ATOM 0 HA LEU A 3 29.202 -2.931 12.928 1.00 2.16 H new ATOM 0 HB2 LEU A 3 26.981 -1.079 13.812 1.00 2.65 H new ATOM 0 HB3 LEU A 3 26.812 -1.913 12.280 1.00 2.65 H new ATOM 0 HG LEU A 3 27.696 -3.504 14.699 1.00 3.34 H new ATOM 0 HD11 LEU A 3 25.319 -3.928 15.273 1.00 4.10 H new ATOM 0 HD12 LEU A 3 25.732 -2.208 15.468 1.00 4.10 H new ATOM 0 HD13 LEU A 3 24.815 -2.746 14.041 1.00 4.10 H new ATOM 0 HD21 LEU A 3 26.429 -5.296 13.527 1.00 3.68 H new ATOM 0 HD22 LEU A 3 25.928 -4.124 12.284 1.00 3.68 H new ATOM 0 HD23 LEU A 3 27.645 -4.562 12.455 1.00 3.68 H new ATOM 61 N SER A 4 29.560 -1.736 10.749 1.00 1.19 N ATOM 62 CA SER A 4 29.921 -0.988 9.512 1.00 0.86 C ATOM 63 C SER A 4 28.646 -0.524 8.805 1.00 0.74 C ATOM 64 O SER A 4 27.547 -0.777 9.257 1.00 0.73 O ATOM 65 CB SER A 4 30.717 -1.901 8.578 1.00 1.12 C ATOM 66 OG SER A 4 30.735 -1.337 7.273 1.00 2.02 O ATOM 0 H SER A 4 29.626 -2.751 10.677 1.00 1.19 H new ATOM 0 HA SER A 4 30.526 -0.121 9.776 1.00 0.86 H new ATOM 0 HB2 SER A 4 31.735 -2.021 8.949 1.00 1.12 H new ATOM 0 HB3 SER A 4 30.268 -2.894 8.551 1.00 1.12 H new ATOM 0 HG SER A 4 31.246 -1.919 6.672 1.00 2.02 H new ATOM 72 N GLU A 5 28.783 0.156 7.700 1.00 0.75 N ATOM 73 CA GLU A 5 27.579 0.636 6.966 1.00 0.72 C ATOM 74 C GLU A 5 26.869 -0.553 6.316 1.00 0.65 C ATOM 75 O GLU A 5 25.660 -0.585 6.209 1.00 0.63 O ATOM 76 CB GLU A 5 28.004 1.631 5.883 1.00 0.79 C ATOM 77 CG GLU A 5 26.769 2.349 5.336 1.00 0.88 C ATOM 78 CD GLU A 5 27.181 3.264 4.181 1.00 1.06 C ATOM 79 OE1 GLU A 5 27.669 2.750 3.188 1.00 1.49 O ATOM 80 OE2 GLU A 5 27.002 4.464 4.309 1.00 1.49 O ATOM 0 H GLU A 5 29.677 0.400 7.274 1.00 0.75 H new ATOM 0 HA GLU A 5 26.900 1.127 7.664 1.00 0.72 H new ATOM 0 HB2 GLU A 5 28.706 2.356 6.295 1.00 0.79 H new ATOM 0 HB3 GLU A 5 28.521 1.109 5.078 1.00 0.79 H new ATOM 0 HG2 GLU A 5 26.034 1.621 4.993 1.00 0.88 H new ATOM 0 HG3 GLU A 5 26.295 2.933 6.125 1.00 0.88 H new ATOM 87 N TYR A 6 27.615 -1.529 5.880 1.00 0.70 N ATOM 88 CA TYR A 6 26.991 -2.719 5.233 1.00 0.74 C ATOM 89 C TYR A 6 25.828 -3.224 6.091 1.00 0.72 C ATOM 90 O TYR A 6 24.828 -3.693 5.584 1.00 0.74 O ATOM 91 CB TYR A 6 28.037 -3.827 5.093 1.00 0.87 C ATOM 92 CG TYR A 6 27.467 -4.959 4.272 1.00 1.51 C ATOM 93 CD1 TYR A 6 26.595 -5.881 4.863 1.00 2.30 C ATOM 94 CD2 TYR A 6 27.811 -5.089 2.921 1.00 2.10 C ATOM 95 CE1 TYR A 6 26.067 -6.932 4.104 1.00 3.19 C ATOM 96 CE2 TYR A 6 27.283 -6.139 2.161 1.00 3.02 C ATOM 97 CZ TYR A 6 26.411 -7.061 2.753 1.00 3.45 C ATOM 98 OH TYR A 6 25.890 -8.097 2.004 1.00 4.46 O ATOM 0 H TYR A 6 28.633 -1.555 5.944 1.00 0.70 H new ATOM 0 HA TYR A 6 26.617 -2.440 4.248 1.00 0.74 H new ATOM 0 HB2 TYR A 6 28.936 -3.435 4.616 1.00 0.87 H new ATOM 0 HB3 TYR A 6 28.331 -4.190 6.078 1.00 0.87 H new ATOM 0 HD1 TYR A 6 26.329 -5.781 5.905 1.00 2.30 H new ATOM 0 HD2 TYR A 6 28.484 -4.378 2.465 1.00 2.10 H new ATOM 0 HE1 TYR A 6 25.394 -7.643 4.560 1.00 3.19 H new ATOM 0 HE2 TYR A 6 27.548 -6.238 1.119 1.00 3.02 H new ATOM 0 HH TYR A 6 26.229 -8.040 1.086 1.00 4.46 H new ATOM 108 N GLY A 7 25.951 -3.137 7.387 1.00 0.75 N ATOM 109 CA GLY A 7 24.854 -3.618 8.274 1.00 0.81 C ATOM 110 C GLY A 7 23.727 -2.584 8.314 1.00 0.73 C ATOM 111 O GLY A 7 22.562 -2.925 8.381 1.00 0.75 O ATOM 0 H GLY A 7 26.763 -2.754 7.870 1.00 0.75 H new ATOM 0 HA2 GLY A 7 24.472 -4.572 7.910 1.00 0.81 H new ATOM 0 HA3 GLY A 7 25.237 -3.791 9.280 1.00 0.81 H new ATOM 115 N LEU A 8 24.060 -1.323 8.279 1.00 0.70 N ATOM 116 CA LEU A 8 23.002 -0.273 8.321 1.00 0.70 C ATOM 117 C LEU A 8 22.159 -0.336 7.047 1.00 0.59 C ATOM 118 O LEU A 8 20.968 -0.097 7.069 1.00 0.58 O ATOM 119 CB LEU A 8 23.653 1.107 8.437 1.00 0.77 C ATOM 120 CG LEU A 8 24.705 1.092 9.550 1.00 0.89 C ATOM 121 CD1 LEU A 8 25.368 2.469 9.640 1.00 0.99 C ATOM 122 CD2 LEU A 8 24.039 0.756 10.891 1.00 1.01 C ATOM 0 H LEU A 8 25.017 -0.974 8.223 1.00 0.70 H new ATOM 0 HA LEU A 8 22.360 -0.445 9.185 1.00 0.70 H new ATOM 0 HB2 LEU A 8 24.117 1.381 7.489 1.00 0.77 H new ATOM 0 HB3 LEU A 8 22.895 1.860 8.651 1.00 0.77 H new ATOM 0 HG LEU A 8 25.458 0.337 9.325 1.00 0.89 H new ATOM 0 HD11 LEU A 8 26.117 2.461 10.432 1.00 0.99 H new ATOM 0 HD12 LEU A 8 25.847 2.705 8.690 1.00 0.99 H new ATOM 0 HD13 LEU A 8 24.613 3.223 9.863 1.00 0.99 H new ATOM 0 HD21 LEU A 8 24.792 0.747 11.679 1.00 1.01 H new ATOM 0 HD22 LEU A 8 23.283 1.507 11.120 1.00 1.01 H new ATOM 0 HD23 LEU A 8 23.568 -0.225 10.828 1.00 1.01 H new ATOM 134 N GLN A 9 22.760 -0.656 5.935 1.00 0.61 N ATOM 135 CA GLN A 9 21.979 -0.732 4.668 1.00 0.60 C ATOM 136 C GLN A 9 20.860 -1.764 4.826 1.00 0.55 C ATOM 137 O GLN A 9 19.690 -1.438 4.774 1.00 0.65 O ATOM 138 CB GLN A 9 22.895 -1.168 3.510 1.00 0.70 C ATOM 139 CG GLN A 9 24.174 -0.295 3.457 1.00 0.79 C ATOM 140 CD GLN A 9 24.591 -0.053 2.000 1.00 1.17 C ATOM 141 OE1 GLN A 9 24.165 -0.761 1.108 1.00 1.67 O ATOM 142 NE2 GLN A 9 25.412 0.922 1.722 1.00 1.87 N ATOM 0 H GLN A 9 23.754 -0.867 5.848 1.00 0.61 H new ATOM 0 HA GLN A 9 21.559 0.250 4.450 1.00 0.60 H new ATOM 0 HB2 GLN A 9 23.170 -2.216 3.633 1.00 0.70 H new ATOM 0 HB3 GLN A 9 22.357 -1.089 2.566 1.00 0.70 H new ATOM 0 HG2 GLN A 9 23.993 0.658 3.954 1.00 0.79 H new ATOM 0 HG3 GLN A 9 24.982 -0.788 3.997 1.00 0.79 H new ATOM 0 HE21 GLN A 9 25.770 1.516 2.470 1.00 1.87 H new ATOM 0 HE22 GLN A 9 25.696 1.090 0.757 1.00 1.87 H new ATOM 151 N LEU A 10 21.210 -3.009 5.009 1.00 0.58 N ATOM 152 CA LEU A 10 20.167 -4.063 5.160 1.00 0.62 C ATOM 153 C LEU A 10 19.261 -3.711 6.346 1.00 0.59 C ATOM 154 O LEU A 10 18.070 -3.949 6.317 1.00 0.67 O ATOM 155 CB LEU A 10 20.854 -5.438 5.371 1.00 0.74 C ATOM 156 CG LEU A 10 20.325 -6.464 4.353 1.00 0.99 C ATOM 157 CD1 LEU A 10 20.928 -6.187 2.968 1.00 1.79 C ATOM 158 CD2 LEU A 10 20.709 -7.877 4.800 1.00 1.10 C ATOM 0 H LEU A 10 22.173 -3.341 5.060 1.00 0.58 H new ATOM 0 HA LEU A 10 19.553 -4.119 4.261 1.00 0.62 H new ATOM 0 HB2 LEU A 10 21.934 -5.333 5.263 1.00 0.74 H new ATOM 0 HB3 LEU A 10 20.668 -5.793 6.385 1.00 0.74 H new ATOM 0 HG LEU A 10 19.240 -6.380 4.296 1.00 0.99 H new ATOM 0 HD11 LEU A 10 20.549 -6.917 2.253 1.00 1.79 H new ATOM 0 HD12 LEU A 10 20.650 -5.184 2.644 1.00 1.79 H new ATOM 0 HD13 LEU A 10 22.014 -6.263 3.022 1.00 1.79 H new ATOM 0 HD21 LEU A 10 20.333 -8.602 4.078 1.00 1.10 H new ATOM 0 HD22 LEU A 10 21.794 -7.956 4.863 1.00 1.10 H new ATOM 0 HD23 LEU A 10 20.273 -8.080 5.778 1.00 1.10 H new ATOM 170 N GLN A 11 19.802 -3.130 7.381 1.00 0.55 N ATOM 171 CA GLN A 11 18.945 -2.756 8.541 1.00 0.57 C ATOM 172 C GLN A 11 17.753 -1.953 8.017 1.00 0.53 C ATOM 173 O GLN A 11 16.610 -2.242 8.313 1.00 0.56 O ATOM 174 CB GLN A 11 19.753 -1.900 9.520 1.00 0.63 C ATOM 175 CG GLN A 11 18.914 -1.615 10.767 1.00 1.18 C ATOM 176 CD GLN A 11 19.706 -0.717 11.720 1.00 1.23 C ATOM 177 OE1 GLN A 11 19.381 -0.614 12.887 1.00 1.55 O ATOM 178 NE2 GLN A 11 20.739 -0.058 11.270 1.00 1.02 N ATOM 0 H GLN A 11 20.791 -2.900 7.474 1.00 0.55 H new ATOM 0 HA GLN A 11 18.597 -3.650 9.058 1.00 0.57 H new ATOM 0 HB2 GLN A 11 20.672 -2.417 9.798 1.00 0.63 H new ATOM 0 HB3 GLN A 11 20.045 -0.964 9.044 1.00 0.63 H new ATOM 0 HG2 GLN A 11 17.979 -1.130 10.486 1.00 1.18 H new ATOM 0 HG3 GLN A 11 18.652 -2.549 11.264 1.00 1.18 H new ATOM 0 HE21 GLN A 11 21.012 -0.144 10.291 1.00 1.02 H new ATOM 0 HE22 GLN A 11 21.273 0.543 11.897 1.00 1.02 H new ATOM 187 N GLU A 12 18.023 -0.952 7.225 1.00 0.50 N ATOM 188 CA GLU A 12 16.922 -0.127 6.658 1.00 0.50 C ATOM 189 C GLU A 12 15.918 -1.043 5.952 1.00 0.49 C ATOM 190 O GLU A 12 14.721 -0.884 6.083 1.00 0.57 O ATOM 191 CB GLU A 12 17.498 0.874 5.654 1.00 0.53 C ATOM 192 CG GLU A 12 18.246 1.977 6.406 1.00 0.89 C ATOM 193 CD GLU A 12 17.237 2.914 7.073 1.00 1.22 C ATOM 194 OE1 GLU A 12 16.594 3.665 6.358 1.00 1.68 O ATOM 195 OE2 GLU A 12 17.126 2.866 8.287 1.00 2.01 O ATOM 0 H GLU A 12 18.963 -0.670 6.946 1.00 0.50 H new ATOM 0 HA GLU A 12 16.420 0.416 7.459 1.00 0.50 H new ATOM 0 HB2 GLU A 12 18.173 0.367 4.965 1.00 0.53 H new ATOM 0 HB3 GLU A 12 16.697 1.306 5.055 1.00 0.53 H new ATOM 0 HG2 GLU A 12 18.903 1.539 7.157 1.00 0.89 H new ATOM 0 HG3 GLU A 12 18.878 2.537 5.717 1.00 0.89 H new ATOM 202 N LYS A 13 16.396 -2.006 5.207 1.00 0.46 N ATOM 203 CA LYS A 13 15.465 -2.933 4.500 1.00 0.49 C ATOM 204 C LYS A 13 14.600 -3.659 5.532 1.00 0.48 C ATOM 205 O LYS A 13 13.420 -3.869 5.331 1.00 0.50 O ATOM 206 CB LYS A 13 16.265 -3.960 3.693 1.00 0.57 C ATOM 207 CG LYS A 13 15.299 -4.935 3.005 1.00 0.59 C ATOM 208 CD LYS A 13 16.015 -5.659 1.859 1.00 0.76 C ATOM 209 CE LYS A 13 17.320 -6.275 2.370 1.00 1.35 C ATOM 210 NZ LYS A 13 17.807 -7.287 1.390 1.00 1.97 N ATOM 0 H LYS A 13 17.388 -2.190 5.058 1.00 0.46 H new ATOM 0 HA LYS A 13 14.831 -2.362 3.822 1.00 0.49 H new ATOM 0 HB2 LYS A 13 16.880 -3.454 2.948 1.00 0.57 H new ATOM 0 HB3 LYS A 13 16.943 -4.506 4.349 1.00 0.57 H new ATOM 0 HG2 LYS A 13 14.925 -5.660 3.728 1.00 0.59 H new ATOM 0 HG3 LYS A 13 14.435 -4.393 2.621 1.00 0.59 H new ATOM 0 HD2 LYS A 13 15.371 -6.437 1.449 1.00 0.76 H new ATOM 0 HD3 LYS A 13 16.225 -4.960 1.050 1.00 0.76 H new ATOM 0 HE2 LYS A 13 18.071 -5.498 2.511 1.00 1.35 H new ATOM 0 HE3 LYS A 13 17.159 -6.742 3.342 1.00 1.35 H new ATOM 0 HZ1 LYS A 13 18.058 -8.163 1.891 1.00 1.97 H new ATOM 0 HZ2 LYS A 13 17.058 -7.488 0.697 1.00 1.97 H new ATOM 0 HZ3 LYS A 13 18.645 -6.918 0.897 1.00 1.97 H new ATOM 224 N GLN A 14 15.180 -4.045 6.635 1.00 0.50 N ATOM 225 CA GLN A 14 14.397 -4.761 7.682 1.00 0.53 C ATOM 226 C GLN A 14 13.202 -3.906 8.107 1.00 0.53 C ATOM 227 O GLN A 14 12.109 -4.401 8.295 1.00 0.56 O ATOM 228 CB GLN A 14 15.291 -5.027 8.894 1.00 0.61 C ATOM 229 CG GLN A 14 14.556 -5.936 9.881 1.00 1.32 C ATOM 230 CD GLN A 14 15.437 -6.176 11.109 1.00 1.82 C ATOM 231 OE1 GLN A 14 15.142 -5.696 12.186 1.00 2.30 O ATOM 232 NE2 GLN A 14 16.514 -6.903 10.992 1.00 2.52 N ATOM 0 H GLN A 14 16.164 -3.895 6.857 1.00 0.50 H new ATOM 0 HA GLN A 14 14.037 -5.708 7.279 1.00 0.53 H new ATOM 0 HB2 GLN A 14 16.222 -5.495 8.576 1.00 0.61 H new ATOM 0 HB3 GLN A 14 15.556 -4.087 9.377 1.00 0.61 H new ATOM 0 HG2 GLN A 14 13.613 -5.478 10.181 1.00 1.32 H new ATOM 0 HG3 GLN A 14 14.312 -6.885 9.405 1.00 1.32 H new ATOM 0 HE21 GLN A 14 16.762 -7.306 10.088 1.00 2.52 H new ATOM 0 HE22 GLN A 14 17.108 -7.069 11.804 1.00 2.52 H new ATOM 241 N LYS A 15 13.402 -2.628 8.263 1.00 0.68 N ATOM 242 CA LYS A 15 12.273 -1.746 8.680 1.00 0.74 C ATOM 243 C LYS A 15 11.247 -1.659 7.546 1.00 0.66 C ATOM 244 O LYS A 15 10.132 -2.127 7.663 1.00 0.79 O ATOM 245 CB LYS A 15 12.804 -0.340 9.000 1.00 0.92 C ATOM 246 CG LYS A 15 14.206 -0.443 9.604 1.00 0.87 C ATOM 247 CD LYS A 15 14.612 0.904 10.218 1.00 0.88 C ATOM 248 CE LYS A 15 14.357 2.041 9.222 1.00 0.79 C ATOM 249 NZ LYS A 15 15.140 3.242 9.628 1.00 1.63 N ATOM 0 H LYS A 15 14.295 -2.155 8.121 1.00 0.68 H new ATOM 0 HA LYS A 15 11.799 -2.163 9.569 1.00 0.74 H new ATOM 0 HB2 LYS A 15 12.832 0.264 8.093 1.00 0.92 H new ATOM 0 HB3 LYS A 15 12.133 0.163 9.697 1.00 0.92 H new ATOM 0 HG2 LYS A 15 14.226 -1.221 10.367 1.00 0.87 H new ATOM 0 HG3 LYS A 15 14.922 -0.732 8.835 1.00 0.87 H new ATOM 0 HD2 LYS A 15 14.047 1.079 11.133 1.00 0.88 H new ATOM 0 HD3 LYS A 15 15.666 0.883 10.494 1.00 0.88 H new ATOM 0 HE2 LYS A 15 14.643 1.730 8.217 1.00 0.79 H new ATOM 0 HE3 LYS A 15 13.294 2.280 9.191 1.00 0.79 H new ATOM 0 HZ1 LYS A 15 14.585 4.100 9.435 1.00 1.63 H new ATOM 0 HZ2 LYS A 15 15.355 3.189 10.644 1.00 1.63 H new ATOM 0 HZ3 LYS A 15 16.028 3.276 9.088 1.00 1.63 H new ATOM 263 N LEU A 16 11.618 -1.050 6.454 1.00 0.60 N ATOM 264 CA LEU A 16 10.671 -0.913 5.314 1.00 0.56 C ATOM 265 C LEU A 16 10.023 -2.268 5.015 1.00 0.56 C ATOM 266 O LEU A 16 9.013 -2.349 4.344 1.00 0.67 O ATOM 267 CB LEU A 16 11.433 -0.414 4.081 1.00 0.58 C ATOM 268 CG LEU A 16 10.452 -0.018 2.965 1.00 0.59 C ATOM 269 CD1 LEU A 16 9.542 1.142 3.426 1.00 0.62 C ATOM 270 CD2 LEU A 16 11.258 0.409 1.732 1.00 0.65 C ATOM 0 H LEU A 16 12.540 -0.640 6.302 1.00 0.60 H new ATOM 0 HA LEU A 16 9.890 -0.197 5.571 1.00 0.56 H new ATOM 0 HB2 LEU A 16 12.051 0.442 4.350 1.00 0.58 H new ATOM 0 HB3 LEU A 16 12.106 -1.193 3.722 1.00 0.58 H new ATOM 0 HG LEU A 16 9.818 -0.870 2.722 1.00 0.59 H new ATOM 0 HD11 LEU A 16 8.855 1.407 2.622 1.00 0.62 H new ATOM 0 HD12 LEU A 16 8.973 0.832 4.302 1.00 0.62 H new ATOM 0 HD13 LEU A 16 10.155 2.007 3.679 1.00 0.62 H new ATOM 0 HD21 LEU A 16 10.575 0.693 0.931 1.00 0.65 H new ATOM 0 HD22 LEU A 16 11.891 1.259 1.987 1.00 0.65 H new ATOM 0 HD23 LEU A 16 11.882 -0.421 1.400 1.00 0.65 H new ATOM 282 N ARG A 17 10.590 -3.333 5.512 1.00 0.53 N ATOM 283 CA ARG A 17 10.001 -4.680 5.259 1.00 0.57 C ATOM 284 C ARG A 17 8.858 -4.928 6.247 1.00 0.64 C ATOM 285 O ARG A 17 7.740 -5.206 5.860 1.00 0.77 O ATOM 286 CB ARG A 17 11.076 -5.752 5.444 1.00 0.60 C ATOM 287 CG ARG A 17 10.475 -7.132 5.168 1.00 0.70 C ATOM 288 CD ARG A 17 11.586 -8.183 5.170 1.00 0.76 C ATOM 289 NE ARG A 17 12.083 -8.378 6.561 1.00 1.38 N ATOM 290 CZ ARG A 17 12.811 -9.421 6.854 1.00 1.59 C ATOM 291 NH1 ARG A 17 13.104 -10.293 5.928 1.00 1.54 N ATOM 292 NH2 ARG A 17 13.246 -9.592 8.072 1.00 2.51 N ATOM 0 H ARG A 17 11.436 -3.329 6.082 1.00 0.53 H new ATOM 0 HA ARG A 17 9.618 -4.724 4.239 1.00 0.57 H new ATOM 0 HB2 ARG A 17 11.910 -5.565 4.768 1.00 0.60 H new ATOM 0 HB3 ARG A 17 11.473 -5.713 6.459 1.00 0.60 H new ATOM 0 HG2 ARG A 17 9.730 -7.374 5.926 1.00 0.70 H new ATOM 0 HG3 ARG A 17 9.963 -7.131 4.206 1.00 0.70 H new ATOM 0 HD2 ARG A 17 11.210 -9.125 4.771 1.00 0.76 H new ATOM 0 HD3 ARG A 17 12.403 -7.865 4.522 1.00 0.76 H new ATOM 0 HE ARG A 17 11.854 -7.696 7.284 1.00 1.38 H new ATOM 0 HH11 ARG A 17 12.764 -10.159 4.976 1.00 1.54 H new ATOM 0 HH12 ARG A 17 13.673 -11.108 6.157 1.00 1.54 H new ATOM 0 HH21 ARG A 17 13.017 -8.911 8.796 1.00 2.51 H new ATOM 0 HH22 ARG A 17 13.815 -10.407 8.301 1.00 2.51 H new ATOM 306 N HIS A 18 9.129 -4.830 7.521 1.00 0.63 N ATOM 307 CA HIS A 18 8.059 -5.060 8.533 1.00 0.71 C ATOM 308 C HIS A 18 7.217 -3.790 8.683 1.00 0.71 C ATOM 309 O HIS A 18 6.447 -3.650 9.612 1.00 0.85 O ATOM 310 CB HIS A 18 8.698 -5.409 9.879 1.00 0.75 C ATOM 311 CG HIS A 18 9.301 -6.784 9.807 1.00 0.76 C ATOM 312 ND1 HIS A 18 10.628 -7.029 10.131 1.00 0.99 N ATOM 313 CD2 HIS A 18 8.772 -8.000 9.448 1.00 0.93 C ATOM 314 CE1 HIS A 18 10.851 -8.346 9.964 1.00 0.93 C ATOM 315 NE2 HIS A 18 9.753 -8.980 9.549 1.00 0.87 N ATOM 0 H HIS A 18 10.046 -4.600 7.904 1.00 0.63 H new ATOM 0 HA HIS A 18 7.422 -5.882 8.208 1.00 0.71 H new ATOM 0 HB2 HIS A 18 9.465 -4.677 10.130 1.00 0.75 H new ATOM 0 HB3 HIS A 18 7.949 -5.370 10.670 1.00 0.75 H new ATOM 0 HD2 HIS A 18 7.752 -8.169 9.136 1.00 0.93 H new ATOM 0 HE1 HIS A 18 11.800 -8.829 10.144 1.00 0.93 H new ATOM 0 HE2 HIS A 18 9.654 -9.975 9.348 1.00 0.87 H new ATOM 324 N MET A 19 7.360 -2.865 7.775 1.00 0.66 N ATOM 325 CA MET A 19 6.572 -1.603 7.862 1.00 0.67 C ATOM 326 C MET A 19 5.097 -1.897 7.582 1.00 0.72 C ATOM 327 O MET A 19 4.334 -2.206 8.476 1.00 0.78 O ATOM 328 CB MET A 19 7.101 -0.608 6.827 1.00 0.62 C ATOM 329 CG MET A 19 6.293 0.703 6.887 1.00 0.64 C ATOM 330 SD MET A 19 7.373 2.100 6.476 1.00 1.21 S ATOM 331 CE MET A 19 8.473 1.993 7.914 1.00 0.67 C ATOM 0 H MET A 19 7.990 -2.928 6.975 1.00 0.66 H new ATOM 0 HA MET A 19 6.670 -1.180 8.862 1.00 0.67 H new ATOM 0 HB2 MET A 19 8.155 -0.403 7.015 1.00 0.62 H new ATOM 0 HB3 MET A 19 7.033 -1.040 5.829 1.00 0.62 H new ATOM 0 HG2 MET A 19 5.457 0.659 6.190 1.00 0.64 H new ATOM 0 HG3 MET A 19 5.871 0.837 7.883 1.00 0.64 H new ATOM 0 HE1 MET A 19 8.717 2.997 8.261 1.00 0.67 H new ATOM 0 HE2 MET A 19 7.975 1.444 8.713 1.00 0.67 H new ATOM 0 HE3 MET A 19 9.389 1.473 7.633 1.00 0.67 H new ATOM 341 N TYR A 20 4.690 -1.807 6.344 1.00 0.70 N ATOM 342 CA TYR A 20 3.267 -2.083 6.004 1.00 0.77 C ATOM 343 C TYR A 20 3.055 -3.594 5.906 1.00 0.81 C ATOM 344 O TYR A 20 2.003 -4.061 5.518 1.00 1.01 O ATOM 345 CB TYR A 20 2.930 -1.431 4.661 1.00 0.72 C ATOM 346 CG TYR A 20 3.398 0.008 4.668 1.00 0.69 C ATOM 347 CD1 TYR A 20 2.809 0.927 5.545 1.00 0.83 C ATOM 348 CD2 TYR A 20 4.417 0.424 3.801 1.00 0.58 C ATOM 349 CE1 TYR A 20 3.238 2.260 5.556 1.00 0.84 C ATOM 350 CE2 TYR A 20 4.846 1.756 3.812 1.00 0.61 C ATOM 351 CZ TYR A 20 4.256 2.674 4.689 1.00 0.72 C ATOM 352 OH TYR A 20 4.679 3.988 4.699 1.00 0.78 O ATOM 0 H TYR A 20 5.283 -1.554 5.554 1.00 0.70 H new ATOM 0 HA TYR A 20 2.619 -1.674 6.779 1.00 0.77 H new ATOM 0 HB2 TYR A 20 3.410 -1.977 3.849 1.00 0.72 H new ATOM 0 HB3 TYR A 20 1.856 -1.474 4.483 1.00 0.72 H new ATOM 0 HD1 TYR A 20 2.023 0.608 6.213 1.00 0.83 H new ATOM 0 HD2 TYR A 20 4.872 -0.284 3.124 1.00 0.58 H new ATOM 0 HE1 TYR A 20 2.784 2.968 6.233 1.00 0.84 H new ATOM 0 HE2 TYR A 20 5.632 2.076 3.144 1.00 0.61 H new ATOM 0 HH TYR A 20 4.350 4.431 5.509 1.00 0.78 H new ATOM 362 N GLY A 21 4.050 -4.364 6.256 1.00 0.74 N ATOM 363 CA GLY A 21 3.910 -5.847 6.183 1.00 0.79 C ATOM 364 C GLY A 21 4.151 -6.312 4.747 1.00 0.68 C ATOM 365 O GLY A 21 3.302 -6.929 4.134 1.00 0.79 O ATOM 0 H GLY A 21 4.954 -4.030 6.589 1.00 0.74 H new ATOM 0 HA2 GLY A 21 4.623 -6.324 6.855 1.00 0.79 H new ATOM 0 HA3 GLY A 21 2.914 -6.145 6.511 1.00 0.79 H new ATOM 369 N VAL A 22 5.306 -6.022 4.203 1.00 0.59 N ATOM 370 CA VAL A 22 5.615 -6.447 2.801 1.00 0.56 C ATOM 371 C VAL A 22 6.389 -7.770 2.850 1.00 0.63 C ATOM 372 O VAL A 22 7.551 -7.804 3.204 1.00 0.63 O ATOM 373 CB VAL A 22 6.467 -5.360 2.083 1.00 0.49 C ATOM 374 CG1 VAL A 22 6.038 -5.234 0.608 1.00 0.47 C ATOM 375 CG2 VAL A 22 6.299 -4.004 2.789 1.00 0.54 C ATOM 0 H VAL A 22 6.052 -5.507 4.671 1.00 0.59 H new ATOM 0 HA VAL A 22 4.687 -6.578 2.245 1.00 0.56 H new ATOM 0 HB VAL A 22 7.515 -5.657 2.124 1.00 0.49 H new ATOM 0 HG11 VAL A 22 6.642 -4.470 0.117 1.00 0.47 H new ATOM 0 HG12 VAL A 22 6.182 -6.190 0.104 1.00 0.47 H new ATOM 0 HG13 VAL A 22 4.986 -4.953 0.558 1.00 0.47 H new ATOM 0 HG21 VAL A 22 6.899 -3.251 2.278 1.00 0.54 H new ATOM 0 HG22 VAL A 22 5.250 -3.709 2.765 1.00 0.54 H new ATOM 0 HG23 VAL A 22 6.628 -4.090 3.824 1.00 0.54 H new ATOM 385 N ASN A 23 5.758 -8.855 2.501 1.00 0.75 N ATOM 386 CA ASN A 23 6.467 -10.164 2.536 1.00 0.89 C ATOM 387 C ASN A 23 7.750 -10.071 1.709 1.00 0.87 C ATOM 388 O ASN A 23 7.905 -9.193 0.882 1.00 1.18 O ATOM 389 CB ASN A 23 5.562 -11.253 1.957 1.00 1.10 C ATOM 390 CG ASN A 23 4.334 -11.426 2.852 1.00 1.58 C ATOM 391 OD1 ASN A 23 3.995 -10.543 3.616 1.00 2.24 O ATOM 392 ND2 ASN A 23 3.647 -12.534 2.791 1.00 2.31 N ATOM 0 H ASN A 23 4.786 -8.893 2.194 1.00 0.75 H new ATOM 0 HA ASN A 23 6.717 -10.413 3.567 1.00 0.89 H new ATOM 0 HB2 ASN A 23 5.254 -10.985 0.946 1.00 1.10 H new ATOM 0 HB3 ASN A 23 6.108 -12.194 1.885 1.00 1.10 H new ATOM 0 HD21 ASN A 23 2.826 -12.659 3.384 1.00 2.31 H new ATOM 0 HD22 ASN A 23 3.931 -13.275 2.150 1.00 2.31 H new ATOM 399 N GLU A 24 8.674 -10.969 1.922 1.00 0.98 N ATOM 400 CA GLU A 24 9.944 -10.929 1.146 1.00 0.92 C ATOM 401 C GLU A 24 9.636 -11.113 -0.340 1.00 1.02 C ATOM 402 O GLU A 24 10.049 -10.330 -1.172 1.00 1.62 O ATOM 403 CB GLU A 24 10.868 -12.053 1.619 1.00 0.99 C ATOM 404 CG GLU A 24 12.169 -12.019 0.815 1.00 1.43 C ATOM 405 CD GLU A 24 13.196 -12.949 1.464 1.00 2.24 C ATOM 406 OE1 GLU A 24 13.024 -13.268 2.629 1.00 2.76 O ATOM 407 OE2 GLU A 24 14.136 -13.327 0.784 1.00 2.88 O ATOM 0 H GLU A 24 8.603 -11.728 2.600 1.00 0.98 H new ATOM 0 HA GLU A 24 10.435 -9.968 1.300 1.00 0.92 H new ATOM 0 HB2 GLU A 24 11.082 -11.939 2.682 1.00 0.99 H new ATOM 0 HB3 GLU A 24 10.377 -13.018 1.495 1.00 0.99 H new ATOM 0 HG2 GLU A 24 11.981 -12.328 -0.213 1.00 1.43 H new ATOM 0 HG3 GLU A 24 12.558 -11.002 0.776 1.00 1.43 H new ATOM 414 N ARG A 25 8.909 -12.142 -0.681 1.00 0.86 N ATOM 415 CA ARG A 25 8.572 -12.371 -2.113 1.00 0.88 C ATOM 416 C ARG A 25 7.987 -11.087 -2.702 1.00 0.78 C ATOM 417 O ARG A 25 8.391 -10.633 -3.754 1.00 0.82 O ATOM 418 CB ARG A 25 7.545 -13.499 -2.223 1.00 1.02 C ATOM 419 CG ARG A 25 7.289 -13.819 -3.699 1.00 1.57 C ATOM 420 CD ARG A 25 6.587 -15.173 -3.813 1.00 1.58 C ATOM 421 NE ARG A 25 6.094 -15.361 -5.207 1.00 2.68 N ATOM 422 CZ ARG A 25 5.734 -16.547 -5.617 1.00 3.21 C ATOM 423 NH1 ARG A 25 5.806 -17.567 -4.807 1.00 2.97 N ATOM 424 NH2 ARG A 25 5.302 -16.712 -6.837 1.00 4.30 N ATOM 0 H ARG A 25 8.535 -12.833 -0.030 1.00 0.86 H new ATOM 0 HA ARG A 25 9.472 -12.649 -2.662 1.00 0.88 H new ATOM 0 HB2 ARG A 25 7.908 -14.387 -1.706 1.00 1.02 H new ATOM 0 HB3 ARG A 25 6.614 -13.206 -1.737 1.00 1.02 H new ATOM 0 HG2 ARG A 25 6.675 -13.040 -4.150 1.00 1.57 H new ATOM 0 HG3 ARG A 25 8.231 -13.839 -4.247 1.00 1.57 H new ATOM 0 HD2 ARG A 25 7.276 -15.975 -3.548 1.00 1.58 H new ATOM 0 HD3 ARG A 25 5.754 -15.223 -3.111 1.00 1.58 H new ATOM 0 HE ARG A 25 6.038 -14.563 -5.840 1.00 2.68 H new ATOM 0 HH11 ARG A 25 6.144 -17.438 -3.853 1.00 2.97 H new ATOM 0 HH12 ARG A 25 5.525 -18.494 -5.127 1.00 2.97 H new ATOM 0 HH21 ARG A 25 5.246 -15.914 -7.470 1.00 4.30 H new ATOM 0 HH22 ARG A 25 5.021 -17.639 -7.157 1.00 4.30 H new ATOM 438 N GLN A 26 7.040 -10.494 -2.028 1.00 0.72 N ATOM 439 CA GLN A 26 6.432 -9.236 -2.545 1.00 0.68 C ATOM 440 C GLN A 26 7.487 -8.128 -2.546 1.00 0.59 C ATOM 441 O GLN A 26 7.450 -7.223 -3.353 1.00 0.61 O ATOM 442 CB GLN A 26 5.262 -8.829 -1.646 1.00 0.77 C ATOM 443 CG GLN A 26 4.491 -7.679 -2.298 1.00 1.39 C ATOM 444 CD GLN A 26 3.756 -8.194 -3.537 1.00 1.92 C ATOM 445 OE1 GLN A 26 3.045 -9.176 -3.471 1.00 2.65 O ATOM 446 NE2 GLN A 26 3.899 -7.567 -4.673 1.00 2.31 N ATOM 0 H GLN A 26 6.661 -10.827 -1.141 1.00 0.72 H new ATOM 0 HA GLN A 26 6.069 -9.395 -3.561 1.00 0.68 H new ATOM 0 HB2 GLN A 26 4.600 -9.680 -1.486 1.00 0.77 H new ATOM 0 HB3 GLN A 26 5.631 -8.524 -0.667 1.00 0.77 H new ATOM 0 HG2 GLN A 26 3.779 -7.257 -1.589 1.00 1.39 H new ATOM 0 HG3 GLN A 26 5.177 -6.879 -2.576 1.00 1.39 H new ATOM 0 HE21 GLN A 26 4.496 -6.742 -4.729 1.00 2.31 H new ATOM 0 HE22 GLN A 26 3.413 -7.902 -5.505 1.00 2.31 H new ATOM 455 N PHE A 27 8.431 -8.196 -1.647 1.00 0.51 N ATOM 456 CA PHE A 27 9.493 -7.150 -1.594 1.00 0.43 C ATOM 457 C PHE A 27 10.395 -7.288 -2.826 1.00 0.42 C ATOM 458 O PHE A 27 10.493 -6.393 -3.642 1.00 0.41 O ATOM 459 CB PHE A 27 10.323 -7.344 -0.313 1.00 0.46 C ATOM 460 CG PHE A 27 11.005 -6.045 0.073 1.00 0.42 C ATOM 461 CD1 PHE A 27 12.030 -5.525 -0.728 1.00 0.41 C ATOM 462 CD2 PHE A 27 10.613 -5.364 1.234 1.00 0.49 C ATOM 463 CE1 PHE A 27 12.659 -4.326 -0.369 1.00 0.42 C ATOM 464 CE2 PHE A 27 11.242 -4.167 1.592 1.00 0.48 C ATOM 465 CZ PHE A 27 12.266 -3.648 0.790 1.00 0.41 C ATOM 0 H PHE A 27 8.513 -8.932 -0.946 1.00 0.51 H new ATOM 0 HA PHE A 27 9.043 -6.157 -1.587 1.00 0.43 H new ATOM 0 HB2 PHE A 27 9.678 -7.680 0.499 1.00 0.46 H new ATOM 0 HB3 PHE A 27 11.070 -8.122 -0.470 1.00 0.46 H new ATOM 0 HD1 PHE A 27 12.335 -6.048 -1.622 1.00 0.41 H new ATOM 0 HD2 PHE A 27 9.824 -5.764 1.853 1.00 0.49 H new ATOM 0 HE1 PHE A 27 13.448 -3.925 -0.987 1.00 0.42 H new ATOM 0 HE2 PHE A 27 10.938 -3.643 2.486 1.00 0.48 H new ATOM 0 HZ PHE A 27 12.752 -2.724 1.066 1.00 0.41 H new ATOM 475 N ARG A 28 11.058 -8.406 -2.962 1.00 0.49 N ATOM 476 CA ARG A 28 11.958 -8.608 -4.133 1.00 0.53 C ATOM 477 C ARG A 28 11.145 -8.557 -5.429 1.00 0.54 C ATOM 478 O ARG A 28 11.558 -7.969 -6.408 1.00 0.55 O ATOM 479 CB ARG A 28 12.645 -9.970 -4.017 1.00 0.62 C ATOM 480 CG ARG A 28 13.584 -10.172 -5.209 1.00 0.68 C ATOM 481 CD ARG A 28 14.550 -11.321 -4.911 1.00 0.94 C ATOM 482 NE ARG A 28 15.209 -11.757 -6.174 1.00 1.61 N ATOM 483 CZ ARG A 28 16.275 -12.508 -6.128 1.00 1.98 C ATOM 484 NH1 ARG A 28 16.764 -12.877 -4.976 1.00 1.97 N ATOM 485 NH2 ARG A 28 16.852 -12.890 -7.234 1.00 2.80 N ATOM 0 H ARG A 28 11.014 -9.189 -2.310 1.00 0.49 H new ATOM 0 HA ARG A 28 12.709 -7.818 -4.149 1.00 0.53 H new ATOM 0 HB2 ARG A 28 13.206 -10.028 -3.084 1.00 0.62 H new ATOM 0 HB3 ARG A 28 11.899 -10.764 -3.990 1.00 0.62 H new ATOM 0 HG2 ARG A 28 13.007 -10.392 -6.107 1.00 0.68 H new ATOM 0 HG3 ARG A 28 14.141 -9.256 -5.405 1.00 0.68 H new ATOM 0 HD2 ARG A 28 15.301 -11.001 -4.188 1.00 0.94 H new ATOM 0 HD3 ARG A 28 14.011 -12.156 -4.462 1.00 0.94 H new ATOM 0 HE ARG A 28 14.827 -11.468 -7.075 1.00 1.61 H new ATOM 0 HH11 ARG A 28 16.313 -12.578 -4.111 1.00 1.97 H new ATOM 0 HH12 ARG A 28 17.597 -13.464 -4.940 1.00 1.97 H new ATOM 0 HH21 ARG A 28 16.470 -12.602 -8.135 1.00 2.80 H new ATOM 0 HH22 ARG A 28 17.685 -13.477 -7.198 1.00 2.80 H new ATOM 499 N LYS A 29 9.992 -9.168 -5.446 1.00 0.57 N ATOM 500 CA LYS A 29 9.163 -9.147 -6.683 1.00 0.60 C ATOM 501 C LYS A 29 8.757 -7.705 -6.988 1.00 0.53 C ATOM 502 O LYS A 29 9.129 -7.147 -7.999 1.00 0.57 O ATOM 503 CB LYS A 29 7.906 -10.002 -6.473 1.00 0.65 C ATOM 504 CG LYS A 29 7.156 -10.188 -7.808 1.00 0.86 C ATOM 505 CD LYS A 29 7.709 -11.403 -8.563 1.00 1.19 C ATOM 506 CE LYS A 29 7.090 -11.461 -9.960 1.00 1.60 C ATOM 507 NZ LYS A 29 5.646 -11.811 -9.850 1.00 2.38 N ATOM 0 H LYS A 29 9.590 -9.679 -4.660 1.00 0.57 H new ATOM 0 HA LYS A 29 9.737 -9.551 -7.517 1.00 0.60 H new ATOM 0 HB2 LYS A 29 8.183 -10.974 -6.065 1.00 0.65 H new ATOM 0 HB3 LYS A 29 7.251 -9.525 -5.744 1.00 0.65 H new ATOM 0 HG2 LYS A 29 6.091 -10.322 -7.619 1.00 0.86 H new ATOM 0 HG3 LYS A 29 7.261 -9.292 -8.420 1.00 0.86 H new ATOM 0 HD2 LYS A 29 8.794 -11.335 -8.637 1.00 1.19 H new ATOM 0 HD3 LYS A 29 7.483 -12.318 -8.016 1.00 1.19 H new ATOM 0 HE2 LYS A 29 7.205 -10.499 -10.460 1.00 1.60 H new ATOM 0 HE3 LYS A 29 7.609 -12.201 -10.569 1.00 1.60 H new ATOM 0 HZ1 LYS A 29 5.266 -12.016 -10.796 1.00 2.38 H new ATOM 0 HZ2 LYS A 29 5.537 -12.649 -9.243 1.00 2.38 H new ATOM 0 HZ3 LYS A 29 5.126 -11.012 -9.434 1.00 2.38 H new ATOM 521 N THR A 30 8.000 -7.099 -6.115 1.00 0.46 N ATOM 522 CA THR A 30 7.570 -5.691 -6.346 1.00 0.40 C ATOM 523 C THR A 30 8.787 -4.839 -6.729 1.00 0.38 C ATOM 524 O THR A 30 8.657 -3.793 -7.332 1.00 0.40 O ATOM 525 CB THR A 30 6.941 -5.140 -5.063 1.00 0.38 C ATOM 526 OG1 THR A 30 5.889 -6.001 -4.648 1.00 0.46 O ATOM 527 CG2 THR A 30 6.383 -3.740 -5.319 1.00 0.35 C ATOM 0 H THR A 30 7.660 -7.519 -5.250 1.00 0.46 H new ATOM 0 HA THR A 30 6.840 -5.659 -7.155 1.00 0.40 H new ATOM 0 HB THR A 30 7.700 -5.086 -4.283 1.00 0.38 H new ATOM 0 HG1 THR A 30 6.267 -6.838 -4.307 1.00 0.46 H new ATOM 0 HG21 THR A 30 5.937 -3.353 -4.403 1.00 0.35 H new ATOM 0 HG22 THR A 30 7.190 -3.079 -5.637 1.00 0.35 H new ATOM 0 HG23 THR A 30 5.624 -3.788 -6.100 1.00 0.35 H new ATOM 535 N PHE A 31 9.970 -5.277 -6.381 1.00 0.42 N ATOM 536 CA PHE A 31 11.191 -4.488 -6.723 1.00 0.45 C ATOM 537 C PHE A 31 11.492 -4.617 -8.219 1.00 0.52 C ATOM 538 O PHE A 31 11.229 -3.717 -8.992 1.00 0.55 O ATOM 539 CB PHE A 31 12.384 -5.007 -5.911 1.00 0.50 C ATOM 540 CG PHE A 31 13.503 -3.991 -5.940 1.00 0.53 C ATOM 541 CD1 PHE A 31 14.462 -4.036 -6.958 1.00 0.61 C ATOM 542 CD2 PHE A 31 13.580 -3.005 -4.948 1.00 0.54 C ATOM 543 CE1 PHE A 31 15.499 -3.095 -6.985 1.00 0.66 C ATOM 544 CE2 PHE A 31 14.617 -2.065 -4.976 1.00 0.58 C ATOM 545 CZ PHE A 31 15.576 -2.110 -5.994 1.00 0.63 C ATOM 0 H PHE A 31 10.143 -6.146 -5.875 1.00 0.42 H new ATOM 0 HA PHE A 31 11.018 -3.439 -6.482 1.00 0.45 H new ATOM 0 HB2 PHE A 31 12.080 -5.198 -4.882 1.00 0.50 H new ATOM 0 HB3 PHE A 31 12.731 -5.955 -6.322 1.00 0.50 H new ATOM 0 HD1 PHE A 31 14.403 -4.796 -7.723 1.00 0.61 H new ATOM 0 HD2 PHE A 31 12.840 -2.970 -4.162 1.00 0.54 H new ATOM 0 HE1 PHE A 31 16.239 -3.130 -7.771 1.00 0.66 H new ATOM 0 HE2 PHE A 31 14.677 -1.305 -4.211 1.00 0.58 H new ATOM 0 HZ PHE A 31 16.376 -1.384 -6.015 1.00 0.63 H new ATOM 555 N GLU A 32 12.042 -5.726 -8.637 1.00 0.60 N ATOM 556 CA GLU A 32 12.356 -5.901 -10.086 1.00 0.69 C ATOM 557 C GLU A 32 11.129 -5.525 -10.920 1.00 0.69 C ATOM 558 O GLU A 32 11.207 -5.351 -12.120 1.00 0.86 O ATOM 559 CB GLU A 32 12.730 -7.360 -10.355 1.00 0.78 C ATOM 560 CG GLU A 32 14.129 -7.639 -9.803 1.00 0.83 C ATOM 561 CD GLU A 32 14.383 -9.148 -9.794 1.00 1.47 C ATOM 562 OE1 GLU A 32 13.512 -9.872 -9.341 1.00 2.16 O ATOM 563 OE2 GLU A 32 15.443 -9.553 -10.240 1.00 2.02 O ATOM 0 H GLU A 32 12.287 -6.516 -8.040 1.00 0.60 H new ATOM 0 HA GLU A 32 13.192 -5.257 -10.358 1.00 0.69 H new ATOM 0 HB2 GLU A 32 12.004 -8.025 -9.887 1.00 0.78 H new ATOM 0 HB3 GLU A 32 12.703 -7.562 -11.426 1.00 0.78 H new ATOM 0 HG2 GLU A 32 14.879 -7.137 -10.414 1.00 0.83 H new ATOM 0 HG3 GLU A 32 14.220 -7.238 -8.793 1.00 0.83 H new ATOM 570 N GLU A 33 9.996 -5.400 -10.286 1.00 0.59 N ATOM 571 CA GLU A 33 8.750 -5.036 -11.019 1.00 0.62 C ATOM 572 C GLU A 33 8.637 -3.508 -11.090 1.00 0.62 C ATOM 573 O GLU A 33 8.072 -2.960 -12.016 1.00 0.79 O ATOM 574 CB GLU A 33 7.549 -5.618 -10.253 1.00 0.59 C ATOM 575 CG GLU A 33 7.248 -7.039 -10.742 1.00 0.80 C ATOM 576 CD GLU A 33 6.672 -6.981 -12.158 1.00 1.39 C ATOM 577 OE1 GLU A 33 5.500 -6.665 -12.287 1.00 1.97 O ATOM 578 OE2 GLU A 33 7.412 -7.254 -13.089 1.00 1.84 O ATOM 0 H GLU A 33 9.879 -5.536 -9.282 1.00 0.59 H new ATOM 0 HA GLU A 33 8.770 -5.438 -12.032 1.00 0.62 H new ATOM 0 HB2 GLU A 33 7.762 -5.631 -9.184 1.00 0.59 H new ATOM 0 HB3 GLU A 33 6.675 -4.983 -10.396 1.00 0.59 H new ATOM 0 HG2 GLU A 33 8.158 -7.638 -10.733 1.00 0.80 H new ATOM 0 HG3 GLU A 33 6.540 -7.524 -10.070 1.00 0.80 H new ATOM 585 N ALA A 34 9.164 -2.819 -10.115 1.00 0.53 N ATOM 586 CA ALA A 34 9.080 -1.331 -10.124 1.00 0.59 C ATOM 587 C ALA A 34 10.117 -0.763 -11.102 1.00 0.81 C ATOM 588 O ALA A 34 9.981 0.340 -11.591 1.00 0.76 O ATOM 589 CB ALA A 34 9.333 -0.803 -8.698 1.00 0.52 C ATOM 0 H ALA A 34 9.649 -3.222 -9.313 1.00 0.53 H new ATOM 0 HA ALA A 34 8.089 -1.015 -10.449 1.00 0.59 H new ATOM 0 HB1 ALA A 34 9.273 0.285 -8.697 1.00 0.52 H new ATOM 0 HB2 ALA A 34 8.581 -1.208 -8.021 1.00 0.52 H new ATOM 0 HB3 ALA A 34 10.324 -1.112 -8.366 1.00 0.52 H new ATOM 595 N GLY A 35 11.147 -1.509 -11.392 1.00 1.09 N ATOM 596 CA GLY A 35 12.183 -1.007 -12.339 1.00 1.34 C ATOM 597 C GLY A 35 11.572 -0.877 -13.735 1.00 1.04 C ATOM 598 O GLY A 35 12.251 -0.575 -14.696 1.00 1.15 O ATOM 0 H GLY A 35 11.316 -2.442 -11.016 1.00 1.09 H new ATOM 0 HA2 GLY A 35 12.561 -0.041 -12.004 1.00 1.34 H new ATOM 0 HA3 GLY A 35 13.032 -1.691 -12.363 1.00 1.34 H new ATOM 602 N LYS A 36 10.291 -1.107 -13.854 1.00 0.97 N ATOM 603 CA LYS A 36 9.628 -1.001 -15.187 1.00 1.31 C ATOM 604 C LYS A 36 9.199 0.447 -15.434 1.00 1.10 C ATOM 605 O LYS A 36 9.396 0.987 -16.504 1.00 1.16 O ATOM 606 CB LYS A 36 8.392 -1.907 -15.215 1.00 1.75 C ATOM 607 CG LYS A 36 8.792 -3.362 -14.919 1.00 2.05 C ATOM 608 CD LYS A 36 9.320 -4.038 -16.191 1.00 1.95 C ATOM 609 CE LYS A 36 9.571 -5.521 -15.913 1.00 2.13 C ATOM 610 NZ LYS A 36 9.789 -6.237 -17.202 1.00 2.94 N ATOM 0 H LYS A 36 9.674 -1.364 -13.084 1.00 0.97 H new ATOM 0 HA LYS A 36 10.327 -1.310 -15.964 1.00 1.31 H new ATOM 0 HB2 LYS A 36 7.665 -1.565 -14.478 1.00 1.75 H new ATOM 0 HB3 LYS A 36 7.910 -1.846 -16.191 1.00 1.75 H new ATOM 0 HG2 LYS A 36 9.556 -3.385 -14.142 1.00 2.05 H new ATOM 0 HG3 LYS A 36 7.932 -3.912 -14.537 1.00 2.05 H new ATOM 0 HD2 LYS A 36 8.600 -3.926 -17.001 1.00 1.95 H new ATOM 0 HD3 LYS A 36 10.242 -3.557 -16.516 1.00 1.95 H new ATOM 0 HE2 LYS A 36 10.441 -5.639 -15.267 1.00 2.13 H new ATOM 0 HE3 LYS A 36 8.721 -5.952 -15.384 1.00 2.13 H new ATOM 0 HZ1 LYS A 36 9.960 -7.246 -17.014 1.00 2.94 H new ATOM 0 HZ2 LYS A 36 8.946 -6.134 -17.803 1.00 2.94 H new ATOM 0 HZ3 LYS A 36 10.613 -5.831 -17.689 1.00 2.94 H new ATOM 624 N MET A 37 8.607 1.079 -14.456 1.00 1.00 N ATOM 625 CA MET A 37 8.162 2.488 -14.646 1.00 0.93 C ATOM 626 C MET A 37 9.376 3.430 -14.532 1.00 0.93 C ATOM 627 O MET A 37 10.175 3.295 -13.628 1.00 1.11 O ATOM 628 CB MET A 37 7.136 2.847 -13.565 1.00 0.95 C ATOM 629 CG MET A 37 6.196 1.662 -13.337 1.00 1.33 C ATOM 630 SD MET A 37 4.810 2.183 -12.295 1.00 1.72 S ATOM 631 CE MET A 37 5.779 2.640 -10.835 1.00 0.57 C ATOM 0 H MET A 37 8.413 0.681 -13.537 1.00 1.00 H new ATOM 0 HA MET A 37 7.709 2.597 -15.631 1.00 0.93 H new ATOM 0 HB2 MET A 37 7.646 3.104 -12.636 1.00 0.95 H new ATOM 0 HB3 MET A 37 6.565 3.724 -13.868 1.00 0.95 H new ATOM 0 HG2 MET A 37 5.827 1.288 -14.292 1.00 1.33 H new ATOM 0 HG3 MET A 37 6.735 0.843 -12.861 1.00 1.33 H new ATOM 0 HE1 MET A 37 5.132 2.653 -9.958 1.00 0.57 H new ATOM 0 HE2 MET A 37 6.577 1.913 -10.686 1.00 0.57 H new ATOM 0 HE3 MET A 37 6.212 3.630 -10.981 1.00 0.57 H new ATOM 641 N PRO A 38 9.518 4.383 -15.428 1.00 1.04 N ATOM 642 CA PRO A 38 10.655 5.349 -15.394 1.00 1.23 C ATOM 643 C PRO A 38 10.452 6.435 -14.330 1.00 1.52 C ATOM 644 O PRO A 38 9.406 7.048 -14.250 1.00 2.12 O ATOM 645 CB PRO A 38 10.638 5.955 -16.798 1.00 1.48 C ATOM 646 CG PRO A 38 9.201 5.925 -17.186 1.00 1.49 C ATOM 647 CD PRO A 38 8.625 4.653 -16.572 1.00 1.29 C ATOM 0 HA PRO A 38 11.600 4.872 -15.136 1.00 1.23 H new ATOM 0 HB2 PRO A 38 11.030 6.972 -16.799 1.00 1.48 H new ATOM 0 HB3 PRO A 38 11.250 5.377 -17.490 1.00 1.48 H new ATOM 0 HG2 PRO A 38 8.679 6.808 -16.816 1.00 1.49 H new ATOM 0 HG3 PRO A 38 9.090 5.920 -18.270 1.00 1.49 H new ATOM 0 HD2 PRO A 38 7.593 4.795 -16.250 1.00 1.29 H new ATOM 0 HD3 PRO A 38 8.626 3.828 -17.284 1.00 1.29 H new ATOM 655 N GLY A 39 11.446 6.683 -13.515 1.00 1.91 N ATOM 656 CA GLY A 39 11.312 7.735 -12.459 1.00 2.60 C ATOM 657 C GLY A 39 12.017 7.274 -11.182 1.00 1.97 C ATOM 658 O GLY A 39 11.384 6.968 -10.192 1.00 2.28 O ATOM 0 H GLY A 39 12.346 6.203 -13.534 1.00 1.91 H new ATOM 0 HA2 GLY A 39 11.746 8.672 -12.808 1.00 2.60 H new ATOM 0 HA3 GLY A 39 10.259 7.928 -12.255 1.00 2.60 H new ATOM 662 N LYS A 40 13.322 7.227 -11.194 1.00 1.59 N ATOM 663 CA LYS A 40 14.069 6.793 -9.980 1.00 1.16 C ATOM 664 C LYS A 40 13.528 5.447 -9.487 1.00 0.90 C ATOM 665 O LYS A 40 12.490 5.374 -8.860 1.00 0.79 O ATOM 666 CB LYS A 40 13.912 7.856 -8.886 1.00 1.70 C ATOM 667 CG LYS A 40 14.892 9.019 -9.150 1.00 1.91 C ATOM 668 CD LYS A 40 14.319 10.323 -8.600 1.00 2.75 C ATOM 669 CE LYS A 40 14.175 10.222 -7.081 1.00 3.21 C ATOM 670 NZ LYS A 40 13.874 11.569 -6.519 1.00 4.02 N ATOM 0 H LYS A 40 13.904 7.471 -11.995 1.00 1.59 H new ATOM 0 HA LYS A 40 15.125 6.676 -10.223 1.00 1.16 H new ATOM 0 HB2 LYS A 40 12.887 8.227 -8.870 1.00 1.70 H new ATOM 0 HB3 LYS A 40 14.108 7.417 -7.908 1.00 1.70 H new ATOM 0 HG2 LYS A 40 15.853 8.809 -8.681 1.00 1.91 H new ATOM 0 HG3 LYS A 40 15.074 9.116 -10.220 1.00 1.91 H new ATOM 0 HD2 LYS A 40 14.972 11.156 -8.858 1.00 2.75 H new ATOM 0 HD3 LYS A 40 13.349 10.526 -9.054 1.00 2.75 H new ATOM 0 HE2 LYS A 40 13.378 9.524 -6.826 1.00 3.21 H new ATOM 0 HE3 LYS A 40 15.093 9.831 -6.643 1.00 3.21 H new ATOM 0 HZ1 LYS A 40 13.776 11.500 -5.486 1.00 4.02 H new ATOM 0 HZ2 LYS A 40 14.649 12.223 -6.751 1.00 4.02 H new ATOM 0 HZ3 LYS A 40 12.987 11.925 -6.928 1.00 4.02 H new ATOM 684 N HIS A 41 14.230 4.381 -9.762 1.00 0.88 N ATOM 685 CA HIS A 41 13.767 3.036 -9.309 1.00 0.79 C ATOM 686 C HIS A 41 13.333 3.109 -7.842 1.00 0.59 C ATOM 687 O HIS A 41 12.254 2.684 -7.481 1.00 0.59 O ATOM 688 CB HIS A 41 14.916 2.033 -9.454 1.00 0.90 C ATOM 689 CG HIS A 41 14.383 0.629 -9.360 1.00 0.77 C ATOM 690 ND1 HIS A 41 14.713 -0.350 -10.288 1.00 1.04 N ATOM 691 CD2 HIS A 41 13.548 0.021 -8.455 1.00 1.26 C ATOM 692 CE1 HIS A 41 14.085 -1.484 -9.923 1.00 1.63 C ATOM 693 NE2 HIS A 41 13.364 -1.309 -8.814 1.00 1.76 N ATOM 0 H HIS A 41 15.107 4.383 -10.283 1.00 0.88 H new ATOM 0 HA HIS A 41 12.922 2.716 -9.918 1.00 0.79 H new ATOM 0 HB2 HIS A 41 15.418 2.178 -10.410 1.00 0.90 H new ATOM 0 HB3 HIS A 41 15.659 2.202 -8.675 1.00 0.90 H new ATOM 0 HD2 HIS A 41 13.103 0.502 -7.597 1.00 1.26 H new ATOM 0 HE1 HIS A 41 14.156 -2.418 -10.461 1.00 1.63 H new ATOM 0 HE2 HIS A 41 12.797 -2.005 -8.331 1.00 1.76 H new ATOM 702 N GLY A 42 14.168 3.648 -6.995 1.00 0.54 N ATOM 703 CA GLY A 42 13.808 3.748 -5.551 1.00 0.56 C ATOM 704 C GLY A 42 12.386 4.294 -5.405 1.00 0.52 C ATOM 705 O GLY A 42 11.532 3.674 -4.803 1.00 0.54 O ATOM 0 H GLY A 42 15.084 4.023 -7.241 1.00 0.54 H new ATOM 0 HA2 GLY A 42 13.880 2.767 -5.081 1.00 0.56 H new ATOM 0 HA3 GLY A 42 14.512 4.401 -5.036 1.00 0.56 H new ATOM 709 N GLU A 43 12.124 5.452 -5.948 1.00 0.50 N ATOM 710 CA GLU A 43 10.757 6.036 -5.835 1.00 0.49 C ATOM 711 C GLU A 43 9.715 4.981 -6.217 1.00 0.40 C ATOM 712 O GLU A 43 8.787 4.715 -5.480 1.00 0.41 O ATOM 713 CB GLU A 43 10.638 7.238 -6.776 1.00 0.53 C ATOM 714 CG GLU A 43 9.411 8.069 -6.394 1.00 1.01 C ATOM 715 CD GLU A 43 9.705 8.861 -5.118 1.00 1.70 C ATOM 716 OE1 GLU A 43 10.638 9.647 -5.135 1.00 2.45 O ATOM 717 OE2 GLU A 43 8.994 8.667 -4.147 1.00 2.29 O ATOM 0 H GLU A 43 12.797 6.018 -6.465 1.00 0.50 H new ATOM 0 HA GLU A 43 10.584 6.359 -4.808 1.00 0.49 H new ATOM 0 HB2 GLU A 43 11.538 7.850 -6.716 1.00 0.53 H new ATOM 0 HB3 GLU A 43 10.553 6.898 -7.808 1.00 0.53 H new ATOM 0 HG2 GLU A 43 9.153 8.750 -7.205 1.00 1.01 H new ATOM 0 HG3 GLU A 43 8.551 7.417 -6.240 1.00 1.01 H new ATOM 724 N ASN A 44 9.861 4.378 -7.366 1.00 0.34 N ATOM 725 CA ASN A 44 8.880 3.341 -7.799 1.00 0.29 C ATOM 726 C ASN A 44 8.625 2.359 -6.646 1.00 0.27 C ATOM 727 O ASN A 44 7.505 2.160 -6.226 1.00 0.35 O ATOM 728 CB ASN A 44 9.442 2.591 -9.011 1.00 0.31 C ATOM 729 CG ASN A 44 10.136 3.582 -9.947 1.00 0.78 C ATOM 730 OD1 ASN A 44 10.070 4.778 -9.744 1.00 1.53 O ATOM 731 ND2 ASN A 44 10.804 3.131 -10.974 1.00 1.39 N ATOM 0 H ASN A 44 10.618 4.559 -8.025 1.00 0.34 H new ATOM 0 HA ASN A 44 7.938 3.817 -8.073 1.00 0.29 H new ATOM 0 HB2 ASN A 44 10.148 1.827 -8.684 1.00 0.31 H new ATOM 0 HB3 ASN A 44 8.639 2.077 -9.539 1.00 0.31 H new ATOM 0 HD21 ASN A 44 11.270 3.783 -11.605 1.00 1.39 H new ATOM 0 HD22 ASN A 44 10.860 2.127 -11.145 1.00 1.39 H new ATOM 738 N PHE A 45 9.653 1.746 -6.125 1.00 0.25 N ATOM 739 CA PHE A 45 9.448 0.787 -5.000 1.00 0.25 C ATOM 740 C PHE A 45 8.660 1.477 -3.883 1.00 0.26 C ATOM 741 O PHE A 45 7.758 0.906 -3.302 1.00 0.29 O ATOM 742 CB PHE A 45 10.808 0.330 -4.463 1.00 0.31 C ATOM 743 CG PHE A 45 10.617 -0.805 -3.479 1.00 0.21 C ATOM 744 CD1 PHE A 45 10.102 -2.033 -3.916 1.00 0.35 C ATOM 745 CD2 PHE A 45 10.961 -0.636 -2.131 1.00 0.35 C ATOM 746 CE1 PHE A 45 9.932 -3.085 -3.009 1.00 0.48 C ATOM 747 CE2 PHE A 45 10.789 -1.690 -1.226 1.00 0.42 C ATOM 748 CZ PHE A 45 10.274 -2.913 -1.665 1.00 0.46 C ATOM 0 H PHE A 45 10.620 1.866 -6.426 1.00 0.25 H new ATOM 0 HA PHE A 45 8.891 -0.080 -5.356 1.00 0.25 H new ATOM 0 HB2 PHE A 45 11.444 0.006 -5.287 1.00 0.31 H new ATOM 0 HB3 PHE A 45 11.316 1.163 -3.977 1.00 0.31 H new ATOM 0 HD1 PHE A 45 9.836 -2.168 -4.954 1.00 0.35 H new ATOM 0 HD2 PHE A 45 11.359 0.308 -1.790 1.00 0.35 H new ATOM 0 HE1 PHE A 45 9.536 -4.031 -3.348 1.00 0.48 H new ATOM 0 HE2 PHE A 45 11.055 -1.558 -0.187 1.00 0.42 H new ATOM 0 HZ PHE A 45 10.140 -3.725 -0.966 1.00 0.46 H new ATOM 758 N MET A 46 8.990 2.703 -3.584 1.00 0.30 N ATOM 759 CA MET A 46 8.260 3.438 -2.511 1.00 0.37 C ATOM 760 C MET A 46 6.849 3.783 -3.000 1.00 0.36 C ATOM 761 O MET A 46 6.006 4.211 -2.237 1.00 0.46 O ATOM 762 CB MET A 46 9.015 4.736 -2.181 1.00 0.44 C ATOM 763 CG MET A 46 10.294 4.442 -1.360 1.00 0.43 C ATOM 764 SD MET A 46 10.533 5.743 -0.121 1.00 1.04 S ATOM 765 CE MET A 46 9.276 5.180 1.059 1.00 0.44 C ATOM 0 H MET A 46 9.736 3.230 -4.038 1.00 0.30 H new ATOM 0 HA MET A 46 8.195 2.814 -1.620 1.00 0.37 H new ATOM 0 HB2 MET A 46 9.282 5.250 -3.104 1.00 0.44 H new ATOM 0 HB3 MET A 46 8.364 5.406 -1.619 1.00 0.44 H new ATOM 0 HG2 MET A 46 10.210 3.471 -0.871 1.00 0.43 H new ATOM 0 HG3 MET A 46 11.159 4.392 -2.021 1.00 0.43 H new ATOM 0 HE1 MET A 46 8.784 6.044 1.506 1.00 0.44 H new ATOM 0 HE2 MET A 46 8.537 4.570 0.540 1.00 0.44 H new ATOM 0 HE3 MET A 46 9.751 4.587 1.841 1.00 0.44 H new ATOM 775 N ILE A 47 6.587 3.606 -4.269 1.00 0.30 N ATOM 776 CA ILE A 47 5.233 3.930 -4.816 1.00 0.32 C ATOM 777 C ILE A 47 4.374 2.657 -4.858 1.00 0.31 C ATOM 778 O ILE A 47 3.177 2.705 -4.654 1.00 0.41 O ATOM 779 CB ILE A 47 5.398 4.514 -6.227 1.00 0.33 C ATOM 780 CG1 ILE A 47 5.945 5.943 -6.122 1.00 0.36 C ATOM 781 CG2 ILE A 47 4.059 4.543 -6.960 1.00 0.39 C ATOM 782 CD1 ILE A 47 6.397 6.435 -7.502 1.00 0.36 C ATOM 0 H ILE A 47 7.254 3.250 -4.953 1.00 0.30 H new ATOM 0 HA ILE A 47 4.735 4.661 -4.179 1.00 0.32 H new ATOM 0 HB ILE A 47 6.090 3.885 -6.786 1.00 0.33 H new ATOM 0 HG12 ILE A 47 5.177 6.607 -5.724 1.00 0.36 H new ATOM 0 HG13 ILE A 47 6.783 5.970 -5.425 1.00 0.36 H new ATOM 0 HG21 ILE A 47 4.199 4.960 -7.957 1.00 0.39 H new ATOM 0 HG22 ILE A 47 3.667 3.529 -7.043 1.00 0.39 H new ATOM 0 HG23 ILE A 47 3.353 5.160 -6.404 1.00 0.39 H new ATOM 0 HD11 ILE A 47 6.784 7.451 -7.417 1.00 0.36 H new ATOM 0 HD12 ILE A 47 7.179 5.779 -7.884 1.00 0.36 H new ATOM 0 HD13 ILE A 47 5.549 6.426 -8.187 1.00 0.36 H new ATOM 794 N LEU A 48 4.966 1.519 -5.117 1.00 0.29 N ATOM 795 CA LEU A 48 4.159 0.262 -5.161 1.00 0.31 C ATOM 796 C LEU A 48 3.801 -0.165 -3.735 1.00 0.32 C ATOM 797 O LEU A 48 2.695 -0.589 -3.465 1.00 0.36 O ATOM 798 CB LEU A 48 4.958 -0.863 -5.838 1.00 0.32 C ATOM 799 CG LEU A 48 5.526 -0.395 -7.186 1.00 0.36 C ATOM 800 CD1 LEU A 48 6.044 -1.606 -7.965 1.00 0.37 C ATOM 801 CD2 LEU A 48 4.435 0.298 -8.009 1.00 0.45 C ATOM 0 H LEU A 48 5.963 1.406 -5.298 1.00 0.29 H new ATOM 0 HA LEU A 48 3.250 0.449 -5.733 1.00 0.31 H new ATOM 0 HB2 LEU A 48 5.772 -1.180 -5.186 1.00 0.32 H new ATOM 0 HB3 LEU A 48 4.316 -1.730 -5.991 1.00 0.32 H new ATOM 0 HG LEU A 48 6.338 0.308 -7.002 1.00 0.36 H new ATOM 0 HD11 LEU A 48 6.448 -1.277 -8.922 1.00 0.37 H new ATOM 0 HD12 LEU A 48 6.828 -2.100 -7.391 1.00 0.37 H new ATOM 0 HD13 LEU A 48 5.226 -2.305 -8.137 1.00 0.37 H new ATOM 0 HD21 LEU A 48 4.851 0.625 -8.962 1.00 0.45 H new ATOM 0 HD22 LEU A 48 3.617 -0.400 -8.190 1.00 0.45 H new ATOM 0 HD23 LEU A 48 4.060 1.162 -7.461 1.00 0.45 H new ATOM 813 N LEU A 49 4.726 -0.061 -2.819 1.00 0.31 N ATOM 814 CA LEU A 49 4.431 -0.465 -1.412 1.00 0.34 C ATOM 815 C LEU A 49 3.097 0.145 -0.971 1.00 0.36 C ATOM 816 O LEU A 49 2.351 -0.450 -0.218 1.00 0.44 O ATOM 817 CB LEU A 49 5.541 0.041 -0.488 1.00 0.35 C ATOM 818 CG LEU A 49 6.823 -0.781 -0.691 1.00 0.34 C ATOM 819 CD1 LEU A 49 7.958 -0.136 0.114 1.00 0.37 C ATOM 820 CD2 LEU A 49 6.615 -2.241 -0.224 1.00 0.38 C ATOM 0 H LEU A 49 5.671 0.285 -2.983 1.00 0.31 H new ATOM 0 HA LEU A 49 4.374 -1.552 -1.357 1.00 0.34 H new ATOM 0 HB2 LEU A 49 5.740 1.093 -0.691 1.00 0.35 H new ATOM 0 HB3 LEU A 49 5.218 -0.028 0.551 1.00 0.35 H new ATOM 0 HG LEU A 49 7.076 -0.794 -1.751 1.00 0.34 H new ATOM 0 HD11 LEU A 49 8.874 -0.711 -0.023 1.00 0.37 H new ATOM 0 HD12 LEU A 49 8.116 0.885 -0.233 1.00 0.37 H new ATOM 0 HD13 LEU A 49 7.692 -0.123 1.171 1.00 0.37 H new ATOM 0 HD21 LEU A 49 7.534 -2.806 -0.376 1.00 0.38 H new ATOM 0 HD22 LEU A 49 6.354 -2.251 0.834 1.00 0.38 H new ATOM 0 HD23 LEU A 49 5.810 -2.696 -0.801 1.00 0.38 H new ATOM 832 N GLU A 50 2.795 1.331 -1.426 1.00 0.33 N ATOM 833 CA GLU A 50 1.513 1.984 -1.027 1.00 0.36 C ATOM 834 C GLU A 50 0.388 1.525 -1.957 1.00 0.35 C ATOM 835 O GLU A 50 -0.743 1.362 -1.545 1.00 0.38 O ATOM 836 CB GLU A 50 1.664 3.503 -1.126 1.00 0.43 C ATOM 837 CG GLU A 50 0.480 4.179 -0.434 1.00 0.68 C ATOM 838 CD GLU A 50 0.666 5.697 -0.467 1.00 1.16 C ATOM 839 OE1 GLU A 50 1.306 6.215 0.433 1.00 1.78 O ATOM 840 OE2 GLU A 50 0.166 6.315 -1.392 1.00 1.89 O ATOM 0 H GLU A 50 3.381 1.877 -2.058 1.00 0.33 H new ATOM 0 HA GLU A 50 1.271 1.705 -0.002 1.00 0.36 H new ATOM 0 HB2 GLU A 50 2.598 3.817 -0.661 1.00 0.43 H new ATOM 0 HB3 GLU A 50 1.710 3.807 -2.172 1.00 0.43 H new ATOM 0 HG2 GLU A 50 -0.450 3.905 -0.932 1.00 0.68 H new ATOM 0 HG3 GLU A 50 0.403 3.834 0.597 1.00 0.68 H new ATOM 847 N SER A 51 0.686 1.318 -3.210 1.00 0.35 N ATOM 848 CA SER A 51 -0.371 0.874 -4.163 1.00 0.38 C ATOM 849 C SER A 51 -0.969 -0.452 -3.687 1.00 0.35 C ATOM 850 O SER A 51 -2.037 -0.845 -4.111 1.00 0.38 O ATOM 851 CB SER A 51 0.242 0.687 -5.551 1.00 0.43 C ATOM 852 OG SER A 51 1.052 1.813 -5.863 1.00 1.36 O ATOM 0 H SER A 51 1.614 1.437 -3.615 1.00 0.35 H new ATOM 0 HA SER A 51 -1.156 1.628 -4.209 1.00 0.38 H new ATOM 0 HB2 SER A 51 0.840 -0.224 -5.577 1.00 0.43 H new ATOM 0 HB3 SER A 51 -0.545 0.573 -6.296 1.00 0.43 H new ATOM 0 HG SER A 51 1.817 1.845 -5.251 1.00 1.36 H new ATOM 858 N ARG A 52 -0.281 -1.150 -2.819 1.00 0.34 N ATOM 859 CA ARG A 52 -0.799 -2.460 -2.320 1.00 0.37 C ATOM 860 C ARG A 52 -2.296 -2.356 -2.011 1.00 0.35 C ATOM 861 O ARG A 52 -2.734 -1.497 -1.272 1.00 0.33 O ATOM 862 CB ARG A 52 -0.044 -2.858 -1.049 1.00 0.41 C ATOM 863 CG ARG A 52 1.409 -3.196 -1.395 1.00 1.06 C ATOM 864 CD ARG A 52 2.073 -3.884 -0.198 1.00 1.36 C ATOM 865 NE ARG A 52 1.529 -3.316 1.067 1.00 1.98 N ATOM 866 CZ ARG A 52 1.713 -3.944 2.196 1.00 2.66 C ATOM 867 NH1 ARG A 52 2.379 -5.066 2.217 1.00 2.78 N ATOM 868 NH2 ARG A 52 1.231 -3.451 3.303 1.00 3.59 N ATOM 0 H ARG A 52 0.620 -0.868 -2.433 1.00 0.34 H new ATOM 0 HA ARG A 52 -0.647 -3.216 -3.091 1.00 0.37 H new ATOM 0 HB2 ARG A 52 -0.075 -2.043 -0.326 1.00 0.41 H new ATOM 0 HB3 ARG A 52 -0.526 -3.717 -0.582 1.00 0.41 H new ATOM 0 HG2 ARG A 52 1.444 -3.848 -2.268 1.00 1.06 H new ATOM 0 HG3 ARG A 52 1.953 -2.288 -1.654 1.00 1.06 H new ATOM 0 HD2 ARG A 52 1.890 -4.958 -0.235 1.00 1.36 H new ATOM 0 HD3 ARG A 52 3.153 -3.743 -0.237 1.00 1.36 H new ATOM 0 HE ARG A 52 1.013 -2.436 1.051 1.00 1.98 H new ATOM 0 HH11 ARG A 52 2.756 -5.452 1.351 1.00 2.78 H new ATOM 0 HH12 ARG A 52 2.523 -5.557 3.099 1.00 2.78 H new ATOM 0 HH21 ARG A 52 0.710 -2.574 3.287 1.00 3.59 H new ATOM 0 HH22 ARG A 52 1.375 -3.942 4.185 1.00 3.59 H new ATOM 882 N LEU A 53 -3.078 -3.228 -2.588 1.00 0.45 N ATOM 883 CA LEU A 53 -4.553 -3.203 -2.359 1.00 0.52 C ATOM 884 C LEU A 53 -4.857 -2.973 -0.873 1.00 0.42 C ATOM 885 O LEU A 53 -5.650 -2.130 -0.522 1.00 0.39 O ATOM 886 CB LEU A 53 -5.157 -4.549 -2.793 1.00 0.75 C ATOM 887 CG LEU A 53 -5.357 -4.595 -4.317 1.00 0.45 C ATOM 888 CD1 LEU A 53 -6.465 -3.617 -4.757 1.00 0.88 C ATOM 889 CD2 LEU A 53 -4.041 -4.241 -5.016 1.00 0.46 C ATOM 0 H LEU A 53 -2.755 -3.965 -3.215 1.00 0.45 H new ATOM 0 HA LEU A 53 -4.987 -2.391 -2.942 1.00 0.52 H new ATOM 0 HB2 LEU A 53 -4.501 -5.363 -2.484 1.00 0.75 H new ATOM 0 HB3 LEU A 53 -6.113 -4.702 -2.292 1.00 0.75 H new ATOM 0 HG LEU A 53 -5.662 -5.603 -4.598 1.00 0.45 H new ATOM 0 HD11 LEU A 53 -6.587 -3.668 -5.839 1.00 0.88 H new ATOM 0 HD12 LEU A 53 -7.403 -3.888 -4.273 1.00 0.88 H new ATOM 0 HD13 LEU A 53 -6.189 -2.602 -4.471 1.00 0.88 H new ATOM 0 HD21 LEU A 53 -4.183 -4.274 -6.096 1.00 0.46 H new ATOM 0 HD22 LEU A 53 -3.730 -3.239 -4.721 1.00 0.46 H new ATOM 0 HD23 LEU A 53 -3.272 -4.958 -4.729 1.00 0.46 H new ATOM 901 N ASP A 54 -4.242 -3.721 -0.001 1.00 0.42 N ATOM 902 CA ASP A 54 -4.522 -3.543 1.453 1.00 0.40 C ATOM 903 C ASP A 54 -4.104 -2.142 1.904 1.00 0.34 C ATOM 904 O ASP A 54 -4.865 -1.434 2.534 1.00 0.39 O ATOM 905 CB ASP A 54 -3.745 -4.590 2.254 1.00 0.49 C ATOM 906 CG ASP A 54 -2.256 -4.487 1.922 1.00 1.60 C ATOM 907 OD1 ASP A 54 -1.604 -3.618 2.477 1.00 2.42 O ATOM 908 OD2 ASP A 54 -1.792 -5.278 1.117 1.00 2.34 O ATOM 0 H ASP A 54 -3.561 -4.445 -0.229 1.00 0.42 H new ATOM 0 HA ASP A 54 -5.591 -3.667 1.626 1.00 0.40 H new ATOM 0 HB2 ASP A 54 -3.902 -4.436 3.322 1.00 0.49 H new ATOM 0 HB3 ASP A 54 -4.112 -5.589 2.019 1.00 0.49 H new ATOM 913 N ASN A 55 -2.903 -1.735 1.596 1.00 0.30 N ATOM 914 CA ASN A 55 -2.444 -0.379 2.018 1.00 0.30 C ATOM 915 C ASN A 55 -3.527 0.656 1.696 1.00 0.26 C ATOM 916 O ASN A 55 -4.114 1.247 2.581 1.00 0.26 O ATOM 917 CB ASN A 55 -1.159 -0.021 1.270 1.00 0.33 C ATOM 918 CG ASN A 55 -0.751 1.413 1.614 1.00 0.43 C ATOM 919 OD1 ASN A 55 0.239 1.632 2.282 1.00 0.99 O ATOM 920 ND2 ASN A 55 -1.479 2.407 1.182 1.00 0.97 N ATOM 0 H ASN A 55 -2.220 -2.281 1.071 1.00 0.30 H new ATOM 0 HA ASN A 55 -2.254 -0.380 3.091 1.00 0.30 H new ATOM 0 HB2 ASN A 55 -0.362 -0.713 1.543 1.00 0.33 H new ATOM 0 HB3 ASN A 55 -1.312 -0.119 0.195 1.00 0.33 H new ATOM 0 HD21 ASN A 55 -1.216 3.367 1.406 1.00 0.97 H new ATOM 0 HD22 ASN A 55 -2.311 2.224 0.621 1.00 0.97 H new ATOM 927 N LEU A 56 -3.785 0.884 0.435 1.00 0.25 N ATOM 928 CA LEU A 56 -4.815 1.879 0.034 1.00 0.23 C ATOM 929 C LEU A 56 -6.058 1.761 0.931 1.00 0.23 C ATOM 930 O LEU A 56 -6.495 2.726 1.520 1.00 0.24 O ATOM 931 CB LEU A 56 -5.186 1.618 -1.447 1.00 0.24 C ATOM 932 CG LEU A 56 -5.196 2.925 -2.244 1.00 0.21 C ATOM 933 CD1 LEU A 56 -5.251 2.606 -3.740 1.00 0.24 C ATOM 934 CD2 LEU A 56 -6.425 3.746 -1.849 1.00 0.23 C ATOM 0 H LEU A 56 -3.318 0.416 -0.342 1.00 0.25 H new ATOM 0 HA LEU A 56 -4.422 2.889 0.148 1.00 0.23 H new ATOM 0 HB2 LEU A 56 -4.472 0.923 -1.888 1.00 0.24 H new ATOM 0 HB3 LEU A 56 -6.167 1.145 -1.503 1.00 0.24 H new ATOM 0 HG LEU A 56 -4.292 3.495 -2.029 1.00 0.21 H new ATOM 0 HD11 LEU A 56 -5.258 3.535 -4.310 1.00 0.24 H new ATOM 0 HD12 LEU A 56 -4.378 2.016 -4.019 1.00 0.24 H new ATOM 0 HD13 LEU A 56 -6.156 2.039 -3.958 1.00 0.24 H new ATOM 0 HD21 LEU A 56 -6.437 4.678 -2.414 1.00 0.23 H new ATOM 0 HD22 LEU A 56 -7.328 3.177 -2.069 1.00 0.23 H new ATOM 0 HD23 LEU A 56 -6.387 3.969 -0.783 1.00 0.23 H new ATOM 946 N VAL A 57 -6.633 0.596 1.040 1.00 0.23 N ATOM 947 CA VAL A 57 -7.843 0.448 1.898 1.00 0.23 C ATOM 948 C VAL A 57 -7.560 1.025 3.288 1.00 0.25 C ATOM 949 O VAL A 57 -8.210 1.954 3.726 1.00 0.28 O ATOM 950 CB VAL A 57 -8.202 -1.040 2.004 1.00 0.26 C ATOM 951 CG1 VAL A 57 -9.467 -1.228 2.849 1.00 0.30 C ATOM 952 CG2 VAL A 57 -8.459 -1.599 0.601 1.00 0.26 C ATOM 0 H VAL A 57 -6.320 -0.256 0.575 1.00 0.23 H new ATOM 0 HA VAL A 57 -8.680 0.990 1.458 1.00 0.23 H new ATOM 0 HB VAL A 57 -7.373 -1.567 2.477 1.00 0.26 H new ATOM 0 HG11 VAL A 57 -9.707 -2.289 2.914 1.00 0.30 H new ATOM 0 HG12 VAL A 57 -9.298 -0.833 3.851 1.00 0.30 H new ATOM 0 HG13 VAL A 57 -10.297 -0.696 2.385 1.00 0.30 H new ATOM 0 HG21 VAL A 57 -8.714 -2.656 0.672 1.00 0.26 H new ATOM 0 HG22 VAL A 57 -9.284 -1.057 0.139 1.00 0.26 H new ATOM 0 HG23 VAL A 57 -7.562 -1.482 -0.007 1.00 0.26 H new ATOM 962 N TYR A 58 -6.602 0.483 3.988 1.00 0.30 N ATOM 963 CA TYR A 58 -6.293 1.006 5.349 1.00 0.32 C ATOM 964 C TYR A 58 -5.970 2.502 5.259 1.00 0.31 C ATOM 965 O TYR A 58 -6.423 3.292 6.063 1.00 0.41 O ATOM 966 CB TYR A 58 -5.096 0.235 5.933 1.00 0.36 C ATOM 967 CG TYR A 58 -4.510 0.980 7.120 1.00 0.44 C ATOM 968 CD1 TYR A 58 -5.340 1.399 8.170 1.00 0.51 C ATOM 969 CD2 TYR A 58 -3.136 1.255 7.167 1.00 0.51 C ATOM 970 CE1 TYR A 58 -4.797 2.090 9.260 1.00 0.61 C ATOM 971 CE2 TYR A 58 -2.595 1.945 8.258 1.00 0.60 C ATOM 972 CZ TYR A 58 -3.425 2.362 9.304 1.00 0.63 C ATOM 973 OH TYR A 58 -2.891 3.043 10.379 1.00 0.74 O ATOM 0 H TYR A 58 -6.022 -0.296 3.678 1.00 0.30 H new ATOM 0 HA TYR A 58 -7.155 0.869 6.002 1.00 0.32 H new ATOM 0 HB2 TYR A 58 -5.413 -0.761 6.242 1.00 0.36 H new ATOM 0 HB3 TYR A 58 -4.332 0.103 5.166 1.00 0.36 H new ATOM 0 HD1 TYR A 58 -6.399 1.188 8.138 1.00 0.51 H new ATOM 0 HD2 TYR A 58 -2.494 0.934 6.360 1.00 0.51 H new ATOM 0 HE1 TYR A 58 -5.437 2.413 10.067 1.00 0.61 H new ATOM 0 HE2 TYR A 58 -1.536 2.156 8.292 1.00 0.60 H new ATOM 0 HH TYR A 58 -1.925 3.148 10.253 1.00 0.74 H new ATOM 983 N ARG A 59 -5.187 2.899 4.293 1.00 0.37 N ATOM 984 CA ARG A 59 -4.838 4.343 4.168 1.00 0.39 C ATOM 985 C ARG A 59 -6.118 5.180 4.236 1.00 0.41 C ATOM 986 O ARG A 59 -6.235 6.087 5.036 1.00 0.48 O ATOM 987 CB ARG A 59 -4.128 4.584 2.830 1.00 0.34 C ATOM 988 CG ARG A 59 -3.881 6.085 2.616 1.00 0.40 C ATOM 989 CD ARG A 59 -3.165 6.690 3.830 1.00 0.84 C ATOM 990 NE ARG A 59 -2.147 5.733 4.350 1.00 0.78 N ATOM 991 CZ ARG A 59 -1.222 6.149 5.171 1.00 1.22 C ATOM 992 NH1 ARG A 59 -1.187 7.402 5.534 1.00 1.62 N ATOM 993 NH2 ARG A 59 -0.331 5.312 5.629 1.00 1.78 N ATOM 0 H ARG A 59 -4.775 2.288 3.587 1.00 0.37 H new ATOM 0 HA ARG A 59 -4.174 4.633 4.982 1.00 0.39 H new ATOM 0 HB2 ARG A 59 -3.180 4.047 2.813 1.00 0.34 H new ATOM 0 HB3 ARG A 59 -4.733 4.189 2.014 1.00 0.34 H new ATOM 0 HG2 ARG A 59 -3.280 6.236 1.719 1.00 0.40 H new ATOM 0 HG3 ARG A 59 -4.830 6.596 2.454 1.00 0.40 H new ATOM 0 HD2 ARG A 59 -2.685 7.628 3.550 1.00 0.84 H new ATOM 0 HD3 ARG A 59 -3.889 6.923 4.611 1.00 0.84 H new ATOM 0 HE ARG A 59 -2.174 4.754 4.064 1.00 0.78 H new ATOM 0 HH11 ARG A 59 -1.883 8.056 5.176 1.00 1.62 H new ATOM 0 HH12 ARG A 59 -0.464 7.727 6.176 1.00 1.62 H new ATOM 0 HH21 ARG A 59 -0.358 4.333 5.345 1.00 1.78 H new ATOM 0 HH22 ARG A 59 0.392 5.637 6.271 1.00 1.78 H new ATOM 1007 N LEU A 60 -7.082 4.880 3.407 1.00 0.37 N ATOM 1008 CA LEU A 60 -8.353 5.658 3.436 1.00 0.42 C ATOM 1009 C LEU A 60 -8.955 5.568 4.845 1.00 0.49 C ATOM 1010 O LEU A 60 -8.496 6.218 5.763 1.00 1.18 O ATOM 1011 CB LEU A 60 -9.334 5.085 2.404 1.00 0.42 C ATOM 1012 CG LEU A 60 -8.683 5.062 1.011 1.00 0.37 C ATOM 1013 CD1 LEU A 60 -9.483 4.139 0.090 1.00 0.40 C ATOM 1014 CD2 LEU A 60 -8.655 6.472 0.405 1.00 0.42 C ATOM 0 H LEU A 60 -7.044 4.133 2.714 1.00 0.37 H new ATOM 0 HA LEU A 60 -8.158 6.701 3.189 1.00 0.42 H new ATOM 0 HB2 LEU A 60 -9.629 4.076 2.693 1.00 0.42 H new ATOM 0 HB3 LEU A 60 -10.242 5.688 2.380 1.00 0.42 H new ATOM 0 HG LEU A 60 -7.660 4.698 1.111 1.00 0.37 H new ATOM 0 HD11 LEU A 60 -9.022 4.122 -0.898 1.00 0.40 H new ATOM 0 HD12 LEU A 60 -9.492 3.131 0.504 1.00 0.40 H new ATOM 0 HD13 LEU A 60 -10.506 4.506 0.007 1.00 0.40 H new ATOM 0 HD21 LEU A 60 -8.191 6.435 -0.581 1.00 0.42 H new ATOM 0 HD22 LEU A 60 -9.674 6.849 0.312 1.00 0.42 H new ATOM 0 HD23 LEU A 60 -8.081 7.135 1.052 1.00 0.42 H new ATOM 1026 N GLY A 61 -9.974 4.768 5.033 1.00 0.47 N ATOM 1027 CA GLY A 61 -10.583 4.651 6.392 1.00 0.45 C ATOM 1028 C GLY A 61 -11.634 3.536 6.397 1.00 0.40 C ATOM 1029 O GLY A 61 -12.608 3.594 7.121 1.00 0.41 O ATOM 0 H GLY A 61 -10.408 4.195 4.310 1.00 0.47 H new ATOM 0 HA2 GLY A 61 -9.810 4.437 7.130 1.00 0.45 H new ATOM 0 HA3 GLY A 61 -11.043 5.597 6.677 1.00 0.45 H new ATOM 1033 N LEU A 62 -11.445 2.522 5.596 1.00 0.37 N ATOM 1034 CA LEU A 62 -12.429 1.398 5.549 1.00 0.35 C ATOM 1035 C LEU A 62 -12.024 0.313 6.549 1.00 0.36 C ATOM 1036 O LEU A 62 -12.775 -0.596 6.827 1.00 0.39 O ATOM 1037 CB LEU A 62 -12.457 0.804 4.141 1.00 0.36 C ATOM 1038 CG LEU A 62 -12.724 1.909 3.112 1.00 0.32 C ATOM 1039 CD1 LEU A 62 -12.561 1.336 1.702 1.00 0.38 C ATOM 1040 CD2 LEU A 62 -14.151 2.455 3.283 1.00 0.30 C ATOM 0 H LEU A 62 -10.647 2.422 4.968 1.00 0.37 H new ATOM 0 HA LEU A 62 -13.418 1.776 5.807 1.00 0.35 H new ATOM 0 HB2 LEU A 62 -11.507 0.316 3.924 1.00 0.36 H new ATOM 0 HB3 LEU A 62 -13.231 0.039 4.075 1.00 0.36 H new ATOM 0 HG LEU A 62 -12.013 2.721 3.264 1.00 0.32 H new ATOM 0 HD11 LEU A 62 -12.750 2.119 0.967 1.00 0.38 H new ATOM 0 HD12 LEU A 62 -11.546 0.959 1.578 1.00 0.38 H new ATOM 0 HD13 LEU A 62 -13.271 0.522 1.556 1.00 0.38 H new ATOM 0 HD21 LEU A 62 -14.331 3.239 2.548 1.00 0.30 H new ATOM 0 HD22 LEU A 62 -14.869 1.648 3.136 1.00 0.30 H new ATOM 0 HD23 LEU A 62 -14.266 2.865 4.286 1.00 0.30 H new ATOM 1052 N ALA A 63 -10.844 0.400 7.099 1.00 0.37 N ATOM 1053 CA ALA A 63 -10.404 -0.629 8.090 1.00 0.42 C ATOM 1054 C ALA A 63 -9.466 0.032 9.102 1.00 0.49 C ATOM 1055 O ALA A 63 -8.805 1.009 8.812 1.00 0.52 O ATOM 1056 CB ALA A 63 -9.691 -1.787 7.364 1.00 0.40 C ATOM 0 H ALA A 63 -10.165 1.137 6.907 1.00 0.37 H new ATOM 0 HA ALA A 63 -11.269 -1.038 8.613 1.00 0.42 H new ATOM 0 HB1 ALA A 63 -9.373 -2.533 8.093 1.00 0.40 H new ATOM 0 HB2 ALA A 63 -10.376 -2.246 6.650 1.00 0.40 H new ATOM 0 HB3 ALA A 63 -8.819 -1.403 6.835 1.00 0.40 H new ATOM 1062 N ARG A 64 -9.429 -0.485 10.294 1.00 0.60 N ATOM 1063 CA ARG A 64 -8.567 0.114 11.346 1.00 0.73 C ATOM 1064 C ARG A 64 -7.098 -0.241 11.115 1.00 0.70 C ATOM 1065 O ARG A 64 -6.224 0.580 11.301 1.00 0.74 O ATOM 1066 CB ARG A 64 -9.012 -0.427 12.714 1.00 0.94 C ATOM 1067 CG ARG A 64 -10.255 0.332 13.199 1.00 0.82 C ATOM 1068 CD ARG A 64 -9.901 1.796 13.517 1.00 1.13 C ATOM 1069 NE ARG A 64 -10.712 2.259 14.677 1.00 1.42 N ATOM 1070 CZ ARG A 64 -10.360 3.331 15.334 1.00 2.44 C ATOM 1071 NH1 ARG A 64 -9.287 3.987 14.986 1.00 3.34 N ATOM 1072 NH2 ARG A 64 -11.077 3.743 16.343 1.00 2.71 N ATOM 0 H ARG A 64 -9.963 -1.303 10.588 1.00 0.60 H new ATOM 0 HA ARG A 64 -8.667 1.199 11.312 1.00 0.73 H new ATOM 0 HB2 ARG A 64 -9.232 -1.492 12.639 1.00 0.94 H new ATOM 0 HB3 ARG A 64 -8.204 -0.319 13.438 1.00 0.94 H new ATOM 0 HG2 ARG A 64 -11.031 0.297 12.435 1.00 0.82 H new ATOM 0 HG3 ARG A 64 -10.660 -0.152 14.088 1.00 0.82 H new ATOM 0 HD2 ARG A 64 -8.838 1.884 13.744 1.00 1.13 H new ATOM 0 HD3 ARG A 64 -10.095 2.426 12.649 1.00 1.13 H new ATOM 0 HE ARG A 64 -11.543 1.738 14.958 1.00 1.42 H new ATOM 0 HH11 ARG A 64 -8.723 3.662 14.201 1.00 3.34 H new ATOM 0 HH12 ARG A 64 -9.012 4.824 15.499 1.00 3.34 H new ATOM 0 HH21 ARG A 64 -11.913 3.228 16.619 1.00 2.71 H new ATOM 0 HH22 ARG A 64 -10.802 4.580 16.856 1.00 2.71 H new ATOM 1086 N THR A 65 -6.812 -1.457 10.738 1.00 0.65 N ATOM 1087 CA THR A 65 -5.386 -1.856 10.538 1.00 0.64 C ATOM 1088 C THR A 65 -5.275 -2.878 9.405 1.00 0.63 C ATOM 1089 O THR A 65 -6.262 -3.361 8.888 1.00 0.74 O ATOM 1090 CB THR A 65 -4.865 -2.478 11.839 1.00 0.67 C ATOM 1091 OG1 THR A 65 -5.236 -3.849 11.883 1.00 0.72 O ATOM 1092 CG2 THR A 65 -5.471 -1.745 13.045 1.00 0.70 C ATOM 0 H THR A 65 -7.499 -2.190 10.560 1.00 0.65 H new ATOM 0 HA THR A 65 -4.796 -0.978 10.275 1.00 0.64 H new ATOM 0 HB THR A 65 -3.779 -2.389 11.874 1.00 0.67 H new ATOM 0 HG1 THR A 65 -6.197 -3.934 11.709 1.00 0.72 H new ATOM 0 HG21 THR A 65 -5.098 -2.191 13.967 1.00 0.70 H new ATOM 0 HG22 THR A 65 -5.189 -0.693 13.011 1.00 0.70 H new ATOM 0 HG23 THR A 65 -6.557 -1.831 13.015 1.00 0.70 H new ATOM 1100 N ARG A 66 -4.071 -3.210 9.019 1.00 0.58 N ATOM 1101 CA ARG A 66 -3.880 -4.199 7.923 1.00 0.59 C ATOM 1102 C ARG A 66 -4.718 -5.445 8.209 1.00 0.58 C ATOM 1103 O ARG A 66 -5.354 -5.992 7.330 1.00 0.59 O ATOM 1104 CB ARG A 66 -2.401 -4.586 7.836 1.00 0.68 C ATOM 1105 CG ARG A 66 -1.988 -5.325 9.111 1.00 1.47 C ATOM 1106 CD ARG A 66 -0.461 -5.386 9.198 1.00 1.56 C ATOM 1107 NE ARG A 66 -0.061 -6.006 10.492 1.00 2.29 N ATOM 1108 CZ ARG A 66 1.161 -6.431 10.661 1.00 2.76 C ATOM 1109 NH1 ARG A 66 2.033 -6.314 9.697 1.00 2.89 N ATOM 1110 NH2 ARG A 66 1.511 -6.974 11.795 1.00 3.58 N ATOM 0 H ARG A 66 -3.210 -2.836 9.418 1.00 0.58 H new ATOM 0 HA ARG A 66 -4.196 -3.759 6.977 1.00 0.59 H new ATOM 0 HB2 ARG A 66 -2.231 -5.219 6.965 1.00 0.68 H new ATOM 0 HB3 ARG A 66 -1.788 -3.694 7.706 1.00 0.68 H new ATOM 0 HG2 ARG A 66 -2.392 -4.815 9.986 1.00 1.47 H new ATOM 0 HG3 ARG A 66 -2.403 -6.333 9.110 1.00 1.47 H new ATOM 0 HD2 ARG A 66 -0.062 -5.966 8.366 1.00 1.56 H new ATOM 0 HD3 ARG A 66 -0.041 -4.383 9.118 1.00 1.56 H new ATOM 0 HE ARG A 66 -0.742 -6.098 11.246 1.00 2.29 H new ATOM 0 HH11 ARG A 66 1.759 -5.890 8.811 1.00 2.89 H new ATOM 0 HH12 ARG A 66 2.988 -6.647 9.830 1.00 2.89 H new ATOM 0 HH21 ARG A 66 0.829 -7.066 12.548 1.00 3.58 H new ATOM 0 HH22 ARG A 66 2.466 -7.307 11.928 1.00 3.58 H new ATOM 1124 N ARG A 67 -4.730 -5.896 9.433 1.00 0.60 N ATOM 1125 CA ARG A 67 -5.535 -7.104 9.768 1.00 0.64 C ATOM 1126 C ARG A 67 -6.985 -6.862 9.350 1.00 0.59 C ATOM 1127 O ARG A 67 -7.711 -7.779 9.021 1.00 0.70 O ATOM 1128 CB ARG A 67 -5.475 -7.360 11.279 1.00 0.69 C ATOM 1129 CG ARG A 67 -4.014 -7.533 11.732 1.00 1.43 C ATOM 1130 CD ARG A 67 -3.550 -8.975 11.489 1.00 1.28 C ATOM 1131 NE ARG A 67 -4.450 -9.917 12.214 1.00 2.04 N ATOM 1132 CZ ARG A 67 -4.436 -11.189 11.921 1.00 2.60 C ATOM 1133 NH1 ARG A 67 -3.633 -11.636 10.994 1.00 2.84 N ATOM 1134 NH2 ARG A 67 -5.224 -12.013 12.556 1.00 3.41 N ATOM 0 H ARG A 67 -4.219 -5.482 10.213 1.00 0.60 H new ATOM 0 HA ARG A 67 -5.136 -7.971 9.242 1.00 0.64 H new ATOM 0 HB2 ARG A 67 -5.933 -6.528 11.814 1.00 0.69 H new ATOM 0 HB3 ARG A 67 -6.048 -8.253 11.527 1.00 0.69 H new ATOM 0 HG2 ARG A 67 -3.372 -6.840 11.187 1.00 1.43 H new ATOM 0 HG3 ARG A 67 -3.922 -7.287 12.790 1.00 1.43 H new ATOM 0 HD2 ARG A 67 -3.559 -9.196 10.422 1.00 1.28 H new ATOM 0 HD3 ARG A 67 -2.523 -9.100 11.832 1.00 1.28 H new ATOM 0 HE ARG A 67 -5.077 -9.568 12.939 1.00 2.04 H new ATOM 0 HH11 ARG A 67 -3.017 -10.991 10.499 1.00 2.84 H new ATOM 0 HH12 ARG A 67 -3.622 -12.630 10.765 1.00 2.84 H new ATOM 0 HH21 ARG A 67 -5.850 -11.663 13.281 1.00 3.41 H new ATOM 0 HH22 ARG A 67 -5.213 -13.007 12.327 1.00 3.41 H new ATOM 1148 N GLN A 68 -7.408 -5.627 9.359 1.00 0.52 N ATOM 1149 CA GLN A 68 -8.808 -5.301 8.962 1.00 0.49 C ATOM 1150 C GLN A 68 -8.863 -5.031 7.456 1.00 0.43 C ATOM 1151 O GLN A 68 -9.733 -5.518 6.767 1.00 0.42 O ATOM 1152 CB GLN A 68 -9.272 -4.067 9.744 1.00 0.49 C ATOM 1153 CG GLN A 68 -9.716 -4.472 11.147 1.00 0.60 C ATOM 1154 CD GLN A 68 -8.608 -5.276 11.828 1.00 1.18 C ATOM 1155 OE1 GLN A 68 -7.524 -4.773 12.048 1.00 2.11 O ATOM 1156 NE2 GLN A 68 -8.835 -6.514 12.174 1.00 1.71 N ATOM 0 H GLN A 68 -6.839 -4.824 9.626 1.00 0.52 H new ATOM 0 HA GLN A 68 -9.467 -6.139 9.190 1.00 0.49 H new ATOM 0 HB2 GLN A 68 -8.462 -3.340 9.806 1.00 0.49 H new ATOM 0 HB3 GLN A 68 -10.095 -3.583 9.219 1.00 0.49 H new ATOM 0 HG2 GLN A 68 -9.948 -3.584 11.735 1.00 0.60 H new ATOM 0 HG3 GLN A 68 -10.628 -5.066 11.093 1.00 0.60 H new ATOM 0 HE21 GLN A 68 -9.745 -6.936 11.989 1.00 1.71 H new ATOM 0 HE22 GLN A 68 -8.103 -7.059 12.629 1.00 1.71 H new ATOM 1165 N ALA A 69 -7.943 -4.268 6.935 1.00 0.41 N ATOM 1166 CA ALA A 69 -7.965 -3.985 5.471 1.00 0.37 C ATOM 1167 C ALA A 69 -7.670 -5.271 4.688 1.00 0.38 C ATOM 1168 O ALA A 69 -8.420 -5.661 3.816 1.00 0.46 O ATOM 1169 CB ALA A 69 -6.918 -2.916 5.140 1.00 0.37 C ATOM 0 H ALA A 69 -7.182 -3.831 7.454 1.00 0.41 H new ATOM 0 HA ALA A 69 -8.952 -3.619 5.188 1.00 0.37 H new ATOM 0 HB1 ALA A 69 -6.935 -2.710 4.070 1.00 0.37 H new ATOM 0 HB2 ALA A 69 -7.145 -2.002 5.689 1.00 0.37 H new ATOM 0 HB3 ALA A 69 -5.929 -3.275 5.425 1.00 0.37 H new ATOM 1175 N ARG A 70 -6.587 -5.930 4.985 1.00 0.41 N ATOM 1176 CA ARG A 70 -6.256 -7.183 4.246 1.00 0.42 C ATOM 1177 C ARG A 70 -7.483 -8.100 4.210 1.00 0.41 C ATOM 1178 O ARG A 70 -7.846 -8.630 3.178 1.00 0.42 O ATOM 1179 CB ARG A 70 -5.105 -7.901 4.954 1.00 0.46 C ATOM 1180 CG ARG A 70 -4.675 -9.115 4.127 1.00 1.01 C ATOM 1181 CD ARG A 70 -3.459 -9.774 4.782 1.00 1.10 C ATOM 1182 NE ARG A 70 -2.363 -8.773 4.915 1.00 1.48 N ATOM 1183 CZ ARG A 70 -1.351 -9.016 5.702 1.00 1.96 C ATOM 1184 NH1 ARG A 70 -1.298 -10.134 6.372 1.00 2.20 N ATOM 1185 NH2 ARG A 70 -0.391 -8.139 5.820 1.00 2.83 N ATOM 0 H ARG A 70 -5.917 -5.658 5.705 1.00 0.41 H new ATOM 0 HA ARG A 70 -5.961 -6.934 3.227 1.00 0.42 H new ATOM 0 HB2 ARG A 70 -4.264 -7.221 5.085 1.00 0.46 H new ATOM 0 HB3 ARG A 70 -5.417 -8.218 5.949 1.00 0.46 H new ATOM 0 HG2 ARG A 70 -5.495 -9.829 4.057 1.00 1.01 H new ATOM 0 HG3 ARG A 70 -4.432 -8.808 3.110 1.00 1.01 H new ATOM 0 HD2 ARG A 70 -3.729 -10.166 5.763 1.00 1.10 H new ATOM 0 HD3 ARG A 70 -3.123 -10.620 4.182 1.00 1.10 H new ATOM 0 HE ARG A 70 -2.404 -7.899 4.391 1.00 1.48 H new ATOM 0 HH11 ARG A 70 -2.048 -10.819 6.281 1.00 2.20 H new ATOM 0 HH12 ARG A 70 -0.506 -10.323 6.987 1.00 2.20 H new ATOM 0 HH21 ARG A 70 -0.432 -7.264 5.297 1.00 2.83 H new ATOM 0 HH22 ARG A 70 0.400 -8.329 6.435 1.00 2.83 H new ATOM 1199 N GLN A 71 -8.116 -8.299 5.333 1.00 0.44 N ATOM 1200 CA GLN A 71 -9.311 -9.191 5.374 1.00 0.45 C ATOM 1201 C GLN A 71 -10.412 -8.652 4.454 1.00 0.42 C ATOM 1202 O GLN A 71 -11.146 -9.409 3.850 1.00 0.43 O ATOM 1203 CB GLN A 71 -9.838 -9.266 6.809 1.00 0.50 C ATOM 1204 CG GLN A 71 -8.891 -10.117 7.657 1.00 0.56 C ATOM 1205 CD GLN A 71 -9.398 -10.163 9.099 1.00 1.26 C ATOM 1206 OE1 GLN A 71 -10.340 -9.479 9.446 1.00 2.00 O ATOM 1207 NE2 GLN A 71 -8.809 -10.947 9.960 1.00 2.14 N ATOM 0 H GLN A 71 -7.857 -7.882 6.227 1.00 0.44 H new ATOM 0 HA GLN A 71 -9.022 -10.185 5.032 1.00 0.45 H new ATOM 0 HB2 GLN A 71 -9.919 -8.264 7.231 1.00 0.50 H new ATOM 0 HB3 GLN A 71 -10.839 -9.698 6.818 1.00 0.50 H new ATOM 0 HG2 GLN A 71 -8.829 -11.126 7.250 1.00 0.56 H new ATOM 0 HG3 GLN A 71 -7.885 -9.699 7.627 1.00 0.56 H new ATOM 0 HE21 GLN A 71 -8.018 -11.521 9.669 1.00 2.14 H new ATOM 0 HE22 GLN A 71 -9.140 -10.985 10.924 1.00 2.14 H new ATOM 1216 N LEU A 72 -10.538 -7.357 4.333 1.00 0.38 N ATOM 1217 CA LEU A 72 -11.600 -6.806 3.440 1.00 0.35 C ATOM 1218 C LEU A 72 -11.319 -7.246 2.003 1.00 0.34 C ATOM 1219 O LEU A 72 -12.170 -7.800 1.336 1.00 0.39 O ATOM 1220 CB LEU A 72 -11.618 -5.279 3.511 1.00 0.33 C ATOM 1221 CG LEU A 72 -12.260 -4.815 4.828 1.00 0.38 C ATOM 1222 CD1 LEU A 72 -12.105 -3.297 4.946 1.00 0.40 C ATOM 1223 CD2 LEU A 72 -13.761 -5.184 4.867 1.00 0.42 C ATOM 0 H LEU A 72 -9.959 -6.664 4.807 1.00 0.38 H new ATOM 0 HA LEU A 72 -12.570 -7.182 3.764 1.00 0.35 H new ATOM 0 HB2 LEU A 72 -10.601 -4.893 3.438 1.00 0.33 H new ATOM 0 HB3 LEU A 72 -12.174 -4.875 2.665 1.00 0.33 H new ATOM 0 HG LEU A 72 -11.762 -5.313 5.660 1.00 0.38 H new ATOM 0 HD11 LEU A 72 -12.557 -2.956 5.877 1.00 0.40 H new ATOM 0 HD12 LEU A 72 -11.046 -3.038 4.941 1.00 0.40 H new ATOM 0 HD13 LEU A 72 -12.601 -2.814 4.104 1.00 0.40 H new ATOM 0 HD21 LEU A 72 -14.194 -4.846 5.808 1.00 0.42 H new ATOM 0 HD22 LEU A 72 -14.276 -4.702 4.036 1.00 0.42 H new ATOM 0 HD23 LEU A 72 -13.872 -6.265 4.784 1.00 0.42 H new ATOM 1235 N VAL A 73 -10.129 -7.009 1.522 1.00 0.33 N ATOM 1236 CA VAL A 73 -9.798 -7.421 0.130 1.00 0.34 C ATOM 1237 C VAL A 73 -10.168 -8.893 -0.059 1.00 0.39 C ATOM 1238 O VAL A 73 -11.055 -9.229 -0.816 1.00 0.40 O ATOM 1239 CB VAL A 73 -8.294 -7.246 -0.118 1.00 0.36 C ATOM 1240 CG1 VAL A 73 -7.923 -7.860 -1.471 1.00 0.39 C ATOM 1241 CG2 VAL A 73 -7.941 -5.757 -0.127 1.00 0.33 C ATOM 0 H VAL A 73 -9.374 -6.549 2.032 1.00 0.33 H new ATOM 0 HA VAL A 73 -10.356 -6.803 -0.573 1.00 0.34 H new ATOM 0 HB VAL A 73 -7.740 -7.746 0.677 1.00 0.36 H new ATOM 0 HG11 VAL A 73 -6.854 -7.735 -1.646 1.00 0.39 H new ATOM 0 HG12 VAL A 73 -8.169 -8.922 -1.468 1.00 0.39 H new ATOM 0 HG13 VAL A 73 -8.481 -7.360 -2.263 1.00 0.39 H new ATOM 0 HG21 VAL A 73 -6.872 -5.638 -0.303 1.00 0.33 H new ATOM 0 HG22 VAL A 73 -8.498 -5.256 -0.919 1.00 0.33 H new ATOM 0 HG23 VAL A 73 -8.202 -5.315 0.835 1.00 0.33 H new ATOM 1251 N THR A 74 -9.482 -9.768 0.626 1.00 0.45 N ATOM 1252 CA THR A 74 -9.758 -11.225 0.502 1.00 0.52 C ATOM 1253 C THR A 74 -11.267 -11.487 0.463 1.00 0.54 C ATOM 1254 O THR A 74 -11.737 -12.338 -0.265 1.00 0.57 O ATOM 1255 CB THR A 74 -9.145 -11.937 1.705 1.00 0.59 C ATOM 1256 OG1 THR A 74 -9.483 -11.233 2.892 1.00 0.55 O ATOM 1257 CG2 THR A 74 -7.624 -11.981 1.550 1.00 0.63 C ATOM 0 H THR A 74 -8.732 -9.530 1.275 1.00 0.45 H new ATOM 0 HA THR A 74 -9.322 -11.599 -0.424 1.00 0.52 H new ATOM 0 HB THR A 74 -9.532 -12.954 1.764 1.00 0.59 H new ATOM 0 HG1 THR A 74 -10.061 -10.474 2.669 1.00 0.55 H new ATOM 0 HG21 THR A 74 -7.185 -12.489 2.409 1.00 0.63 H new ATOM 0 HG22 THR A 74 -7.367 -12.520 0.639 1.00 0.63 H new ATOM 0 HG23 THR A 74 -7.235 -10.965 1.492 1.00 0.63 H new ATOM 1265 N HIS A 75 -12.028 -10.764 1.234 1.00 0.54 N ATOM 1266 CA HIS A 75 -13.503 -10.979 1.229 1.00 0.58 C ATOM 1267 C HIS A 75 -14.088 -10.472 -0.093 1.00 0.57 C ATOM 1268 O HIS A 75 -15.285 -10.321 -0.235 1.00 0.86 O ATOM 1269 CB HIS A 75 -14.135 -10.214 2.394 1.00 0.64 C ATOM 1270 CG HIS A 75 -13.493 -10.643 3.684 1.00 0.79 C ATOM 1271 ND1 HIS A 75 -13.794 -10.039 4.897 1.00 1.03 N ATOM 1272 CD2 HIS A 75 -12.565 -11.615 3.969 1.00 0.86 C ATOM 1273 CE1 HIS A 75 -13.060 -10.648 5.847 1.00 1.18 C ATOM 1274 NE2 HIS A 75 -12.297 -11.613 5.333 1.00 1.07 N ATOM 0 H HIS A 75 -11.695 -10.036 1.866 1.00 0.54 H new ATOM 0 HA HIS A 75 -13.715 -12.043 1.336 1.00 0.58 H new ATOM 0 HB2 HIS A 75 -14.006 -9.141 2.251 1.00 0.64 H new ATOM 0 HB3 HIS A 75 -15.208 -10.404 2.429 1.00 0.64 H new ATOM 0 HD2 HIS A 75 -12.114 -12.278 3.246 1.00 0.86 H new ATOM 0 HE1 HIS A 75 -13.086 -10.387 6.895 1.00 1.18 H new ATOM 0 HE2 HIS A 75 -11.652 -12.222 5.836 1.00 1.07 H new ATOM 1283 N GLY A 76 -13.248 -10.218 -1.063 1.00 0.52 N ATOM 1284 CA GLY A 76 -13.741 -9.728 -2.385 1.00 0.52 C ATOM 1285 C GLY A 76 -14.811 -8.652 -2.184 1.00 0.56 C ATOM 1286 O GLY A 76 -15.862 -8.688 -2.792 1.00 1.45 O ATOM 0 H GLY A 76 -12.236 -10.330 -0.996 1.00 0.52 H new ATOM 0 HA2 GLY A 76 -12.911 -9.322 -2.963 1.00 0.52 H new ATOM 0 HA3 GLY A 76 -14.153 -10.558 -2.958 1.00 0.52 H new ATOM 1290 N HIS A 77 -14.551 -7.693 -1.332 1.00 0.66 N ATOM 1291 CA HIS A 77 -15.548 -6.605 -1.081 1.00 0.45 C ATOM 1292 C HIS A 77 -15.105 -5.330 -1.801 1.00 0.37 C ATOM 1293 O HIS A 77 -15.912 -4.519 -2.205 1.00 0.57 O ATOM 1294 CB HIS A 77 -15.625 -6.334 0.422 1.00 0.40 C ATOM 1295 CG HIS A 77 -16.326 -7.477 1.102 1.00 0.44 C ATOM 1296 ND1 HIS A 77 -17.205 -8.313 0.427 1.00 0.49 N ATOM 1297 CD2 HIS A 77 -16.296 -7.932 2.398 1.00 0.53 C ATOM 1298 CE1 HIS A 77 -17.665 -9.218 1.312 1.00 0.53 C ATOM 1299 NE2 HIS A 77 -17.142 -9.028 2.524 1.00 0.55 N ATOM 0 H HIS A 77 -13.687 -7.615 -0.796 1.00 0.66 H new ATOM 0 HA HIS A 77 -16.526 -6.912 -1.453 1.00 0.45 H new ATOM 0 HB2 HIS A 77 -14.623 -6.212 0.832 1.00 0.40 H new ATOM 0 HB3 HIS A 77 -16.160 -5.403 0.608 1.00 0.40 H new ATOM 0 HD2 HIS A 77 -15.706 -7.504 3.195 1.00 0.53 H new ATOM 0 HE1 HIS A 77 -18.370 -10.000 1.070 1.00 0.53 H new ATOM 0 HE2 HIS A 77 -17.324 -9.573 3.367 1.00 0.55 H new ATOM 1308 N ILE A 78 -13.826 -5.144 -1.959 1.00 0.34 N ATOM 1309 CA ILE A 78 -13.327 -3.919 -2.645 1.00 0.29 C ATOM 1310 C ILE A 78 -13.532 -4.065 -4.161 1.00 0.29 C ATOM 1311 O ILE A 78 -13.020 -4.972 -4.790 1.00 0.33 O ATOM 1312 CB ILE A 78 -11.831 -3.728 -2.297 1.00 0.33 C ATOM 1313 CG1 ILE A 78 -11.685 -2.938 -0.984 1.00 0.73 C ATOM 1314 CG2 ILE A 78 -11.101 -2.955 -3.407 1.00 0.57 C ATOM 1315 CD1 ILE A 78 -12.613 -3.496 0.102 1.00 0.31 C ATOM 0 H ILE A 78 -13.102 -5.788 -1.642 1.00 0.34 H new ATOM 0 HA ILE A 78 -13.879 -3.040 -2.311 1.00 0.29 H new ATOM 0 HB ILE A 78 -11.390 -4.719 -2.193 1.00 0.33 H new ATOM 0 HG12 ILE A 78 -10.651 -2.983 -0.642 1.00 0.73 H new ATOM 0 HG13 ILE A 78 -11.917 -1.888 -1.160 1.00 0.73 H new ATOM 0 HG21 ILE A 78 -10.052 -2.835 -3.137 1.00 0.57 H new ATOM 0 HG22 ILE A 78 -11.174 -3.508 -4.344 1.00 0.57 H new ATOM 0 HG23 ILE A 78 -11.559 -1.973 -3.529 1.00 0.57 H new ATOM 0 HD11 ILE A 78 -12.489 -2.919 1.018 1.00 0.31 H new ATOM 0 HD12 ILE A 78 -13.648 -3.427 -0.233 1.00 0.31 H new ATOM 0 HD13 ILE A 78 -12.363 -4.539 0.294 1.00 0.31 H new ATOM 1327 N LEU A 79 -14.274 -3.157 -4.743 1.00 0.28 N ATOM 1328 CA LEU A 79 -14.526 -3.197 -6.214 1.00 0.30 C ATOM 1329 C LEU A 79 -13.578 -2.221 -6.908 1.00 0.30 C ATOM 1330 O LEU A 79 -13.829 -1.033 -6.953 1.00 0.44 O ATOM 1331 CB LEU A 79 -15.958 -2.747 -6.513 1.00 0.30 C ATOM 1332 CG LEU A 79 -16.980 -3.645 -5.807 1.00 0.31 C ATOM 1333 CD1 LEU A 79 -18.358 -2.985 -5.901 1.00 0.30 C ATOM 1334 CD2 LEU A 79 -17.025 -5.025 -6.482 1.00 0.36 C ATOM 0 H LEU A 79 -14.721 -2.381 -4.255 1.00 0.28 H new ATOM 0 HA LEU A 79 -14.371 -4.215 -6.570 1.00 0.30 H new ATOM 0 HB2 LEU A 79 -16.093 -1.715 -6.190 1.00 0.30 H new ATOM 0 HB3 LEU A 79 -16.132 -2.770 -7.589 1.00 0.30 H new ATOM 0 HG LEU A 79 -16.695 -3.774 -4.763 1.00 0.31 H new ATOM 0 HD11 LEU A 79 -19.097 -3.613 -5.403 1.00 0.30 H new ATOM 0 HD12 LEU A 79 -18.327 -2.008 -5.419 1.00 0.30 H new ATOM 0 HD13 LEU A 79 -18.633 -2.864 -6.949 1.00 0.30 H new ATOM 0 HD21 LEU A 79 -17.754 -5.655 -5.973 1.00 0.36 H new ATOM 0 HD22 LEU A 79 -17.312 -4.910 -7.527 1.00 0.36 H new ATOM 0 HD23 LEU A 79 -16.041 -5.490 -6.425 1.00 0.36 H new ATOM 1346 N VAL A 80 -12.500 -2.697 -7.460 1.00 0.34 N ATOM 1347 CA VAL A 80 -11.566 -1.771 -8.156 1.00 0.36 C ATOM 1348 C VAL A 80 -12.160 -1.422 -9.524 1.00 0.39 C ATOM 1349 O VAL A 80 -12.647 -2.280 -10.234 1.00 0.40 O ATOM 1350 CB VAL A 80 -10.194 -2.450 -8.303 1.00 0.38 C ATOM 1351 CG1 VAL A 80 -9.378 -1.781 -9.418 1.00 0.44 C ATOM 1352 CG2 VAL A 80 -9.430 -2.331 -6.975 1.00 0.37 C ATOM 0 H VAL A 80 -12.226 -3.679 -7.460 1.00 0.34 H new ATOM 0 HA VAL A 80 -11.431 -0.853 -7.584 1.00 0.36 H new ATOM 0 HB VAL A 80 -10.344 -3.499 -8.559 1.00 0.38 H new ATOM 0 HG11 VAL A 80 -8.410 -2.275 -9.507 1.00 0.44 H new ATOM 0 HG12 VAL A 80 -9.916 -1.864 -10.362 1.00 0.44 H new ATOM 0 HG13 VAL A 80 -9.227 -0.729 -9.177 1.00 0.44 H new ATOM 0 HG21 VAL A 80 -8.456 -2.810 -7.071 1.00 0.37 H new ATOM 0 HG22 VAL A 80 -9.294 -1.278 -6.727 1.00 0.37 H new ATOM 0 HG23 VAL A 80 -9.998 -2.820 -6.183 1.00 0.37 H new ATOM 1362 N ASP A 81 -12.130 -0.167 -9.892 1.00 0.41 N ATOM 1363 CA ASP A 81 -12.702 0.245 -11.208 1.00 0.46 C ATOM 1364 C ASP A 81 -14.063 -0.433 -11.400 1.00 0.45 C ATOM 1365 O ASP A 81 -14.549 -0.576 -12.504 1.00 0.51 O ATOM 1366 CB ASP A 81 -11.756 -0.182 -12.333 1.00 0.51 C ATOM 1367 CG ASP A 81 -12.223 0.431 -13.654 1.00 0.97 C ATOM 1368 OD1 ASP A 81 -12.171 1.644 -13.773 1.00 1.66 O ATOM 1369 OD2 ASP A 81 -12.625 -0.323 -14.525 1.00 1.45 O ATOM 0 H ASP A 81 -11.733 0.591 -9.337 1.00 0.41 H new ATOM 0 HA ASP A 81 -12.825 1.328 -11.231 1.00 0.46 H new ATOM 0 HB2 ASP A 81 -10.739 0.141 -12.110 1.00 0.51 H new ATOM 0 HB3 ASP A 81 -11.735 -1.269 -12.412 1.00 0.51 H new ATOM 1374 N GLY A 82 -14.670 -0.863 -10.326 1.00 0.40 N ATOM 1375 CA GLY A 82 -15.989 -1.548 -10.430 1.00 0.41 C ATOM 1376 C GLY A 82 -15.755 -3.035 -10.698 1.00 0.40 C ATOM 1377 O GLY A 82 -16.443 -3.651 -11.487 1.00 0.43 O ATOM 0 H GLY A 82 -14.306 -0.768 -9.378 1.00 0.40 H new ATOM 0 HA2 GLY A 82 -16.556 -1.416 -9.509 1.00 0.41 H new ATOM 0 HA3 GLY A 82 -16.580 -1.108 -11.234 1.00 0.41 H new ATOM 1381 N SER A 83 -14.780 -3.618 -10.046 1.00 0.39 N ATOM 1382 CA SER A 83 -14.489 -5.067 -10.262 1.00 0.41 C ATOM 1383 C SER A 83 -13.971 -5.687 -8.963 1.00 0.36 C ATOM 1384 O SER A 83 -13.093 -5.156 -8.313 1.00 0.33 O ATOM 1385 CB SER A 83 -13.427 -5.215 -11.355 1.00 0.45 C ATOM 1386 OG SER A 83 -14.032 -5.015 -12.626 1.00 0.52 O ATOM 0 H SER A 83 -14.173 -3.151 -9.373 1.00 0.39 H new ATOM 0 HA SER A 83 -15.402 -5.578 -10.567 1.00 0.41 H new ATOM 0 HB2 SER A 83 -12.627 -4.491 -11.202 1.00 0.45 H new ATOM 0 HB3 SER A 83 -12.974 -6.205 -11.307 1.00 0.45 H new ATOM 0 HG SER A 83 -14.949 -4.690 -12.505 1.00 0.52 H new ATOM 1392 N ARG A 84 -14.511 -6.811 -8.588 1.00 0.39 N ATOM 1393 CA ARG A 84 -14.064 -7.483 -7.337 1.00 0.37 C ATOM 1394 C ARG A 84 -12.591 -7.887 -7.468 1.00 0.37 C ATOM 1395 O ARG A 84 -12.219 -8.615 -8.368 1.00 0.40 O ATOM 1396 CB ARG A 84 -14.929 -8.730 -7.111 1.00 0.42 C ATOM 1397 CG ARG A 84 -14.873 -9.150 -5.640 1.00 1.28 C ATOM 1398 CD ARG A 84 -15.816 -10.336 -5.409 1.00 1.25 C ATOM 1399 NE ARG A 84 -15.174 -11.585 -5.908 1.00 2.19 N ATOM 1400 CZ ARG A 84 -15.650 -12.748 -5.555 1.00 2.60 C ATOM 1401 NH1 ARG A 84 -16.689 -12.817 -4.768 1.00 2.43 N ATOM 1402 NH2 ARG A 84 -15.087 -13.842 -5.990 1.00 3.54 N ATOM 0 H ARG A 84 -15.249 -7.297 -9.098 1.00 0.39 H new ATOM 0 HA ARG A 84 -14.169 -6.804 -6.491 1.00 0.37 H new ATOM 0 HB2 ARG A 84 -15.960 -8.524 -7.399 1.00 0.42 H new ATOM 0 HB3 ARG A 84 -14.578 -9.545 -7.744 1.00 0.42 H new ATOM 0 HG2 ARG A 84 -13.854 -9.424 -5.368 1.00 1.28 H new ATOM 0 HG3 ARG A 84 -15.160 -8.314 -5.001 1.00 1.28 H new ATOM 0 HD2 ARG A 84 -16.045 -10.431 -4.348 1.00 1.25 H new ATOM 0 HD3 ARG A 84 -16.761 -10.169 -5.925 1.00 1.25 H new ATOM 0 HE ARG A 84 -14.363 -11.531 -6.525 1.00 2.19 H new ATOM 0 HH11 ARG A 84 -17.129 -11.962 -4.429 1.00 2.43 H new ATOM 0 HH12 ARG A 84 -17.061 -13.726 -4.492 1.00 2.43 H new ATOM 0 HH21 ARG A 84 -14.275 -13.788 -6.605 1.00 3.54 H new ATOM 0 HH22 ARG A 84 -15.459 -14.751 -5.714 1.00 3.54 H new ATOM 1416 N VAL A 85 -11.754 -7.425 -6.569 1.00 0.36 N ATOM 1417 CA VAL A 85 -10.296 -7.780 -6.617 1.00 0.37 C ATOM 1418 C VAL A 85 -9.901 -8.404 -5.277 1.00 0.38 C ATOM 1419 O VAL A 85 -9.238 -7.795 -4.464 1.00 0.39 O ATOM 1420 CB VAL A 85 -9.469 -6.504 -6.887 1.00 0.38 C ATOM 1421 CG1 VAL A 85 -7.971 -6.720 -6.537 1.00 0.39 C ATOM 1422 CG2 VAL A 85 -9.608 -6.132 -8.373 1.00 0.41 C ATOM 0 H VAL A 85 -12.019 -6.812 -5.798 1.00 0.36 H new ATOM 0 HA VAL A 85 -10.102 -8.495 -7.417 1.00 0.37 H new ATOM 0 HB VAL A 85 -9.846 -5.698 -6.257 1.00 0.38 H new ATOM 0 HG11 VAL A 85 -7.415 -5.804 -6.738 1.00 0.39 H new ATOM 0 HG12 VAL A 85 -7.877 -6.978 -5.482 1.00 0.39 H new ATOM 0 HG13 VAL A 85 -7.568 -7.530 -7.145 1.00 0.39 H new ATOM 0 HG21 VAL A 85 -9.029 -5.232 -8.578 1.00 0.41 H new ATOM 0 HG22 VAL A 85 -9.237 -6.951 -8.989 1.00 0.41 H new ATOM 0 HG23 VAL A 85 -10.657 -5.949 -8.606 1.00 0.41 H new ATOM 1432 N ASN A 86 -10.308 -9.623 -5.044 1.00 0.42 N ATOM 1433 CA ASN A 86 -9.956 -10.295 -3.762 1.00 0.45 C ATOM 1434 C ASN A 86 -8.467 -10.635 -3.773 1.00 0.47 C ATOM 1435 O ASN A 86 -7.974 -11.352 -2.925 1.00 0.51 O ATOM 1436 CB ASN A 86 -10.775 -11.580 -3.614 1.00 0.50 C ATOM 1437 CG ASN A 86 -10.775 -12.342 -4.941 1.00 0.88 C ATOM 1438 OD1 ASN A 86 -11.354 -11.895 -5.911 1.00 1.61 O ATOM 1439 ND2 ASN A 86 -10.146 -13.482 -5.025 1.00 1.58 N ATOM 0 H ASN A 86 -10.869 -10.182 -5.687 1.00 0.42 H new ATOM 0 HA ASN A 86 -10.177 -9.632 -2.925 1.00 0.45 H new ATOM 0 HB2 ASN A 86 -10.354 -12.203 -2.825 1.00 0.50 H new ATOM 0 HB3 ASN A 86 -11.797 -11.341 -3.320 1.00 0.50 H new ATOM 0 HD21 ASN A 86 -10.140 -13.998 -5.905 1.00 1.58 H new ATOM 0 HD22 ASN A 86 -9.660 -13.857 -4.211 1.00 1.58 H new ATOM 1446 N ILE A 87 -7.748 -10.119 -4.733 1.00 0.49 N ATOM 1447 CA ILE A 87 -6.287 -10.398 -4.819 1.00 0.51 C ATOM 1448 C ILE A 87 -5.522 -9.268 -4.097 1.00 0.52 C ATOM 1449 O ILE A 87 -5.600 -8.126 -4.505 1.00 0.61 O ATOM 1450 CB ILE A 87 -5.879 -10.423 -6.295 1.00 0.53 C ATOM 1451 CG1 ILE A 87 -6.579 -11.588 -7.011 1.00 0.60 C ATOM 1452 CG2 ILE A 87 -4.369 -10.605 -6.403 1.00 0.55 C ATOM 1453 CD1 ILE A 87 -8.095 -11.346 -7.093 1.00 1.07 C ATOM 0 H ILE A 87 -8.114 -9.512 -5.466 1.00 0.49 H new ATOM 0 HA ILE A 87 -6.055 -11.356 -4.354 1.00 0.51 H new ATOM 0 HB ILE A 87 -6.172 -9.482 -6.761 1.00 0.53 H new ATOM 0 HG12 ILE A 87 -6.170 -11.703 -8.015 1.00 0.60 H new ATOM 0 HG13 ILE A 87 -6.383 -12.519 -6.479 1.00 0.60 H new ATOM 0 HG21 ILE A 87 -4.079 -10.623 -7.454 1.00 0.55 H new ATOM 0 HG22 ILE A 87 -3.866 -9.778 -5.902 1.00 0.55 H new ATOM 0 HG23 ILE A 87 -4.081 -11.544 -5.931 1.00 0.55 H new ATOM 0 HD11 ILE A 87 -8.570 -12.184 -7.604 1.00 1.07 H new ATOM 0 HD12 ILE A 87 -8.504 -11.256 -6.087 1.00 1.07 H new ATOM 0 HD13 ILE A 87 -8.287 -10.427 -7.647 1.00 1.07 H new ATOM 1465 N PRO A 88 -4.798 -9.555 -3.031 1.00 0.55 N ATOM 1466 CA PRO A 88 -4.048 -8.504 -2.280 1.00 0.58 C ATOM 1467 C PRO A 88 -2.729 -8.115 -2.967 1.00 0.68 C ATOM 1468 O PRO A 88 -2.253 -7.006 -2.829 1.00 1.06 O ATOM 1469 CB PRO A 88 -3.786 -9.162 -0.921 1.00 0.64 C ATOM 1470 CG PRO A 88 -3.685 -10.624 -1.219 1.00 0.89 C ATOM 1471 CD PRO A 88 -4.607 -10.888 -2.419 1.00 0.69 C ATOM 0 HA PRO A 88 -4.607 -7.571 -2.213 1.00 0.58 H new ATOM 0 HB2 PRO A 88 -2.868 -8.786 -0.470 1.00 0.64 H new ATOM 0 HB3 PRO A 88 -4.594 -8.956 -0.219 1.00 0.64 H new ATOM 0 HG2 PRO A 88 -2.657 -10.903 -1.451 1.00 0.89 H new ATOM 0 HG3 PRO A 88 -3.990 -11.218 -0.357 1.00 0.89 H new ATOM 0 HD2 PRO A 88 -4.155 -11.588 -3.122 1.00 0.69 H new ATOM 0 HD3 PRO A 88 -5.556 -11.321 -2.104 1.00 0.69 H new ATOM 1479 N SER A 89 -2.131 -9.019 -3.695 1.00 0.57 N ATOM 1480 CA SER A 89 -0.842 -8.697 -4.375 1.00 0.65 C ATOM 1481 C SER A 89 -1.109 -7.908 -5.662 1.00 0.55 C ATOM 1482 O SER A 89 -0.203 -7.373 -6.270 1.00 0.57 O ATOM 1483 CB SER A 89 -0.112 -9.995 -4.719 1.00 0.80 C ATOM 1484 OG SER A 89 1.207 -9.692 -5.154 1.00 1.44 O ATOM 0 H SER A 89 -2.478 -9.966 -3.849 1.00 0.57 H new ATOM 0 HA SER A 89 -0.228 -8.093 -3.707 1.00 0.65 H new ATOM 0 HB2 SER A 89 -0.078 -10.649 -3.847 1.00 0.80 H new ATOM 0 HB3 SER A 89 -0.650 -10.532 -5.500 1.00 0.80 H new ATOM 0 HG SER A 89 1.696 -9.248 -4.430 1.00 1.44 H new ATOM 1490 N TYR A 90 -2.340 -7.834 -6.084 1.00 0.55 N ATOM 1491 CA TYR A 90 -2.649 -7.082 -7.333 1.00 0.49 C ATOM 1492 C TYR A 90 -2.118 -5.655 -7.192 1.00 0.55 C ATOM 1493 O TYR A 90 -1.551 -5.296 -6.179 1.00 0.99 O ATOM 1494 CB TYR A 90 -4.165 -7.059 -7.572 1.00 0.47 C ATOM 1495 CG TYR A 90 -4.474 -6.264 -8.827 1.00 0.47 C ATOM 1496 CD1 TYR A 90 -3.996 -6.703 -10.068 1.00 0.53 C ATOM 1497 CD2 TYR A 90 -5.237 -5.089 -8.751 1.00 0.44 C ATOM 1498 CE1 TYR A 90 -4.277 -5.970 -11.228 1.00 0.55 C ATOM 1499 CE2 TYR A 90 -5.518 -4.358 -9.911 1.00 0.46 C ATOM 1500 CZ TYR A 90 -5.038 -4.798 -11.149 1.00 0.50 C ATOM 1501 OH TYR A 90 -5.314 -4.076 -12.292 1.00 0.54 O ATOM 0 H TYR A 90 -3.143 -8.260 -5.621 1.00 0.55 H new ATOM 0 HA TYR A 90 -2.173 -7.569 -8.184 1.00 0.49 H new ATOM 0 HB2 TYR A 90 -4.542 -8.077 -7.673 1.00 0.47 H new ATOM 0 HB3 TYR A 90 -4.671 -6.615 -6.715 1.00 0.47 H new ATOM 0 HD1 TYR A 90 -3.410 -7.608 -10.131 1.00 0.53 H new ATOM 0 HD2 TYR A 90 -5.608 -4.748 -7.796 1.00 0.44 H new ATOM 0 HE1 TYR A 90 -3.906 -6.309 -12.184 1.00 0.55 H new ATOM 0 HE2 TYR A 90 -6.106 -3.454 -9.850 1.00 0.46 H new ATOM 0 HH TYR A 90 -5.354 -4.683 -13.060 1.00 0.54 H new ATOM 1511 N ARG A 91 -2.286 -4.836 -8.198 1.00 0.48 N ATOM 1512 CA ARG A 91 -1.780 -3.432 -8.115 1.00 0.46 C ATOM 1513 C ARG A 91 -2.752 -2.496 -8.829 1.00 0.43 C ATOM 1514 O ARG A 91 -3.258 -2.799 -9.892 1.00 0.43 O ATOM 1515 CB ARG A 91 -0.403 -3.348 -8.775 1.00 0.47 C ATOM 1516 CG ARG A 91 0.636 -3.991 -7.854 1.00 0.54 C ATOM 1517 CD ARG A 91 2.018 -3.907 -8.504 1.00 0.58 C ATOM 1518 NE ARG A 91 2.105 -4.894 -9.617 1.00 1.13 N ATOM 1519 CZ ARG A 91 3.064 -4.802 -10.497 1.00 1.68 C ATOM 1520 NH1 ARG A 91 3.947 -3.846 -10.402 1.00 1.95 N ATOM 1521 NH2 ARG A 91 3.141 -5.666 -11.472 1.00 2.36 N ATOM 0 H ARG A 91 -2.751 -5.078 -9.073 1.00 0.48 H new ATOM 0 HA ARG A 91 -1.698 -3.135 -7.069 1.00 0.46 H new ATOM 0 HB2 ARG A 91 -0.417 -3.857 -9.739 1.00 0.47 H new ATOM 0 HB3 ARG A 91 -0.142 -2.307 -8.968 1.00 0.47 H new ATOM 0 HG2 ARG A 91 0.645 -3.484 -6.889 1.00 0.54 H new ATOM 0 HG3 ARG A 91 0.375 -5.032 -7.665 1.00 0.54 H new ATOM 0 HD2 ARG A 91 2.193 -2.900 -8.882 1.00 0.58 H new ATOM 0 HD3 ARG A 91 2.792 -4.108 -7.764 1.00 0.58 H new ATOM 0 HE ARG A 91 1.415 -5.641 -9.691 1.00 1.13 H new ATOM 0 HH11 ARG A 91 3.888 -3.171 -9.640 1.00 1.95 H new ATOM 0 HH12 ARG A 91 4.697 -3.774 -11.090 1.00 1.95 H new ATOM 0 HH21 ARG A 91 2.451 -6.414 -11.546 1.00 2.36 H new ATOM 0 HH22 ARG A 91 3.891 -5.594 -12.160 1.00 2.36 H new ATOM 1535 N VAL A 92 -3.024 -1.361 -8.241 1.00 0.43 N ATOM 1536 CA VAL A 92 -3.976 -0.387 -8.857 1.00 0.42 C ATOM 1537 C VAL A 92 -3.195 0.762 -9.500 1.00 0.44 C ATOM 1538 O VAL A 92 -2.064 1.031 -9.148 1.00 0.45 O ATOM 1539 CB VAL A 92 -4.892 0.172 -7.766 1.00 0.40 C ATOM 1540 CG1 VAL A 92 -5.957 1.062 -8.403 1.00 0.40 C ATOM 1541 CG2 VAL A 92 -5.576 -0.981 -7.023 1.00 0.45 C ATOM 0 H VAL A 92 -2.624 -1.063 -7.351 1.00 0.43 H new ATOM 0 HA VAL A 92 -4.570 -0.890 -9.620 1.00 0.42 H new ATOM 0 HB VAL A 92 -4.298 0.755 -7.062 1.00 0.40 H new ATOM 0 HG11 VAL A 92 -6.610 1.461 -7.627 1.00 0.40 H new ATOM 0 HG12 VAL A 92 -5.475 1.886 -8.930 1.00 0.40 H new ATOM 0 HG13 VAL A 92 -6.547 0.476 -9.108 1.00 0.40 H new ATOM 0 HG21 VAL A 92 -6.227 -0.578 -6.247 1.00 0.45 H new ATOM 0 HG22 VAL A 92 -6.168 -1.566 -7.726 1.00 0.45 H new ATOM 0 HG23 VAL A 92 -4.819 -1.619 -6.567 1.00 0.45 H new ATOM 1551 N LYS A 93 -3.795 1.442 -10.445 1.00 0.47 N ATOM 1552 CA LYS A 93 -3.101 2.581 -11.125 1.00 0.54 C ATOM 1553 C LYS A 93 -4.116 3.711 -11.362 1.00 0.45 C ATOM 1554 O LYS A 93 -5.299 3.461 -11.480 1.00 0.44 O ATOM 1555 CB LYS A 93 -2.548 2.095 -12.471 1.00 0.64 C ATOM 1556 CG LYS A 93 -1.248 1.318 -12.245 1.00 1.02 C ATOM 1557 CD LYS A 93 -0.655 0.908 -13.594 1.00 1.18 C ATOM 1558 CE LYS A 93 0.437 -0.140 -13.375 1.00 1.63 C ATOM 1559 NZ LYS A 93 -0.185 -1.424 -12.946 1.00 2.51 N ATOM 0 H LYS A 93 -4.741 1.257 -10.777 1.00 0.47 H new ATOM 0 HA LYS A 93 -2.282 2.948 -10.506 1.00 0.54 H new ATOM 0 HB2 LYS A 93 -3.281 1.460 -12.968 1.00 0.64 H new ATOM 0 HB3 LYS A 93 -2.365 2.945 -13.128 1.00 0.64 H new ATOM 0 HG2 LYS A 93 -0.536 1.933 -11.695 1.00 1.02 H new ATOM 0 HG3 LYS A 93 -1.442 0.434 -11.638 1.00 1.02 H new ATOM 0 HD2 LYS A 93 -1.436 0.505 -14.239 1.00 1.18 H new ATOM 0 HD3 LYS A 93 -0.241 1.780 -14.101 1.00 1.18 H new ATOM 0 HE2 LYS A 93 1.004 -0.288 -14.294 1.00 1.63 H new ATOM 0 HE3 LYS A 93 1.141 0.206 -12.618 1.00 1.63 H new ATOM 0 HZ1 LYS A 93 0.457 -2.212 -13.167 1.00 2.51 H new ATOM 0 HZ2 LYS A 93 -0.362 -1.399 -11.921 1.00 2.51 H new ATOM 0 HZ3 LYS A 93 -1.085 -1.559 -13.449 1.00 2.51 H new ATOM 1573 N PRO A 94 -3.669 4.947 -11.434 1.00 0.54 N ATOM 1574 CA PRO A 94 -4.570 6.111 -11.662 1.00 0.58 C ATOM 1575 C PRO A 94 -5.728 5.783 -12.612 1.00 0.56 C ATOM 1576 O PRO A 94 -5.595 4.980 -13.514 1.00 0.80 O ATOM 1577 CB PRO A 94 -3.632 7.152 -12.274 1.00 0.72 C ATOM 1578 CG PRO A 94 -2.305 6.887 -11.630 1.00 0.82 C ATOM 1579 CD PRO A 94 -2.263 5.380 -11.308 1.00 0.71 C ATOM 0 HA PRO A 94 -5.059 6.443 -10.746 1.00 0.58 H new ATOM 0 HB2 PRO A 94 -3.575 7.047 -13.357 1.00 0.72 H new ATOM 0 HB3 PRO A 94 -3.977 8.166 -12.070 1.00 0.72 H new ATOM 0 HG2 PRO A 94 -1.489 7.163 -12.297 1.00 0.82 H new ATOM 0 HG3 PRO A 94 -2.190 7.480 -10.723 1.00 0.82 H new ATOM 0 HD2 PRO A 94 -1.616 4.842 -12.001 1.00 0.71 H new ATOM 0 HD3 PRO A 94 -1.878 5.197 -10.305 1.00 0.71 H new ATOM 1587 N GLY A 95 -6.865 6.397 -12.411 1.00 0.57 N ATOM 1588 CA GLY A 95 -8.038 6.122 -13.294 1.00 0.59 C ATOM 1589 C GLY A 95 -8.869 4.984 -12.698 1.00 0.54 C ATOM 1590 O GLY A 95 -9.996 4.754 -13.088 1.00 0.96 O ATOM 0 H GLY A 95 -7.032 7.079 -11.671 1.00 0.57 H new ATOM 0 HA2 GLY A 95 -8.649 7.019 -13.395 1.00 0.59 H new ATOM 0 HA3 GLY A 95 -7.699 5.854 -14.294 1.00 0.59 H new ATOM 1594 N GLN A 96 -8.318 4.267 -11.752 1.00 0.37 N ATOM 1595 CA GLN A 96 -9.068 3.138 -11.121 1.00 0.32 C ATOM 1596 C GLN A 96 -9.720 3.624 -9.824 1.00 0.26 C ATOM 1597 O GLN A 96 -9.149 4.410 -9.092 1.00 0.30 O ATOM 1598 CB GLN A 96 -8.092 2.004 -10.804 1.00 0.45 C ATOM 1599 CG GLN A 96 -7.707 1.282 -12.097 1.00 0.56 C ATOM 1600 CD GLN A 96 -6.829 0.074 -11.767 1.00 1.19 C ATOM 1601 OE1 GLN A 96 -5.632 0.205 -11.606 1.00 1.81 O ATOM 1602 NE2 GLN A 96 -7.377 -1.105 -11.658 1.00 1.97 N ATOM 0 H GLN A 96 -7.377 4.415 -11.388 1.00 0.37 H new ATOM 0 HA GLN A 96 -9.839 2.781 -11.804 1.00 0.32 H new ATOM 0 HB2 GLN A 96 -7.201 2.402 -10.319 1.00 0.45 H new ATOM 0 HB3 GLN A 96 -8.548 1.302 -10.106 1.00 0.45 H new ATOM 0 HG2 GLN A 96 -8.604 0.959 -12.626 1.00 0.56 H new ATOM 0 HG3 GLN A 96 -7.173 1.962 -12.760 1.00 0.56 H new ATOM 0 HE21 GLN A 96 -8.382 -1.215 -11.793 1.00 1.97 H new ATOM 0 HE22 GLN A 96 -6.800 -1.917 -11.438 1.00 1.97 H new ATOM 1611 N THR A 97 -10.917 3.165 -9.536 1.00 0.32 N ATOM 1612 CA THR A 97 -11.625 3.597 -8.288 1.00 0.44 C ATOM 1613 C THR A 97 -11.728 2.435 -7.301 1.00 0.35 C ATOM 1614 O THR A 97 -12.109 1.339 -7.652 1.00 0.38 O ATOM 1615 CB THR A 97 -13.043 4.077 -8.628 1.00 0.63 C ATOM 1616 OG1 THR A 97 -13.003 4.931 -9.762 1.00 1.60 O ATOM 1617 CG2 THR A 97 -13.616 4.829 -7.440 1.00 0.73 C ATOM 0 H THR A 97 -11.436 2.506 -10.116 1.00 0.32 H new ATOM 0 HA THR A 97 -11.053 4.408 -7.838 1.00 0.44 H new ATOM 0 HB THR A 97 -13.673 3.217 -8.853 1.00 0.63 H new ATOM 0 HG1 THR A 97 -13.910 5.233 -9.976 1.00 1.60 H new ATOM 0 HG21 THR A 97 -14.623 5.172 -7.678 1.00 0.73 H new ATOM 0 HG22 THR A 97 -13.652 4.168 -6.574 1.00 0.73 H new ATOM 0 HG23 THR A 97 -12.984 5.688 -7.214 1.00 0.73 H new ATOM 1625 N ILE A 98 -11.446 2.697 -6.055 1.00 0.28 N ATOM 1626 CA ILE A 98 -11.577 1.646 -5.003 1.00 0.25 C ATOM 1627 C ILE A 98 -12.969 1.815 -4.398 1.00 0.19 C ATOM 1628 O ILE A 98 -13.289 2.876 -3.898 1.00 0.24 O ATOM 1629 CB ILE A 98 -10.529 1.880 -3.911 1.00 0.33 C ATOM 1630 CG1 ILE A 98 -9.145 2.043 -4.542 1.00 0.63 C ATOM 1631 CG2 ILE A 98 -10.521 0.696 -2.941 1.00 0.56 C ATOM 1632 CD1 ILE A 98 -8.848 0.865 -5.467 1.00 0.58 C ATOM 0 H ILE A 98 -11.127 3.604 -5.716 1.00 0.28 H new ATOM 0 HA ILE A 98 -11.433 0.649 -5.420 1.00 0.25 H new ATOM 0 HB ILE A 98 -10.779 2.790 -3.365 1.00 0.33 H new ATOM 0 HG12 ILE A 98 -9.100 2.976 -5.103 1.00 0.63 H new ATOM 0 HG13 ILE A 98 -8.386 2.103 -3.762 1.00 0.63 H new ATOM 0 HG21 ILE A 98 -9.774 0.866 -2.165 1.00 0.56 H new ATOM 0 HG22 ILE A 98 -11.504 0.595 -2.482 1.00 0.56 H new ATOM 0 HG23 ILE A 98 -10.279 -0.218 -3.484 1.00 0.56 H new ATOM 0 HD11 ILE A 98 -7.861 0.991 -5.911 1.00 0.58 H new ATOM 0 HD12 ILE A 98 -8.873 -0.062 -4.895 1.00 0.58 H new ATOM 0 HD13 ILE A 98 -9.598 0.824 -6.257 1.00 0.58 H new ATOM 1644 N ALA A 99 -13.818 0.816 -4.457 1.00 0.16 N ATOM 1645 CA ALA A 99 -15.200 0.991 -3.898 1.00 0.19 C ATOM 1646 C ALA A 99 -15.633 -0.235 -3.094 1.00 0.20 C ATOM 1647 O ALA A 99 -15.512 -1.360 -3.527 1.00 0.30 O ATOM 1648 CB ALA A 99 -16.174 1.262 -5.062 1.00 0.24 C ATOM 0 H ALA A 99 -13.620 -0.100 -4.861 1.00 0.16 H new ATOM 0 HA ALA A 99 -15.207 1.838 -3.212 1.00 0.19 H new ATOM 0 HB1 ALA A 99 -17.183 1.391 -4.670 1.00 0.24 H new ATOM 0 HB2 ALA A 99 -15.870 2.167 -5.587 1.00 0.24 H new ATOM 0 HB3 ALA A 99 -16.159 0.419 -5.753 1.00 0.24 H new ATOM 1654 N VAL A 100 -16.146 -0.004 -1.912 1.00 0.20 N ATOM 1655 CA VAL A 100 -16.599 -1.133 -1.055 1.00 0.22 C ATOM 1656 C VAL A 100 -17.784 -1.834 -1.722 1.00 0.28 C ATOM 1657 O VAL A 100 -18.638 -1.203 -2.312 1.00 0.40 O ATOM 1658 CB VAL A 100 -17.034 -0.590 0.309 1.00 0.24 C ATOM 1659 CG1 VAL A 100 -17.579 -1.733 1.163 1.00 0.27 C ATOM 1660 CG2 VAL A 100 -15.835 0.044 1.019 1.00 0.27 C ATOM 0 H VAL A 100 -16.270 0.923 -1.505 1.00 0.20 H new ATOM 0 HA VAL A 100 -15.782 -1.843 -0.924 1.00 0.22 H new ATOM 0 HB VAL A 100 -17.810 0.162 0.165 1.00 0.24 H new ATOM 0 HG11 VAL A 100 -17.889 -1.346 2.134 1.00 0.27 H new ATOM 0 HG12 VAL A 100 -18.435 -2.185 0.663 1.00 0.27 H new ATOM 0 HG13 VAL A 100 -16.802 -2.485 1.303 1.00 0.27 H new ATOM 0 HG21 VAL A 100 -16.149 0.429 1.989 1.00 0.27 H new ATOM 0 HG22 VAL A 100 -15.057 -0.707 1.161 1.00 0.27 H new ATOM 0 HG23 VAL A 100 -15.444 0.861 0.413 1.00 0.27 H new ATOM 1670 N ARG A 101 -17.848 -3.134 -1.631 1.00 0.30 N ATOM 1671 CA ARG A 101 -18.982 -3.866 -2.259 1.00 0.38 C ATOM 1672 C ARG A 101 -20.270 -3.524 -1.502 1.00 0.43 C ATOM 1673 O ARG A 101 -20.270 -3.372 -0.297 1.00 0.54 O ATOM 1674 CB ARG A 101 -18.721 -5.374 -2.193 1.00 0.50 C ATOM 1675 CG ARG A 101 -19.967 -6.134 -2.652 1.00 0.52 C ATOM 1676 CD ARG A 101 -19.600 -7.591 -2.941 1.00 0.64 C ATOM 1677 NE ARG A 101 -20.843 -8.386 -3.145 1.00 1.29 N ATOM 1678 CZ ARG A 101 -20.779 -9.569 -3.692 1.00 1.62 C ATOM 1679 NH1 ARG A 101 -19.625 -10.056 -4.059 1.00 1.63 N ATOM 1680 NH2 ARG A 101 -21.867 -10.266 -3.870 1.00 2.47 N ATOM 0 H ARG A 101 -17.165 -3.719 -1.150 1.00 0.30 H new ATOM 0 HA ARG A 101 -19.082 -3.572 -3.304 1.00 0.38 H new ATOM 0 HB2 ARG A 101 -17.872 -5.634 -2.825 1.00 0.50 H new ATOM 0 HB3 ARG A 101 -18.461 -5.664 -1.175 1.00 0.50 H new ATOM 0 HG2 ARG A 101 -20.738 -6.088 -1.883 1.00 0.52 H new ATOM 0 HG3 ARG A 101 -20.381 -5.668 -3.546 1.00 0.52 H new ATOM 0 HD2 ARG A 101 -18.969 -7.649 -3.828 1.00 0.64 H new ATOM 0 HD3 ARG A 101 -19.024 -8.003 -2.112 1.00 0.64 H new ATOM 0 HE ARG A 101 -21.745 -8.006 -2.857 1.00 1.29 H new ATOM 0 HH11 ARG A 101 -18.774 -9.512 -3.918 1.00 1.63 H new ATOM 0 HH12 ARG A 101 -19.574 -10.981 -4.487 1.00 1.63 H new ATOM 0 HH21 ARG A 101 -22.769 -9.886 -3.582 1.00 2.47 H new ATOM 0 HH22 ARG A 101 -21.816 -11.191 -4.298 1.00 2.47 H new ATOM 1694 N GLU A 102 -21.364 -3.389 -2.200 1.00 0.54 N ATOM 1695 CA GLU A 102 -22.650 -3.040 -1.526 1.00 0.68 C ATOM 1696 C GLU A 102 -22.861 -3.909 -0.280 1.00 0.83 C ATOM 1697 O GLU A 102 -22.664 -3.468 0.835 1.00 1.55 O ATOM 1698 CB GLU A 102 -23.808 -3.265 -2.500 1.00 0.81 C ATOM 1699 CG GLU A 102 -23.665 -2.317 -3.692 1.00 1.11 C ATOM 1700 CD GLU A 102 -24.801 -2.570 -4.684 1.00 1.73 C ATOM 1701 OE1 GLU A 102 -25.943 -2.590 -4.255 1.00 2.34 O ATOM 1702 OE2 GLU A 102 -24.510 -2.738 -5.857 1.00 2.23 O ATOM 0 H GLU A 102 -21.424 -3.505 -3.212 1.00 0.54 H new ATOM 0 HA GLU A 102 -22.613 -1.994 -1.222 1.00 0.68 H new ATOM 0 HB2 GLU A 102 -23.812 -4.300 -2.843 1.00 0.81 H new ATOM 0 HB3 GLU A 102 -24.759 -3.092 -1.997 1.00 0.81 H new ATOM 0 HG2 GLU A 102 -23.689 -1.282 -3.352 1.00 1.11 H new ATOM 0 HG3 GLU A 102 -22.702 -2.470 -4.179 1.00 1.11 H new ATOM 1709 N LYS A 103 -23.283 -5.132 -0.463 1.00 0.86 N ATOM 1710 CA LYS A 103 -23.537 -6.035 0.703 1.00 0.86 C ATOM 1711 C LYS A 103 -22.422 -5.899 1.746 1.00 0.69 C ATOM 1712 O LYS A 103 -22.614 -6.194 2.909 1.00 0.74 O ATOM 1713 CB LYS A 103 -23.595 -7.488 0.214 1.00 0.98 C ATOM 1714 CG LYS A 103 -24.702 -7.650 -0.845 1.00 1.31 C ATOM 1715 CD LYS A 103 -26.052 -7.912 -0.166 1.00 1.55 C ATOM 1716 CE LYS A 103 -27.159 -7.927 -1.221 1.00 1.64 C ATOM 1717 NZ LYS A 103 -27.046 -9.166 -2.043 1.00 2.20 N ATOM 0 H LYS A 103 -23.465 -5.549 -1.376 1.00 0.86 H new ATOM 0 HA LYS A 103 -24.484 -5.754 1.163 1.00 0.86 H new ATOM 0 HB2 LYS A 103 -22.632 -7.776 -0.209 1.00 0.98 H new ATOM 0 HB3 LYS A 103 -23.786 -8.155 1.055 1.00 0.98 H new ATOM 0 HG2 LYS A 103 -24.764 -6.750 -1.458 1.00 1.31 H new ATOM 0 HG3 LYS A 103 -24.457 -8.475 -1.514 1.00 1.31 H new ATOM 0 HD2 LYS A 103 -26.026 -8.865 0.363 1.00 1.55 H new ATOM 0 HD3 LYS A 103 -26.253 -7.140 0.577 1.00 1.55 H new ATOM 0 HE2 LYS A 103 -28.136 -7.885 -0.739 1.00 1.64 H new ATOM 0 HE3 LYS A 103 -27.080 -7.046 -1.859 1.00 1.64 H new ATOM 0 HZ1 LYS A 103 -27.889 -9.262 -2.644 1.00 2.20 H new ATOM 0 HZ2 LYS A 103 -26.198 -9.109 -2.643 1.00 2.20 H new ATOM 0 HZ3 LYS A 103 -26.971 -9.993 -1.416 1.00 2.20 H new ATOM 1731 N SER A 104 -21.257 -5.466 1.343 1.00 0.57 N ATOM 1732 CA SER A 104 -20.124 -5.321 2.311 1.00 0.56 C ATOM 1733 C SER A 104 -20.006 -3.860 2.759 1.00 0.71 C ATOM 1734 O SER A 104 -18.932 -3.296 2.758 1.00 1.54 O ATOM 1735 CB SER A 104 -18.826 -5.750 1.619 1.00 0.68 C ATOM 1736 OG SER A 104 -19.099 -6.849 0.759 1.00 0.93 O ATOM 0 H SER A 104 -21.038 -5.205 0.382 1.00 0.57 H new ATOM 0 HA SER A 104 -20.306 -5.946 3.185 1.00 0.56 H new ATOM 0 HB2 SER A 104 -18.412 -4.919 1.048 1.00 0.68 H new ATOM 0 HB3 SER A 104 -18.079 -6.030 2.361 1.00 0.68 H new ATOM 0 HG SER A 104 -18.301 -7.056 0.230 1.00 0.93 H new ATOM 1742 N ARG A 105 -21.101 -3.245 3.144 1.00 0.49 N ATOM 1743 CA ARG A 105 -21.057 -1.812 3.595 1.00 0.48 C ATOM 1744 C ARG A 105 -21.490 -1.716 5.061 1.00 0.48 C ATOM 1745 O ARG A 105 -21.033 -0.860 5.791 1.00 0.69 O ATOM 1746 CB ARG A 105 -22.009 -0.973 2.728 1.00 0.65 C ATOM 1747 CG ARG A 105 -21.350 -0.655 1.379 1.00 0.85 C ATOM 1748 CD ARG A 105 -22.186 0.388 0.636 1.00 0.65 C ATOM 1749 NE ARG A 105 -23.488 -0.213 0.233 1.00 1.41 N ATOM 1750 CZ ARG A 105 -24.473 0.556 -0.144 1.00 1.69 C ATOM 1751 NH1 ARG A 105 -24.317 1.851 -0.168 1.00 1.48 N ATOM 1752 NH2 ARG A 105 -25.613 0.029 -0.498 1.00 2.62 N ATOM 0 H ARG A 105 -22.026 -3.674 3.166 1.00 0.49 H new ATOM 0 HA ARG A 105 -20.039 -1.435 3.493 1.00 0.48 H new ATOM 0 HB2 ARG A 105 -22.941 -1.515 2.568 1.00 0.65 H new ATOM 0 HB3 ARG A 105 -22.264 -0.048 3.244 1.00 0.65 H new ATOM 0 HG2 ARG A 105 -20.338 -0.281 1.536 1.00 0.85 H new ATOM 0 HG3 ARG A 105 -21.265 -1.562 0.781 1.00 0.85 H new ATOM 0 HD2 ARG A 105 -22.356 1.255 1.274 1.00 0.65 H new ATOM 0 HD3 ARG A 105 -21.648 0.741 -0.244 1.00 0.65 H new ATOM 0 HE ARG A 105 -23.610 -1.226 0.252 1.00 1.41 H new ATOM 0 HH11 ARG A 105 -23.425 2.262 0.108 1.00 1.48 H new ATOM 0 HH12 ARG A 105 -25.087 2.452 -0.463 1.00 1.48 H new ATOM 0 HH21 ARG A 105 -25.734 -0.984 -0.480 1.00 2.62 H new ATOM 0 HH22 ARG A 105 -26.383 0.630 -0.793 1.00 2.62 H new ATOM 1766 N ASN A 106 -22.359 -2.582 5.503 1.00 0.48 N ATOM 1767 CA ASN A 106 -22.805 -2.523 6.921 1.00 0.53 C ATOM 1768 C ASN A 106 -21.737 -3.173 7.796 1.00 0.52 C ATOM 1769 O ASN A 106 -21.847 -3.220 9.005 1.00 0.58 O ATOM 1770 CB ASN A 106 -24.126 -3.281 7.065 1.00 0.64 C ATOM 1771 CG ASN A 106 -25.275 -2.418 6.538 1.00 0.72 C ATOM 1772 OD1 ASN A 106 -25.582 -1.386 7.100 1.00 1.16 O ATOM 1773 ND2 ASN A 106 -25.926 -2.800 5.474 1.00 1.40 N ATOM 0 H ASN A 106 -22.778 -3.326 4.945 1.00 0.48 H new ATOM 0 HA ASN A 106 -22.952 -1.488 7.229 1.00 0.53 H new ATOM 0 HB2 ASN A 106 -24.080 -4.220 6.513 1.00 0.64 H new ATOM 0 HB3 ASN A 106 -24.299 -3.535 8.111 1.00 0.64 H new ATOM 0 HD21 ASN A 106 -26.693 -2.232 5.114 1.00 1.40 H new ATOM 0 HD22 ASN A 106 -25.668 -3.667 5.002 1.00 1.40 H new ATOM 1780 N LEU A 107 -20.700 -3.672 7.185 1.00 0.47 N ATOM 1781 CA LEU A 107 -19.610 -4.321 7.960 1.00 0.47 C ATOM 1782 C LEU A 107 -19.217 -3.441 9.147 1.00 0.47 C ATOM 1783 O LEU A 107 -18.708 -2.350 8.980 1.00 0.45 O ATOM 1784 CB LEU A 107 -18.402 -4.508 7.052 1.00 0.45 C ATOM 1785 CG LEU A 107 -18.650 -5.662 6.077 1.00 0.48 C ATOM 1786 CD1 LEU A 107 -17.518 -5.688 5.056 1.00 0.53 C ATOM 1787 CD2 LEU A 107 -18.703 -7.007 6.828 1.00 0.53 C ATOM 0 H LEU A 107 -20.561 -3.657 6.175 1.00 0.47 H new ATOM 0 HA LEU A 107 -19.954 -5.287 8.331 1.00 0.47 H new ATOM 0 HB2 LEU A 107 -18.208 -3.589 6.498 1.00 0.45 H new ATOM 0 HB3 LEU A 107 -17.515 -4.712 7.651 1.00 0.45 H new ATOM 0 HG LEU A 107 -19.607 -5.513 5.577 1.00 0.48 H new ATOM 0 HD11 LEU A 107 -17.680 -6.506 4.354 1.00 0.53 H new ATOM 0 HD12 LEU A 107 -17.495 -4.743 4.514 1.00 0.53 H new ATOM 0 HD13 LEU A 107 -16.568 -5.834 5.570 1.00 0.53 H new ATOM 0 HD21 LEU A 107 -18.880 -7.814 6.117 1.00 0.53 H new ATOM 0 HD22 LEU A 107 -17.755 -7.176 7.340 1.00 0.53 H new ATOM 0 HD23 LEU A 107 -19.511 -6.984 7.559 1.00 0.53 H new ATOM 1799 N GLN A 108 -19.441 -3.905 10.344 1.00 0.49 N ATOM 1800 CA GLN A 108 -19.069 -3.090 11.532 1.00 0.51 C ATOM 1801 C GLN A 108 -17.603 -2.673 11.411 1.00 0.48 C ATOM 1802 O GLN A 108 -17.250 -1.532 11.636 1.00 0.48 O ATOM 1803 CB GLN A 108 -19.269 -3.917 12.806 1.00 0.55 C ATOM 1804 CG GLN A 108 -18.418 -5.190 12.738 1.00 1.20 C ATOM 1805 CD GLN A 108 -18.915 -6.197 13.777 1.00 1.53 C ATOM 1806 OE1 GLN A 108 -18.839 -5.950 14.964 1.00 1.94 O ATOM 1807 NE2 GLN A 108 -19.424 -7.331 13.378 1.00 2.08 N ATOM 0 H GLN A 108 -19.864 -4.810 10.550 1.00 0.49 H new ATOM 0 HA GLN A 108 -19.699 -2.202 11.582 1.00 0.51 H new ATOM 0 HB2 GLN A 108 -18.990 -3.328 13.680 1.00 0.55 H new ATOM 0 HB3 GLN A 108 -20.321 -4.178 12.920 1.00 0.55 H new ATOM 0 HG2 GLN A 108 -18.475 -5.624 11.740 1.00 1.20 H new ATOM 0 HG3 GLN A 108 -17.371 -4.950 12.922 1.00 1.20 H new ATOM 0 HE21 GLN A 108 -19.488 -7.539 12.381 1.00 2.08 H new ATOM 0 HE22 GLN A 108 -19.758 -8.009 14.063 1.00 2.08 H new ATOM 1816 N VAL A 109 -16.749 -3.593 11.063 1.00 0.47 N ATOM 1817 CA VAL A 109 -15.301 -3.265 10.931 1.00 0.45 C ATOM 1818 C VAL A 109 -15.117 -2.052 10.005 1.00 0.42 C ATOM 1819 O VAL A 109 -14.213 -1.258 10.190 1.00 0.42 O ATOM 1820 CB VAL A 109 -14.550 -4.489 10.378 1.00 0.45 C ATOM 1821 CG1 VAL A 109 -15.314 -5.078 9.194 1.00 0.45 C ATOM 1822 CG2 VAL A 109 -13.146 -4.084 9.918 1.00 0.44 C ATOM 0 H VAL A 109 -16.992 -4.563 10.863 1.00 0.47 H new ATOM 0 HA VAL A 109 -14.893 -3.011 11.910 1.00 0.45 H new ATOM 0 HB VAL A 109 -14.471 -5.234 11.170 1.00 0.45 H new ATOM 0 HG11 VAL A 109 -14.776 -5.944 8.808 1.00 0.45 H new ATOM 0 HG12 VAL A 109 -16.309 -5.384 9.519 1.00 0.45 H new ATOM 0 HG13 VAL A 109 -15.403 -4.327 8.409 1.00 0.45 H new ATOM 0 HG21 VAL A 109 -12.624 -4.958 9.529 1.00 0.44 H new ATOM 0 HG22 VAL A 109 -13.223 -3.329 9.135 1.00 0.44 H new ATOM 0 HG23 VAL A 109 -12.590 -3.676 10.762 1.00 0.44 H new ATOM 1832 N ILE A 110 -15.974 -1.867 9.032 1.00 0.40 N ATOM 1833 CA ILE A 110 -15.828 -0.675 8.147 1.00 0.39 C ATOM 1834 C ILE A 110 -16.511 0.507 8.822 1.00 0.41 C ATOM 1835 O ILE A 110 -15.895 1.508 9.121 1.00 0.42 O ATOM 1836 CB ILE A 110 -16.487 -0.941 6.787 1.00 0.38 C ATOM 1837 CG1 ILE A 110 -15.652 -1.982 6.032 1.00 0.39 C ATOM 1838 CG2 ILE A 110 -16.549 0.367 5.976 1.00 0.38 C ATOM 1839 CD1 ILE A 110 -16.293 -2.301 4.682 1.00 0.40 C ATOM 0 H ILE A 110 -16.758 -2.482 8.815 1.00 0.40 H new ATOM 0 HA ILE A 110 -14.771 -0.462 7.984 1.00 0.39 H new ATOM 0 HB ILE A 110 -17.501 -1.314 6.931 1.00 0.38 H new ATOM 0 HG12 ILE A 110 -14.640 -1.606 5.882 1.00 0.39 H new ATOM 0 HG13 ILE A 110 -15.569 -2.892 6.627 1.00 0.39 H new ATOM 0 HG21 ILE A 110 -17.017 0.175 5.011 1.00 0.38 H new ATOM 0 HG22 ILE A 110 -17.134 1.107 6.523 1.00 0.38 H new ATOM 0 HG23 ILE A 110 -15.539 0.747 5.820 1.00 0.38 H new ATOM 0 HD11 ILE A 110 -15.689 -3.041 4.158 1.00 0.40 H new ATOM 0 HD12 ILE A 110 -17.296 -2.697 4.840 1.00 0.40 H new ATOM 0 HD13 ILE A 110 -16.352 -1.392 4.084 1.00 0.40 H new ATOM 1851 N LYS A 111 -17.782 0.369 9.091 1.00 0.43 N ATOM 1852 CA LYS A 111 -18.538 1.460 9.769 1.00 0.46 C ATOM 1853 C LYS A 111 -17.715 1.972 10.947 1.00 0.49 C ATOM 1854 O LYS A 111 -17.831 3.107 11.365 1.00 0.53 O ATOM 1855 CB LYS A 111 -19.868 0.902 10.276 1.00 0.49 C ATOM 1856 CG LYS A 111 -20.756 0.527 9.075 1.00 0.52 C ATOM 1857 CD LYS A 111 -21.546 1.767 8.585 1.00 0.64 C ATOM 1858 CE LYS A 111 -21.689 1.737 7.061 1.00 0.80 C ATOM 1859 NZ LYS A 111 -22.388 2.971 6.602 1.00 1.60 N ATOM 0 H LYS A 111 -18.333 -0.460 8.868 1.00 0.43 H new ATOM 0 HA LYS A 111 -18.728 2.277 9.073 1.00 0.46 H new ATOM 0 HB2 LYS A 111 -19.693 0.026 10.901 1.00 0.49 H new ATOM 0 HB3 LYS A 111 -20.372 1.642 10.898 1.00 0.49 H new ATOM 0 HG2 LYS A 111 -20.139 0.137 8.265 1.00 0.52 H new ATOM 0 HG3 LYS A 111 -21.448 -0.265 9.359 1.00 0.52 H new ATOM 0 HD2 LYS A 111 -22.532 1.785 9.049 1.00 0.64 H new ATOM 0 HD3 LYS A 111 -21.032 2.678 8.891 1.00 0.64 H new ATOM 0 HE2 LYS A 111 -20.706 1.668 6.594 1.00 0.80 H new ATOM 0 HE3 LYS A 111 -22.250 0.854 6.755 1.00 0.80 H new ATOM 0 HZ1 LYS A 111 -22.485 2.950 5.567 1.00 1.60 H new ATOM 0 HZ2 LYS A 111 -23.331 3.018 7.037 1.00 1.60 H new ATOM 0 HZ3 LYS A 111 -21.836 3.807 6.881 1.00 1.60 H new ATOM 1873 N GLU A 112 -16.876 1.128 11.478 1.00 0.48 N ATOM 1874 CA GLU A 112 -16.023 1.534 12.628 1.00 0.50 C ATOM 1875 C GLU A 112 -14.775 2.258 12.113 1.00 0.48 C ATOM 1876 O GLU A 112 -14.292 3.187 12.728 1.00 0.50 O ATOM 1877 CB GLU A 112 -15.601 0.289 13.412 1.00 0.52 C ATOM 1878 CG GLU A 112 -14.758 0.705 14.619 1.00 1.38 C ATOM 1879 CD GLU A 112 -14.579 -0.492 15.554 1.00 1.90 C ATOM 1880 OE1 GLU A 112 -15.117 -1.543 15.248 1.00 2.49 O ATOM 1881 OE2 GLU A 112 -13.907 -0.336 16.561 1.00 2.45 O ATOM 0 H GLU A 112 -16.744 0.167 11.162 1.00 0.48 H new ATOM 0 HA GLU A 112 -16.587 2.203 13.278 1.00 0.50 H new ATOM 0 HB2 GLU A 112 -16.482 -0.261 13.743 1.00 0.52 H new ATOM 0 HB3 GLU A 112 -15.030 -0.381 12.770 1.00 0.52 H new ATOM 0 HG2 GLU A 112 -13.786 1.070 14.288 1.00 1.38 H new ATOM 0 HG3 GLU A 112 -15.243 1.525 15.149 1.00 1.38 H new ATOM 1888 N ALA A 113 -14.242 1.842 10.991 1.00 0.45 N ATOM 1889 CA ALA A 113 -13.022 2.519 10.460 1.00 0.44 C ATOM 1890 C ALA A 113 -13.401 3.842 9.777 1.00 0.45 C ATOM 1891 O ALA A 113 -12.584 4.732 9.652 1.00 0.49 O ATOM 1892 CB ALA A 113 -12.311 1.604 9.456 1.00 0.41 C ATOM 0 H ALA A 113 -14.596 1.070 10.425 1.00 0.45 H new ATOM 0 HA ALA A 113 -12.350 2.731 11.292 1.00 0.44 H new ATOM 0 HB1 ALA A 113 -11.422 2.105 9.073 1.00 0.41 H new ATOM 0 HB2 ALA A 113 -12.020 0.677 9.951 1.00 0.41 H new ATOM 0 HB3 ALA A 113 -12.984 1.378 8.629 1.00 0.41 H new ATOM 1898 N LEU A 114 -14.628 3.994 9.338 1.00 0.45 N ATOM 1899 CA LEU A 114 -15.017 5.273 8.679 1.00 0.47 C ATOM 1900 C LEU A 114 -14.773 6.433 9.647 1.00 0.53 C ATOM 1901 O LEU A 114 -14.383 7.513 9.250 1.00 0.56 O ATOM 1902 CB LEU A 114 -16.503 5.255 8.308 1.00 0.48 C ATOM 1903 CG LEU A 114 -16.848 4.081 7.377 1.00 0.45 C ATOM 1904 CD1 LEU A 114 -18.220 4.333 6.752 1.00 0.48 C ATOM 1905 CD2 LEU A 114 -15.809 3.932 6.256 1.00 0.43 C ATOM 0 H LEU A 114 -15.367 3.294 9.408 1.00 0.45 H new ATOM 0 HA LEU A 114 -14.420 5.395 7.775 1.00 0.47 H new ATOM 0 HB2 LEU A 114 -17.103 5.187 9.216 1.00 0.48 H new ATOM 0 HB3 LEU A 114 -16.767 6.194 7.821 1.00 0.48 H new ATOM 0 HG LEU A 114 -16.852 3.164 7.966 1.00 0.45 H new ATOM 0 HD11 LEU A 114 -18.475 3.506 6.089 1.00 0.48 H new ATOM 0 HD12 LEU A 114 -18.970 4.412 7.539 1.00 0.48 H new ATOM 0 HD13 LEU A 114 -18.195 5.261 6.181 1.00 0.48 H new ATOM 0 HD21 LEU A 114 -16.082 3.093 5.616 1.00 0.43 H new ATOM 0 HD22 LEU A 114 -15.779 4.846 5.663 1.00 0.43 H new ATOM 0 HD23 LEU A 114 -14.827 3.750 6.692 1.00 0.43 H new ATOM 1917 N GLU A 115 -15.002 6.220 10.914 1.00 0.57 N ATOM 1918 CA GLU A 115 -14.787 7.314 11.903 1.00 0.65 C ATOM 1919 C GLU A 115 -13.291 7.481 12.161 1.00 0.68 C ATOM 1920 O GLU A 115 -12.800 8.576 12.352 1.00 0.71 O ATOM 1921 CB GLU A 115 -15.493 6.964 13.214 1.00 0.69 C ATOM 1922 CG GLU A 115 -16.997 6.832 12.965 1.00 0.74 C ATOM 1923 CD GLU A 115 -17.574 8.197 12.587 1.00 1.38 C ATOM 1924 OE1 GLU A 115 -17.742 9.014 13.477 1.00 1.96 O ATOM 1925 OE2 GLU A 115 -17.839 8.402 11.413 1.00 2.19 O ATOM 0 H GLU A 115 -15.328 5.337 11.307 1.00 0.57 H new ATOM 0 HA GLU A 115 -15.194 8.245 11.508 1.00 0.65 H new ATOM 0 HB2 GLU A 115 -15.097 6.031 13.615 1.00 0.69 H new ATOM 0 HB3 GLU A 115 -15.303 7.737 13.959 1.00 0.69 H new ATOM 0 HG2 GLU A 115 -17.182 6.113 12.167 1.00 0.74 H new ATOM 0 HG3 GLU A 115 -17.492 6.451 13.858 1.00 0.74 H new ATOM 1932 N ALA A 116 -12.562 6.401 12.173 1.00 0.69 N ATOM 1933 CA ALA A 116 -11.098 6.490 12.423 1.00 0.74 C ATOM 1934 C ALA A 116 -10.428 7.277 11.294 1.00 0.77 C ATOM 1935 O ALA A 116 -9.223 7.421 11.256 1.00 1.03 O ATOM 1936 CB ALA A 116 -10.513 5.078 12.479 1.00 0.69 C ATOM 0 H ALA A 116 -12.919 5.458 12.020 1.00 0.69 H new ATOM 0 HA ALA A 116 -10.920 7.001 13.369 1.00 0.74 H new ATOM 0 HB1 ALA A 116 -9.440 5.136 12.662 1.00 0.69 H new ATOM 0 HB2 ALA A 116 -10.989 4.519 13.284 1.00 0.69 H new ATOM 0 HB3 ALA A 116 -10.693 4.572 11.530 1.00 0.69 H new ATOM 1942 N ASN A 117 -11.201 7.788 10.373 1.00 0.94 N ATOM 1943 CA ASN A 117 -10.609 8.565 9.246 1.00 0.97 C ATOM 1944 C ASN A 117 -10.417 10.022 9.672 1.00 0.96 C ATOM 1945 O ASN A 117 -11.352 10.695 10.058 1.00 1.28 O ATOM 1946 CB ASN A 117 -11.552 8.510 8.042 1.00 1.35 C ATOM 1947 CG ASN A 117 -10.867 9.140 6.828 1.00 1.76 C ATOM 1948 OD1 ASN A 117 -10.338 8.444 5.985 1.00 2.46 O ATOM 1949 ND2 ASN A 117 -10.855 10.439 6.702 1.00 2.16 N ATOM 0 H ASN A 117 -12.217 7.701 10.353 1.00 0.94 H new ATOM 0 HA ASN A 117 -9.644 8.135 8.977 1.00 0.97 H new ATOM 0 HB2 ASN A 117 -11.822 7.476 7.825 1.00 1.35 H new ATOM 0 HB3 ASN A 117 -12.477 9.041 8.267 1.00 1.35 H new ATOM 0 HD21 ASN A 117 -10.402 10.869 5.896 1.00 2.16 H new ATOM 0 HD22 ASN A 117 -11.299 11.024 7.410 1.00 2.16 H new ATOM 1956 N ASN A 118 -9.210 10.517 9.602 1.00 1.06 N ATOM 1957 CA ASN A 118 -8.957 11.933 9.998 1.00 1.47 C ATOM 1958 C ASN A 118 -7.676 12.424 9.326 1.00 1.21 C ATOM 1959 O ASN A 118 -7.010 13.318 9.807 1.00 2.09 O ATOM 1960 CB ASN A 118 -8.808 12.023 11.518 1.00 2.38 C ATOM 1961 CG ASN A 118 -7.571 11.238 11.958 1.00 2.99 C ATOM 1962 OD1 ASN A 118 -6.459 11.707 11.819 1.00 3.49 O ATOM 1963 ND2 ASN A 118 -7.718 10.054 12.486 1.00 3.62 N ATOM 0 H ASN A 118 -8.388 10.002 9.288 1.00 1.06 H new ATOM 0 HA ASN A 118 -9.795 12.555 9.683 1.00 1.47 H new ATOM 0 HB2 ASN A 118 -8.718 13.065 11.824 1.00 2.38 H new ATOM 0 HB3 ASN A 118 -9.697 11.624 12.005 1.00 2.38 H new ATOM 0 HD21 ASN A 118 -6.899 9.522 12.782 1.00 3.62 H new ATOM 0 HD22 ASN A 118 -8.652 9.660 12.603 1.00 3.62 H new ATOM 1970 N TYR A 119 -7.338 11.843 8.210 1.00 0.73 N ATOM 1971 CA TYR A 119 -6.107 12.258 7.478 1.00 0.98 C ATOM 1972 C TYR A 119 -5.989 11.428 6.196 1.00 1.08 C ATOM 1973 O TYR A 119 -5.369 10.383 6.184 1.00 2.08 O ATOM 1974 CB TYR A 119 -4.869 12.022 8.361 1.00 1.56 C ATOM 1975 CG TYR A 119 -3.611 12.136 7.525 1.00 1.26 C ATOM 1976 CD1 TYR A 119 -3.105 13.397 7.188 1.00 1.38 C ATOM 1977 CD2 TYR A 119 -2.958 10.979 7.082 1.00 1.51 C ATOM 1978 CE1 TYR A 119 -1.946 13.501 6.408 1.00 1.51 C ATOM 1979 CE2 TYR A 119 -1.800 11.083 6.303 1.00 1.60 C ATOM 1980 CZ TYR A 119 -1.294 12.344 5.966 1.00 1.50 C ATOM 1981 OH TYR A 119 -0.152 12.446 5.198 1.00 1.91 O ATOM 0 H TYR A 119 -7.866 11.091 7.768 1.00 0.73 H new ATOM 0 HA TYR A 119 -6.168 13.318 7.230 1.00 0.98 H new ATOM 0 HB2 TYR A 119 -4.845 12.751 9.171 1.00 1.56 H new ATOM 0 HB3 TYR A 119 -4.922 11.035 8.821 1.00 1.56 H new ATOM 0 HD1 TYR A 119 -3.608 14.290 7.529 1.00 1.38 H new ATOM 0 HD2 TYR A 119 -3.348 10.006 7.342 1.00 1.51 H new ATOM 0 HE1 TYR A 119 -1.556 14.474 6.148 1.00 1.51 H new ATOM 0 HE2 TYR A 119 -1.297 10.190 5.962 1.00 1.60 H new ATOM 0 HH TYR A 119 -0.281 11.965 4.354 1.00 1.91 H new ATOM 1991 N ILE A 120 -6.572 11.888 5.117 1.00 0.46 N ATOM 1992 CA ILE A 120 -6.492 11.132 3.829 1.00 0.39 C ATOM 1993 C ILE A 120 -5.513 11.850 2.880 1.00 0.37 C ATOM 1994 O ILE A 120 -5.656 13.034 2.647 1.00 0.38 O ATOM 1995 CB ILE A 120 -7.874 11.096 3.181 1.00 0.37 C ATOM 1996 CG1 ILE A 120 -8.912 10.700 4.245 1.00 0.40 C ATOM 1997 CG2 ILE A 120 -7.861 10.072 2.038 1.00 0.34 C ATOM 1998 CD1 ILE A 120 -10.219 10.259 3.585 1.00 0.40 C ATOM 0 H ILE A 120 -7.102 12.758 5.073 1.00 0.46 H new ATOM 0 HA ILE A 120 -6.146 10.116 4.021 1.00 0.39 H new ATOM 0 HB ILE A 120 -8.133 12.075 2.778 1.00 0.37 H new ATOM 0 HG12 ILE A 120 -8.519 9.891 4.861 1.00 0.40 H new ATOM 0 HG13 ILE A 120 -9.100 11.544 4.909 1.00 0.40 H new ATOM 0 HG21 ILE A 120 -8.844 10.039 1.568 1.00 0.34 H new ATOM 0 HG22 ILE A 120 -7.115 10.362 1.298 1.00 0.34 H new ATOM 0 HG23 ILE A 120 -7.615 9.087 2.435 1.00 0.34 H new ATOM 0 HD11 ILE A 120 -10.940 9.983 4.354 1.00 0.40 H new ATOM 0 HD12 ILE A 120 -10.620 11.079 2.989 1.00 0.40 H new ATOM 0 HD13 ILE A 120 -10.030 9.401 2.941 1.00 0.40 H new ATOM 2010 N PRO A 121 -4.530 11.165 2.328 1.00 0.35 N ATOM 2011 CA PRO A 121 -3.554 11.799 1.394 1.00 0.35 C ATOM 2012 C PRO A 121 -4.229 12.752 0.398 1.00 0.34 C ATOM 2013 O PRO A 121 -5.439 12.837 0.323 1.00 0.38 O ATOM 2014 CB PRO A 121 -2.927 10.606 0.669 1.00 0.33 C ATOM 2015 CG PRO A 121 -2.983 9.486 1.657 1.00 0.34 C ATOM 2016 CD PRO A 121 -4.227 9.731 2.524 1.00 0.35 C ATOM 0 HA PRO A 121 -2.828 12.418 1.921 1.00 0.35 H new ATOM 0 HB2 PRO A 121 -3.478 10.361 -0.239 1.00 0.33 H new ATOM 0 HB3 PRO A 121 -1.901 10.819 0.371 1.00 0.33 H new ATOM 0 HG2 PRO A 121 -3.047 8.524 1.149 1.00 0.34 H new ATOM 0 HG3 PRO A 121 -2.082 9.464 2.269 1.00 0.34 H new ATOM 0 HD2 PRO A 121 -5.060 9.102 2.211 1.00 0.35 H new ATOM 0 HD3 PRO A 121 -4.032 9.505 3.572 1.00 0.35 H new ATOM 2024 N ASP A 122 -3.453 13.474 -0.366 1.00 0.35 N ATOM 2025 CA ASP A 122 -4.043 14.429 -1.349 1.00 0.36 C ATOM 2026 C ASP A 122 -4.336 13.719 -2.675 1.00 0.33 C ATOM 2027 O ASP A 122 -5.200 14.130 -3.424 1.00 0.34 O ATOM 2028 CB ASP A 122 -3.055 15.570 -1.598 1.00 0.42 C ATOM 2029 CG ASP A 122 -2.941 16.431 -0.339 1.00 1.42 C ATOM 2030 OD1 ASP A 122 -3.779 17.300 -0.162 1.00 2.16 O ATOM 2031 OD2 ASP A 122 -2.018 16.207 0.427 1.00 2.15 O ATOM 0 H ASP A 122 -2.434 13.443 -0.352 1.00 0.35 H new ATOM 0 HA ASP A 122 -4.976 14.821 -0.944 1.00 0.36 H new ATOM 0 HB2 ASP A 122 -2.078 15.167 -1.866 1.00 0.42 H new ATOM 0 HB3 ASP A 122 -3.390 16.178 -2.438 1.00 0.42 H new ATOM 2036 N TYR A 123 -3.624 12.666 -2.985 1.00 0.32 N ATOM 2037 CA TYR A 123 -3.874 11.957 -4.278 1.00 0.31 C ATOM 2038 C TYR A 123 -5.022 10.950 -4.119 1.00 0.27 C ATOM 2039 O TYR A 123 -5.430 10.313 -5.074 1.00 0.29 O ATOM 2040 CB TYR A 123 -2.597 11.237 -4.732 1.00 0.35 C ATOM 2041 CG TYR A 123 -1.910 10.596 -3.552 1.00 0.35 C ATOM 2042 CD1 TYR A 123 -1.007 11.336 -2.781 1.00 0.43 C ATOM 2043 CD2 TYR A 123 -2.169 9.259 -3.236 1.00 0.47 C ATOM 2044 CE1 TYR A 123 -0.364 10.738 -1.691 1.00 0.57 C ATOM 2045 CE2 TYR A 123 -1.526 8.660 -2.146 1.00 0.62 C ATOM 2046 CZ TYR A 123 -0.624 9.400 -1.374 1.00 0.65 C ATOM 2047 OH TYR A 123 0.010 8.810 -0.299 1.00 0.85 O ATOM 0 H TYR A 123 -2.886 12.268 -2.405 1.00 0.32 H new ATOM 0 HA TYR A 123 -4.157 12.689 -5.034 1.00 0.31 H new ATOM 0 HB2 TYR A 123 -2.844 10.478 -5.474 1.00 0.35 H new ATOM 0 HB3 TYR A 123 -1.923 11.946 -5.213 1.00 0.35 H new ATOM 0 HD1 TYR A 123 -0.806 12.368 -3.027 1.00 0.43 H new ATOM 0 HD2 TYR A 123 -2.865 8.688 -3.833 1.00 0.47 H new ATOM 0 HE1 TYR A 123 0.332 11.309 -1.095 1.00 0.57 H new ATOM 0 HE2 TYR A 123 -1.726 7.627 -1.901 1.00 0.62 H new ATOM 0 HH TYR A 123 -0.518 8.045 0.013 1.00 0.85 H new ATOM 2057 N LEU A 124 -5.556 10.810 -2.927 1.00 0.25 N ATOM 2058 CA LEU A 124 -6.693 9.855 -2.703 1.00 0.22 C ATOM 2059 C LEU A 124 -7.965 10.642 -2.387 1.00 0.21 C ATOM 2060 O LEU A 124 -8.019 11.406 -1.443 1.00 0.22 O ATOM 2061 CB LEU A 124 -6.386 8.929 -1.514 1.00 0.23 C ATOM 2062 CG LEU A 124 -5.202 7.999 -1.826 1.00 0.22 C ATOM 2063 CD1 LEU A 124 -4.980 7.052 -0.640 1.00 0.24 C ATOM 2064 CD2 LEU A 124 -5.485 7.169 -3.090 1.00 0.22 C ATOM 0 H LEU A 124 -5.253 11.318 -2.096 1.00 0.25 H new ATOM 0 HA LEU A 124 -6.829 9.259 -3.605 1.00 0.22 H new ATOM 0 HB2 LEU A 124 -6.159 9.528 -0.632 1.00 0.23 H new ATOM 0 HB3 LEU A 124 -7.267 8.333 -1.276 1.00 0.23 H new ATOM 0 HG LEU A 124 -4.313 8.606 -1.996 1.00 0.22 H new ATOM 0 HD11 LEU A 124 -4.141 6.390 -0.855 1.00 0.24 H new ATOM 0 HD12 LEU A 124 -4.762 7.635 0.255 1.00 0.24 H new ATOM 0 HD13 LEU A 124 -5.879 6.458 -0.476 1.00 0.24 H new ATOM 0 HD21 LEU A 124 -4.636 6.517 -3.295 1.00 0.22 H new ATOM 0 HD22 LEU A 124 -6.378 6.564 -2.935 1.00 0.22 H new ATOM 0 HD23 LEU A 124 -5.642 7.837 -3.937 1.00 0.22 H new ATOM 2076 N SER A 125 -9.001 10.435 -3.160 1.00 0.21 N ATOM 2077 CA SER A 125 -10.297 11.135 -2.908 1.00 0.22 C ATOM 2078 C SER A 125 -11.241 10.135 -2.235 1.00 0.24 C ATOM 2079 O SER A 125 -11.552 9.104 -2.794 1.00 0.25 O ATOM 2080 CB SER A 125 -10.894 11.601 -4.243 1.00 0.23 C ATOM 2081 OG SER A 125 -12.310 11.469 -4.202 1.00 1.10 O ATOM 0 H SER A 125 -9.004 9.805 -3.962 1.00 0.21 H new ATOM 0 HA SER A 125 -10.150 12.006 -2.270 1.00 0.22 H new ATOM 0 HB2 SER A 125 -10.620 12.639 -4.433 1.00 0.23 H new ATOM 0 HB3 SER A 125 -10.487 11.009 -5.062 1.00 0.23 H new ATOM 0 HG SER A 125 -12.691 11.768 -5.054 1.00 1.10 H new ATOM 2087 N PHE A 126 -11.684 10.413 -1.033 1.00 0.27 N ATOM 2088 CA PHE A 126 -12.589 9.454 -0.320 1.00 0.31 C ATOM 2089 C PHE A 126 -14.047 9.907 -0.409 1.00 0.30 C ATOM 2090 O PHE A 126 -14.398 10.997 -0.002 1.00 0.29 O ATOM 2091 CB PHE A 126 -12.182 9.386 1.150 1.00 0.37 C ATOM 2092 CG PHE A 126 -12.953 8.281 1.836 1.00 0.42 C ATOM 2093 CD1 PHE A 126 -12.694 6.944 1.512 1.00 0.51 C ATOM 2094 CD2 PHE A 126 -13.928 8.591 2.795 1.00 0.45 C ATOM 2095 CE1 PHE A 126 -13.407 5.918 2.145 1.00 0.57 C ATOM 2096 CE2 PHE A 126 -14.640 7.566 3.427 1.00 0.50 C ATOM 2097 CZ PHE A 126 -14.379 6.229 3.103 1.00 0.55 C ATOM 0 H PHE A 126 -11.459 11.262 -0.514 1.00 0.27 H new ATOM 0 HA PHE A 126 -12.498 8.475 -0.791 1.00 0.31 H new ATOM 0 HB2 PHE A 126 -11.111 9.203 1.234 1.00 0.37 H new ATOM 0 HB3 PHE A 126 -12.381 10.340 1.638 1.00 0.37 H new ATOM 0 HD1 PHE A 126 -11.944 6.703 0.773 1.00 0.51 H new ATOM 0 HD2 PHE A 126 -14.129 9.622 3.046 1.00 0.45 H new ATOM 0 HE1 PHE A 126 -13.207 4.887 1.894 1.00 0.57 H new ATOM 0 HE2 PHE A 126 -15.391 7.806 4.165 1.00 0.50 H new ATOM 0 HZ PHE A 126 -14.928 5.438 3.592 1.00 0.55 H new ATOM 2107 N ASP A 127 -14.904 9.059 -0.920 1.00 0.33 N ATOM 2108 CA ASP A 127 -16.356 9.401 -1.023 1.00 0.37 C ATOM 2109 C ASP A 127 -17.106 8.655 0.098 1.00 0.35 C ATOM 2110 O ASP A 127 -17.199 7.444 0.066 1.00 0.54 O ATOM 2111 CB ASP A 127 -16.890 8.935 -2.380 1.00 0.47 C ATOM 2112 CG ASP A 127 -15.958 9.419 -3.492 1.00 1.28 C ATOM 2113 OD1 ASP A 127 -14.756 9.298 -3.326 1.00 1.89 O ATOM 2114 OD2 ASP A 127 -16.463 9.903 -4.491 1.00 2.03 O ATOM 0 H ASP A 127 -14.657 8.135 -1.274 1.00 0.33 H new ATOM 0 HA ASP A 127 -16.500 10.477 -0.928 1.00 0.37 H new ATOM 0 HB2 ASP A 127 -16.962 7.848 -2.400 1.00 0.47 H new ATOM 0 HB3 ASP A 127 -17.896 9.324 -2.539 1.00 0.47 H new ATOM 2119 N PRO A 128 -17.620 9.346 1.094 1.00 0.39 N ATOM 2120 CA PRO A 128 -18.336 8.687 2.225 1.00 0.41 C ATOM 2121 C PRO A 128 -19.784 8.318 1.878 1.00 0.42 C ATOM 2122 O PRO A 128 -20.287 7.293 2.293 1.00 0.45 O ATOM 2123 CB PRO A 128 -18.288 9.747 3.330 1.00 0.50 C ATOM 2124 CG PRO A 128 -18.298 11.054 2.601 1.00 1.02 C ATOM 2125 CD PRO A 128 -17.585 10.814 1.264 1.00 0.68 C ATOM 0 HA PRO A 128 -17.877 7.739 2.504 1.00 0.41 H new ATOM 0 HB2 PRO A 128 -19.144 9.660 4.000 1.00 0.50 H new ATOM 0 HB3 PRO A 128 -17.392 9.641 3.942 1.00 0.50 H new ATOM 0 HG2 PRO A 128 -19.319 11.400 2.439 1.00 1.02 H new ATOM 0 HG3 PRO A 128 -17.788 11.824 3.179 1.00 1.02 H new ATOM 0 HD2 PRO A 128 -18.093 11.322 0.445 1.00 0.68 H new ATOM 0 HD3 PRO A 128 -16.562 11.188 1.285 1.00 0.68 H new ATOM 2133 N GLU A 129 -20.462 9.144 1.131 1.00 0.47 N ATOM 2134 CA GLU A 129 -21.874 8.834 0.775 1.00 0.51 C ATOM 2135 C GLU A 129 -21.949 7.468 0.092 1.00 0.49 C ATOM 2136 O GLU A 129 -22.693 6.599 0.502 1.00 0.53 O ATOM 2137 CB GLU A 129 -22.407 9.908 -0.177 1.00 0.57 C ATOM 2138 CG GLU A 129 -22.224 11.289 0.457 1.00 1.52 C ATOM 2139 CD GLU A 129 -22.986 12.332 -0.362 1.00 1.77 C ATOM 2140 OE1 GLU A 129 -24.166 12.127 -0.594 1.00 2.40 O ATOM 2141 OE2 GLU A 129 -22.377 13.317 -0.744 1.00 2.10 O ATOM 0 H GLU A 129 -20.100 10.019 0.752 1.00 0.47 H new ATOM 0 HA GLU A 129 -22.477 8.816 1.683 1.00 0.51 H new ATOM 0 HB2 GLU A 129 -21.878 9.860 -1.129 1.00 0.57 H new ATOM 0 HB3 GLU A 129 -23.461 9.730 -0.389 1.00 0.57 H new ATOM 0 HG2 GLU A 129 -22.589 11.280 1.484 1.00 1.52 H new ATOM 0 HG3 GLU A 129 -21.165 11.545 0.497 1.00 1.52 H new ATOM 2148 N LYS A 130 -21.191 7.273 -0.956 1.00 0.46 N ATOM 2149 CA LYS A 130 -21.220 5.968 -1.681 1.00 0.48 C ATOM 2150 C LYS A 130 -20.059 5.084 -1.210 1.00 0.43 C ATOM 2151 O LYS A 130 -19.803 4.037 -1.770 1.00 0.43 O ATOM 2152 CB LYS A 130 -21.082 6.240 -3.186 1.00 0.53 C ATOM 2153 CG LYS A 130 -22.435 6.675 -3.778 1.00 0.63 C ATOM 2154 CD LYS A 130 -23.268 5.441 -4.167 1.00 1.52 C ATOM 2155 CE LYS A 130 -22.906 4.981 -5.584 1.00 1.97 C ATOM 2156 NZ LYS A 130 -23.772 3.831 -5.969 1.00 2.90 N ATOM 0 H LYS A 130 -20.550 7.966 -1.343 1.00 0.46 H new ATOM 0 HA LYS A 130 -22.159 5.454 -1.478 1.00 0.48 H new ATOM 0 HB2 LYS A 130 -20.337 7.017 -3.355 1.00 0.53 H new ATOM 0 HB3 LYS A 130 -20.727 5.343 -3.693 1.00 0.53 H new ATOM 0 HG2 LYS A 130 -22.981 7.277 -3.052 1.00 0.63 H new ATOM 0 HG3 LYS A 130 -22.272 7.303 -4.654 1.00 0.63 H new ATOM 0 HD2 LYS A 130 -23.087 4.633 -3.458 1.00 1.52 H new ATOM 0 HD3 LYS A 130 -24.330 5.679 -4.115 1.00 1.52 H new ATOM 0 HE2 LYS A 130 -23.038 5.802 -6.289 1.00 1.97 H new ATOM 0 HE3 LYS A 130 -21.856 4.690 -5.626 1.00 1.97 H new ATOM 0 HZ1 LYS A 130 -23.527 3.518 -6.930 1.00 2.90 H new ATOM 0 HZ2 LYS A 130 -23.625 3.047 -5.302 1.00 2.90 H new ATOM 0 HZ3 LYS A 130 -24.770 4.124 -5.944 1.00 2.90 H new ATOM 2170 N MET A 131 -19.351 5.494 -0.191 1.00 0.41 N ATOM 2171 CA MET A 131 -18.208 4.667 0.298 1.00 0.40 C ATOM 2172 C MET A 131 -17.336 4.264 -0.898 1.00 0.39 C ATOM 2173 O MET A 131 -17.145 3.091 -1.180 1.00 0.40 O ATOM 2174 CB MET A 131 -18.753 3.410 1.013 1.00 0.44 C ATOM 2175 CG MET A 131 -18.954 3.695 2.509 1.00 0.46 C ATOM 2176 SD MET A 131 -20.224 2.581 3.169 1.00 0.53 S ATOM 2177 CE MET A 131 -19.121 1.364 3.933 1.00 0.45 C ATOM 0 H MET A 131 -19.513 6.361 0.322 1.00 0.41 H new ATOM 0 HA MET A 131 -17.606 5.239 1.004 1.00 0.40 H new ATOM 0 HB2 MET A 131 -19.699 3.108 0.563 1.00 0.44 H new ATOM 0 HB3 MET A 131 -18.059 2.580 0.884 1.00 0.44 H new ATOM 0 HG2 MET A 131 -18.016 3.554 3.046 1.00 0.46 H new ATOM 0 HG3 MET A 131 -19.253 4.733 2.656 1.00 0.46 H new ATOM 0 HE1 MET A 131 -19.644 0.857 4.744 1.00 0.45 H new ATOM 0 HE2 MET A 131 -18.813 0.632 3.186 1.00 0.45 H new ATOM 0 HE3 MET A 131 -18.241 1.869 4.330 1.00 0.45 H new ATOM 2187 N GLU A 132 -16.805 5.234 -1.607 1.00 0.39 N ATOM 2188 CA GLU A 132 -15.945 4.922 -2.788 1.00 0.40 C ATOM 2189 C GLU A 132 -14.695 5.801 -2.782 1.00 0.38 C ATOM 2190 O GLU A 132 -14.766 7.011 -2.706 1.00 0.52 O ATOM 2191 CB GLU A 132 -16.736 5.147 -4.082 1.00 0.46 C ATOM 2192 CG GLU A 132 -15.886 4.747 -5.280 1.00 0.63 C ATOM 2193 CD GLU A 132 -16.787 4.567 -6.507 1.00 1.55 C ATOM 2194 OE1 GLU A 132 -17.059 5.555 -7.168 1.00 1.93 O ATOM 2195 OE2 GLU A 132 -17.188 3.443 -6.763 1.00 2.24 O ATOM 0 H GLU A 132 -16.932 6.228 -1.416 1.00 0.39 H new ATOM 0 HA GLU A 132 -15.638 3.878 -2.732 1.00 0.40 H new ATOM 0 HB2 GLU A 132 -17.655 4.561 -4.064 1.00 0.46 H new ATOM 0 HB3 GLU A 132 -17.027 6.194 -4.164 1.00 0.46 H new ATOM 0 HG2 GLU A 132 -15.133 5.510 -5.477 1.00 0.63 H new ATOM 0 HG3 GLU A 132 -15.352 3.820 -5.068 1.00 0.63 H new ATOM 2202 N GLY A 133 -13.545 5.183 -2.880 1.00 0.29 N ATOM 2203 CA GLY A 133 -12.261 5.948 -2.904 1.00 0.33 C ATOM 2204 C GLY A 133 -11.776 6.015 -4.349 1.00 0.38 C ATOM 2205 O GLY A 133 -12.005 5.104 -5.120 1.00 0.71 O ATOM 0 H GLY A 133 -13.440 4.171 -2.945 1.00 0.29 H new ATOM 0 HA2 GLY A 133 -12.408 6.952 -2.505 1.00 0.33 H new ATOM 0 HA3 GLY A 133 -11.516 5.461 -2.275 1.00 0.33 H new ATOM 2209 N THR A 134 -11.125 7.088 -4.736 1.00 0.20 N ATOM 2210 CA THR A 134 -10.647 7.212 -6.152 1.00 0.21 C ATOM 2211 C THR A 134 -9.162 7.555 -6.201 1.00 0.21 C ATOM 2212 O THR A 134 -8.701 8.484 -5.568 1.00 0.21 O ATOM 2213 CB THR A 134 -11.436 8.319 -6.856 1.00 0.23 C ATOM 2214 OG1 THR A 134 -12.810 7.967 -6.906 1.00 0.24 O ATOM 2215 CG2 THR A 134 -10.901 8.508 -8.277 1.00 0.29 C ATOM 0 H THR A 134 -10.904 7.881 -4.134 1.00 0.20 H new ATOM 0 HA THR A 134 -10.801 6.256 -6.652 1.00 0.21 H new ATOM 0 HB THR A 134 -11.323 9.251 -6.302 1.00 0.23 H new ATOM 0 HG1 THR A 134 -13.314 8.678 -7.355 1.00 0.24 H new ATOM 0 HG21 THR A 134 -11.464 9.297 -8.776 1.00 0.29 H new ATOM 0 HG22 THR A 134 -9.848 8.785 -8.235 1.00 0.29 H new ATOM 0 HG23 THR A 134 -11.009 7.577 -8.833 1.00 0.29 H new ATOM 2223 N TYR A 135 -8.416 6.829 -6.993 1.00 0.22 N ATOM 2224 CA TYR A 135 -6.966 7.135 -7.136 1.00 0.24 C ATOM 2225 C TYR A 135 -6.876 8.301 -8.131 1.00 0.26 C ATOM 2226 O TYR A 135 -6.808 8.106 -9.328 1.00 0.30 O ATOM 2227 CB TYR A 135 -6.232 5.880 -7.673 1.00 0.27 C ATOM 2228 CG TYR A 135 -4.914 5.662 -6.948 1.00 0.27 C ATOM 2229 CD1 TYR A 135 -4.092 6.749 -6.620 1.00 0.65 C ATOM 2230 CD2 TYR A 135 -4.517 4.361 -6.609 1.00 0.66 C ATOM 2231 CE1 TYR A 135 -2.878 6.533 -5.952 1.00 0.68 C ATOM 2232 CE2 TYR A 135 -3.305 4.148 -5.943 1.00 0.65 C ATOM 2233 CZ TYR A 135 -2.487 5.233 -5.614 1.00 0.33 C ATOM 2234 OH TYR A 135 -1.291 5.021 -4.957 1.00 0.37 O ATOM 0 H TYR A 135 -8.750 6.039 -7.545 1.00 0.22 H new ATOM 0 HA TYR A 135 -6.500 7.405 -6.188 1.00 0.24 H new ATOM 0 HB2 TYR A 135 -6.867 5.003 -7.549 1.00 0.27 H new ATOM 0 HB3 TYR A 135 -6.048 5.992 -8.741 1.00 0.27 H new ATOM 0 HD1 TYR A 135 -4.393 7.753 -6.882 1.00 0.65 H new ATOM 0 HD2 TYR A 135 -5.148 3.522 -6.862 1.00 0.66 H new ATOM 0 HE1 TYR A 135 -2.245 7.370 -5.698 1.00 0.68 H new ATOM 0 HE2 TYR A 135 -3.001 3.145 -5.683 1.00 0.65 H new ATOM 0 HH TYR A 135 -1.172 4.062 -4.796 1.00 0.37 H new ATOM 2244 N THR A 136 -6.941 9.515 -7.650 1.00 0.25 N ATOM 2245 CA THR A 136 -6.930 10.686 -8.580 1.00 0.28 C ATOM 2246 C THR A 136 -5.497 11.048 -8.997 1.00 0.31 C ATOM 2247 O THR A 136 -5.297 11.838 -9.898 1.00 0.34 O ATOM 2248 CB THR A 136 -7.618 11.904 -7.905 1.00 0.30 C ATOM 2249 OG1 THR A 136 -6.675 12.954 -7.727 1.00 0.37 O ATOM 2250 CG2 THR A 136 -8.199 11.515 -6.537 1.00 0.26 C ATOM 0 H THR A 136 -7.001 9.747 -6.659 1.00 0.25 H new ATOM 0 HA THR A 136 -7.483 10.415 -9.479 1.00 0.28 H new ATOM 0 HB THR A 136 -8.429 12.237 -8.552 1.00 0.30 H new ATOM 0 HG1 THR A 136 -7.115 13.720 -7.303 1.00 0.37 H new ATOM 0 HG21 THR A 136 -8.676 12.384 -6.084 1.00 0.26 H new ATOM 0 HG22 THR A 136 -8.937 10.723 -6.667 1.00 0.26 H new ATOM 0 HG23 THR A 136 -7.397 11.161 -5.889 1.00 0.26 H new ATOM 2258 N ARG A 137 -4.501 10.490 -8.367 1.00 0.32 N ATOM 2259 CA ARG A 137 -3.104 10.836 -8.767 1.00 0.38 C ATOM 2260 C ARG A 137 -2.111 9.881 -8.099 1.00 0.36 C ATOM 2261 O ARG A 137 -2.478 9.063 -7.283 1.00 0.34 O ATOM 2262 CB ARG A 137 -2.807 12.281 -8.345 1.00 0.42 C ATOM 2263 CG ARG A 137 -1.386 12.678 -8.776 1.00 0.89 C ATOM 2264 CD ARG A 137 -1.281 14.204 -8.876 1.00 1.17 C ATOM 2265 NE ARG A 137 0.080 14.578 -9.354 1.00 1.80 N ATOM 2266 CZ ARG A 137 0.307 15.784 -9.797 1.00 2.45 C ATOM 2267 NH1 ARG A 137 -0.658 16.663 -9.821 1.00 2.60 N ATOM 2268 NH2 ARG A 137 1.498 16.112 -10.217 1.00 3.43 N ATOM 0 H ARG A 137 -4.588 9.819 -7.604 1.00 0.32 H new ATOM 0 HA ARG A 137 -3.001 10.741 -9.848 1.00 0.38 H new ATOM 0 HB2 ARG A 137 -3.534 12.956 -8.797 1.00 0.42 H new ATOM 0 HB3 ARG A 137 -2.908 12.380 -7.264 1.00 0.42 H new ATOM 0 HG2 ARG A 137 -0.659 12.301 -8.057 1.00 0.89 H new ATOM 0 HG3 ARG A 137 -1.148 12.224 -9.738 1.00 0.89 H new ATOM 0 HD2 ARG A 137 -2.037 14.587 -9.562 1.00 1.17 H new ATOM 0 HD3 ARG A 137 -1.474 14.657 -7.904 1.00 1.17 H new ATOM 0 HE ARG A 137 0.834 13.891 -9.335 1.00 1.80 H new ATOM 0 HH11 ARG A 137 -1.589 16.407 -9.493 1.00 2.60 H new ATOM 0 HH12 ARG A 137 -0.481 17.606 -10.167 1.00 2.60 H new ATOM 0 HH21 ARG A 137 2.252 15.425 -10.199 1.00 3.43 H new ATOM 0 HH22 ARG A 137 1.675 17.055 -10.563 1.00 3.43 H new ATOM 2282 N LEU A 138 -0.853 9.977 -8.446 1.00 0.38 N ATOM 2283 CA LEU A 138 0.171 9.075 -7.838 1.00 0.38 C ATOM 2284 C LEU A 138 0.672 9.695 -6.521 1.00 0.38 C ATOM 2285 O LEU A 138 0.592 10.892 -6.331 1.00 0.40 O ATOM 2286 CB LEU A 138 1.343 8.917 -8.824 1.00 0.40 C ATOM 2287 CG LEU A 138 1.061 7.758 -9.803 1.00 0.46 C ATOM 2288 CD1 LEU A 138 1.886 7.950 -11.071 1.00 0.53 C ATOM 2289 CD2 LEU A 138 1.440 6.412 -9.168 1.00 0.49 C ATOM 0 H LEU A 138 -0.490 10.644 -9.127 1.00 0.38 H new ATOM 0 HA LEU A 138 -0.263 8.097 -7.630 1.00 0.38 H new ATOM 0 HB2 LEU A 138 1.489 9.844 -9.378 1.00 0.40 H new ATOM 0 HB3 LEU A 138 2.265 8.724 -8.276 1.00 0.40 H new ATOM 0 HG LEU A 138 -0.003 7.757 -10.040 1.00 0.46 H new ATOM 0 HD11 LEU A 138 1.687 7.131 -11.762 1.00 0.53 H new ATOM 0 HD12 LEU A 138 1.616 8.896 -11.541 1.00 0.53 H new ATOM 0 HD13 LEU A 138 2.946 7.961 -10.817 1.00 0.53 H new ATOM 0 HD21 LEU A 138 1.234 5.606 -9.873 1.00 0.49 H new ATOM 0 HD22 LEU A 138 2.501 6.413 -8.918 1.00 0.49 H new ATOM 0 HD23 LEU A 138 0.854 6.259 -8.262 1.00 0.49 H new ATOM 2301 N PRO A 139 1.189 8.892 -5.618 1.00 0.39 N ATOM 2302 CA PRO A 139 1.708 9.386 -4.306 1.00 0.43 C ATOM 2303 C PRO A 139 3.100 10.023 -4.432 1.00 0.63 C ATOM 2304 O PRO A 139 3.755 9.910 -5.449 1.00 0.87 O ATOM 2305 CB PRO A 139 1.775 8.111 -3.459 1.00 0.55 C ATOM 2306 CG PRO A 139 2.066 7.028 -4.445 1.00 0.47 C ATOM 2307 CD PRO A 139 1.336 7.425 -5.735 1.00 0.41 C ATOM 0 HA PRO A 139 1.078 10.167 -3.881 1.00 0.43 H new ATOM 0 HB2 PRO A 139 2.555 8.178 -2.700 1.00 0.55 H new ATOM 0 HB3 PRO A 139 0.836 7.931 -2.936 1.00 0.55 H new ATOM 0 HG2 PRO A 139 3.138 6.934 -4.616 1.00 0.47 H new ATOM 0 HG3 PRO A 139 1.716 6.063 -4.079 1.00 0.47 H new ATOM 0 HD2 PRO A 139 1.909 7.149 -6.620 1.00 0.41 H new ATOM 0 HD3 PRO A 139 0.368 6.931 -5.815 1.00 0.41 H new ATOM 2315 N GLU A 140 3.554 10.684 -3.395 1.00 0.70 N ATOM 2316 CA GLU A 140 4.907 11.327 -3.431 1.00 0.98 C ATOM 2317 C GLU A 140 5.614 11.080 -2.093 1.00 0.99 C ATOM 2318 O GLU A 140 5.060 10.491 -1.186 1.00 1.51 O ATOM 2319 CB GLU A 140 4.758 12.839 -3.672 1.00 1.08 C ATOM 2320 CG GLU A 140 3.524 13.099 -4.539 1.00 1.16 C ATOM 2321 CD GLU A 140 3.522 14.557 -5.000 1.00 1.95 C ATOM 2322 OE1 GLU A 140 4.233 14.861 -5.944 1.00 2.57 O ATOM 2323 OE2 GLU A 140 2.810 15.346 -4.402 1.00 2.58 O ATOM 0 H GLU A 140 3.044 10.807 -2.520 1.00 0.70 H new ATOM 0 HA GLU A 140 5.497 10.897 -4.241 1.00 0.98 H new ATOM 0 HB2 GLU A 140 4.664 13.362 -2.720 1.00 1.08 H new ATOM 0 HB3 GLU A 140 5.649 13.229 -4.163 1.00 1.08 H new ATOM 0 HG2 GLU A 140 3.526 12.434 -5.402 1.00 1.16 H new ATOM 0 HG3 GLU A 140 2.617 12.884 -3.973 1.00 1.16 H new ATOM 2330 N ARG A 141 6.838 11.511 -1.972 1.00 0.93 N ATOM 2331 CA ARG A 141 7.589 11.286 -0.703 1.00 0.92 C ATOM 2332 C ARG A 141 7.042 12.186 0.408 1.00 0.76 C ATOM 2333 O ARG A 141 7.059 11.828 1.569 1.00 0.80 O ATOM 2334 CB ARG A 141 9.068 11.606 -0.928 1.00 1.25 C ATOM 2335 CG ARG A 141 9.669 10.589 -1.901 1.00 1.44 C ATOM 2336 CD ARG A 141 11.190 10.746 -1.929 1.00 2.01 C ATOM 2337 NE ARG A 141 11.781 9.702 -2.812 1.00 2.78 N ATOM 2338 CZ ARG A 141 13.014 9.818 -3.226 1.00 3.38 C ATOM 2339 NH1 ARG A 141 13.728 10.850 -2.866 1.00 3.41 N ATOM 2340 NH2 ARG A 141 13.532 8.903 -3.998 1.00 4.30 N ATOM 0 H ARG A 141 7.353 12.010 -2.697 1.00 0.93 H new ATOM 0 HA ARG A 141 7.473 10.244 -0.404 1.00 0.92 H new ATOM 0 HB2 ARG A 141 9.176 12.615 -1.327 1.00 1.25 H new ATOM 0 HB3 ARG A 141 9.605 11.579 0.020 1.00 1.25 H new ATOM 0 HG2 ARG A 141 9.403 9.577 -1.596 1.00 1.44 H new ATOM 0 HG3 ARG A 141 9.259 10.739 -2.900 1.00 1.44 H new ATOM 0 HD2 ARG A 141 11.457 11.738 -2.292 1.00 2.01 H new ATOM 0 HD3 ARG A 141 11.594 10.656 -0.921 1.00 2.01 H new ATOM 0 HE ARG A 141 11.222 8.896 -3.093 1.00 2.78 H new ATOM 0 HH11 ARG A 141 13.323 11.565 -2.262 1.00 3.41 H new ATOM 0 HH12 ARG A 141 14.691 10.941 -3.189 1.00 3.41 H new ATOM 0 HH21 ARG A 141 12.974 8.097 -4.278 1.00 4.30 H new ATOM 0 HH22 ARG A 141 14.495 8.994 -4.321 1.00 4.30 H new ATOM 2354 N SER A 142 6.569 13.355 0.073 1.00 0.75 N ATOM 2355 CA SER A 142 6.038 14.276 1.120 1.00 0.83 C ATOM 2356 C SER A 142 4.950 13.584 1.949 1.00 0.84 C ATOM 2357 O SER A 142 4.397 14.169 2.859 1.00 1.27 O ATOM 2358 CB SER A 142 5.449 15.517 0.449 1.00 1.06 C ATOM 2359 OG SER A 142 4.354 15.131 -0.372 1.00 1.20 O ATOM 0 H SER A 142 6.527 13.713 -0.881 1.00 0.75 H new ATOM 0 HA SER A 142 6.855 14.560 1.783 1.00 0.83 H new ATOM 0 HB2 SER A 142 5.119 16.231 1.204 1.00 1.06 H new ATOM 0 HB3 SER A 142 6.210 16.016 -0.151 1.00 1.06 H new ATOM 0 HG SER A 142 3.972 15.924 -0.803 1.00 1.20 H new ATOM 2365 N GLU A 143 4.633 12.347 1.646 1.00 0.71 N ATOM 2366 CA GLU A 143 3.575 11.618 2.418 1.00 0.70 C ATOM 2367 C GLU A 143 4.093 10.236 2.824 1.00 0.64 C ATOM 2368 O GLU A 143 3.667 9.671 3.812 1.00 1.00 O ATOM 2369 CB GLU A 143 2.329 11.461 1.542 1.00 0.76 C ATOM 2370 CG GLU A 143 1.595 12.802 1.453 1.00 1.36 C ATOM 2371 CD GLU A 143 0.862 13.074 2.769 1.00 1.63 C ATOM 2372 OE1 GLU A 143 1.483 13.613 3.670 1.00 1.97 O ATOM 2373 OE2 GLU A 143 -0.308 12.738 2.852 1.00 2.43 O ATOM 0 H GLU A 143 5.063 11.809 0.894 1.00 0.71 H new ATOM 0 HA GLU A 143 3.324 12.184 3.315 1.00 0.70 H new ATOM 0 HB2 GLU A 143 2.612 11.123 0.545 1.00 0.76 H new ATOM 0 HB3 GLU A 143 1.670 10.701 1.961 1.00 0.76 H new ATOM 0 HG2 GLU A 143 2.305 13.604 1.248 1.00 1.36 H new ATOM 0 HG3 GLU A 143 0.885 12.785 0.626 1.00 1.36 H new ATOM 2380 N LEU A 144 5.009 9.684 2.074 1.00 0.70 N ATOM 2381 CA LEU A 144 5.550 8.338 2.427 1.00 0.61 C ATOM 2382 C LEU A 144 6.649 8.499 3.489 1.00 0.61 C ATOM 2383 O LEU A 144 7.331 9.504 3.520 1.00 0.67 O ATOM 2384 CB LEU A 144 6.152 7.690 1.176 1.00 0.57 C ATOM 2385 CG LEU A 144 5.072 7.517 0.097 1.00 0.59 C ATOM 2386 CD1 LEU A 144 5.742 7.260 -1.254 1.00 0.58 C ATOM 2387 CD2 LEU A 144 4.162 6.327 0.439 1.00 0.64 C ATOM 0 H LEU A 144 5.406 10.105 1.234 1.00 0.70 H new ATOM 0 HA LEU A 144 4.748 7.711 2.816 1.00 0.61 H new ATOM 0 HB2 LEU A 144 6.964 8.308 0.792 1.00 0.57 H new ATOM 0 HB3 LEU A 144 6.581 6.721 1.430 1.00 0.57 H new ATOM 0 HG LEU A 144 4.471 8.425 0.051 1.00 0.59 H new ATOM 0 HD11 LEU A 144 4.978 7.137 -2.022 1.00 0.58 H new ATOM 0 HD12 LEU A 144 6.381 8.105 -1.510 1.00 0.58 H new ATOM 0 HD13 LEU A 144 6.346 6.354 -1.194 1.00 0.58 H new ATOM 0 HD21 LEU A 144 3.402 6.216 -0.334 1.00 0.64 H new ATOM 0 HD22 LEU A 144 4.759 5.417 0.494 1.00 0.64 H new ATOM 0 HD23 LEU A 144 3.679 6.503 1.400 1.00 0.64 H new ATOM 2399 N PRO A 145 6.833 7.522 4.350 1.00 0.59 N ATOM 2400 CA PRO A 145 7.878 7.578 5.410 1.00 0.63 C ATOM 2401 C PRO A 145 9.160 8.275 4.937 1.00 0.66 C ATOM 2402 O PRO A 145 9.799 7.848 3.995 1.00 0.98 O ATOM 2403 CB PRO A 145 8.136 6.102 5.707 1.00 0.61 C ATOM 2404 CG PRO A 145 6.808 5.439 5.503 1.00 0.62 C ATOM 2405 CD PRO A 145 6.074 6.255 4.422 1.00 0.59 C ATOM 0 HA PRO A 145 7.559 8.156 6.278 1.00 0.63 H new ATOM 0 HB2 PRO A 145 8.892 5.689 5.039 1.00 0.61 H new ATOM 0 HB3 PRO A 145 8.498 5.960 6.725 1.00 0.61 H new ATOM 0 HG2 PRO A 145 6.936 4.403 5.188 1.00 0.62 H new ATOM 0 HG3 PRO A 145 6.236 5.421 6.431 1.00 0.62 H new ATOM 0 HD2 PRO A 145 6.072 5.736 3.463 1.00 0.59 H new ATOM 0 HD3 PRO A 145 5.032 6.429 4.692 1.00 0.59 H new ATOM 2413 N ALA A 146 9.538 9.344 5.585 1.00 0.81 N ATOM 2414 CA ALA A 146 10.777 10.073 5.179 1.00 0.87 C ATOM 2415 C ALA A 146 11.983 9.478 5.907 1.00 0.84 C ATOM 2416 O ALA A 146 13.098 9.530 5.428 1.00 0.90 O ATOM 2417 CB ALA A 146 10.639 11.549 5.553 1.00 0.97 C ATOM 0 H ALA A 146 9.042 9.746 6.380 1.00 0.81 H new ATOM 0 HA ALA A 146 10.919 9.977 4.103 1.00 0.87 H new ATOM 0 HB1 ALA A 146 11.541 12.085 5.258 1.00 0.97 H new ATOM 0 HB2 ALA A 146 9.779 11.976 5.038 1.00 0.97 H new ATOM 0 HB3 ALA A 146 10.498 11.640 6.630 1.00 0.97 H new ATOM 2423 N GLU A 147 11.769 8.917 7.065 1.00 0.82 N ATOM 2424 CA GLU A 147 12.901 8.322 7.829 1.00 0.88 C ATOM 2425 C GLU A 147 13.382 7.048 7.124 1.00 0.95 C ATOM 2426 O GLU A 147 14.128 6.267 7.682 1.00 1.63 O ATOM 2427 CB GLU A 147 12.430 7.987 9.250 1.00 0.96 C ATOM 2428 CG GLU A 147 10.984 7.484 9.204 1.00 0.91 C ATOM 2429 CD GLU A 147 10.642 6.783 10.520 1.00 1.59 C ATOM 2430 OE1 GLU A 147 10.240 7.467 11.447 1.00 1.88 O ATOM 2431 OE2 GLU A 147 10.788 5.573 10.579 1.00 2.27 O ATOM 0 H GLU A 147 10.857 8.845 7.516 1.00 0.82 H new ATOM 0 HA GLU A 147 13.725 9.033 7.880 1.00 0.88 H new ATOM 0 HB2 GLU A 147 13.077 7.227 9.689 1.00 0.96 H new ATOM 0 HB3 GLU A 147 12.499 8.870 9.885 1.00 0.96 H new ATOM 0 HG2 GLU A 147 10.303 8.319 9.037 1.00 0.91 H new ATOM 0 HG3 GLU A 147 10.854 6.795 8.369 1.00 0.91 H new ATOM 2438 N ILE A 148 12.963 6.838 5.900 1.00 0.77 N ATOM 2439 CA ILE A 148 13.390 5.620 5.140 1.00 0.73 C ATOM 2440 C ILE A 148 14.339 6.034 4.015 1.00 0.73 C ATOM 2441 O ILE A 148 14.307 7.152 3.540 1.00 0.71 O ATOM 2442 CB ILE A 148 12.155 4.941 4.532 1.00 0.68 C ATOM 2443 CG1 ILE A 148 11.215 4.444 5.648 1.00 0.75 C ATOM 2444 CG2 ILE A 148 12.591 3.764 3.656 1.00 0.72 C ATOM 2445 CD1 ILE A 148 11.945 3.494 6.612 1.00 0.71 C ATOM 0 H ILE A 148 12.338 7.463 5.390 1.00 0.77 H new ATOM 0 HA ILE A 148 13.896 4.928 5.813 1.00 0.73 H new ATOM 0 HB ILE A 148 11.619 5.666 3.920 1.00 0.68 H new ATOM 0 HG12 ILE A 148 10.822 5.297 6.202 1.00 0.75 H new ATOM 0 HG13 ILE A 148 10.361 3.931 5.205 1.00 0.75 H new ATOM 0 HG21 ILE A 148 11.711 3.285 3.226 1.00 0.72 H new ATOM 0 HG22 ILE A 148 13.235 4.126 2.854 1.00 0.72 H new ATOM 0 HG23 ILE A 148 13.138 3.042 4.263 1.00 0.72 H new ATOM 0 HD11 ILE A 148 11.255 3.161 7.387 1.00 0.71 H new ATOM 0 HD12 ILE A 148 12.315 2.630 6.060 1.00 0.71 H new ATOM 0 HD13 ILE A 148 12.783 4.017 7.073 1.00 0.71 H new ATOM 2457 N ASN A 149 15.186 5.136 3.584 1.00 0.80 N ATOM 2458 CA ASN A 149 16.146 5.461 2.488 1.00 0.86 C ATOM 2459 C ASN A 149 16.393 4.195 1.656 1.00 0.93 C ATOM 2460 O ASN A 149 16.972 3.236 2.124 1.00 1.94 O ATOM 2461 CB ASN A 149 17.459 5.954 3.100 1.00 0.92 C ATOM 2462 CG ASN A 149 18.302 6.638 2.021 1.00 0.99 C ATOM 2463 OD1 ASN A 149 18.171 6.338 0.851 1.00 1.61 O ATOM 2464 ND2 ASN A 149 19.167 7.550 2.368 1.00 1.35 N ATOM 0 H ASN A 149 15.254 4.185 3.947 1.00 0.80 H new ATOM 0 HA ASN A 149 15.738 6.242 1.846 1.00 0.86 H new ATOM 0 HB2 ASN A 149 17.254 6.651 3.912 1.00 0.92 H new ATOM 0 HB3 ASN A 149 18.009 5.117 3.529 1.00 0.92 H new ATOM 0 HD21 ASN A 149 19.734 8.012 1.657 1.00 1.35 H new ATOM 0 HD22 ASN A 149 19.277 7.801 3.350 1.00 1.35 H new ATOM 2471 N GLU A 150 15.916 4.174 0.440 1.00 0.54 N ATOM 2472 CA GLU A 150 16.074 2.960 -0.418 1.00 0.54 C ATOM 2473 C GLU A 150 17.467 2.895 -1.064 1.00 0.53 C ATOM 2474 O GLU A 150 17.886 1.855 -1.529 1.00 0.58 O ATOM 2475 CB GLU A 150 15.007 3.003 -1.520 1.00 0.71 C ATOM 2476 CG GLU A 150 14.825 1.612 -2.135 1.00 1.65 C ATOM 2477 CD GLU A 150 14.029 0.725 -1.176 1.00 2.50 C ATOM 2478 OE1 GLU A 150 13.130 1.241 -0.533 1.00 3.06 O ATOM 2479 OE2 GLU A 150 14.332 -0.454 -1.101 1.00 3.06 O ATOM 0 H GLU A 150 15.421 4.950 0.000 1.00 0.54 H new ATOM 0 HA GLU A 150 15.957 2.075 0.208 1.00 0.54 H new ATOM 0 HB2 GLU A 150 14.061 3.352 -1.107 1.00 0.71 H new ATOM 0 HB3 GLU A 150 15.300 3.714 -2.292 1.00 0.71 H new ATOM 0 HG2 GLU A 150 14.305 1.691 -3.089 1.00 1.65 H new ATOM 0 HG3 GLU A 150 15.797 1.163 -2.338 1.00 1.65 H new ATOM 2486 N ALA A 151 18.189 3.979 -1.103 1.00 0.53 N ATOM 2487 CA ALA A 151 19.541 3.934 -1.742 1.00 0.58 C ATOM 2488 C ALA A 151 20.334 2.731 -1.213 1.00 0.57 C ATOM 2489 O ALA A 151 20.620 1.802 -1.935 1.00 0.58 O ATOM 2490 CB ALA A 151 20.306 5.215 -1.449 1.00 0.62 C ATOM 0 H ALA A 151 17.910 4.885 -0.727 1.00 0.53 H new ATOM 0 HA ALA A 151 19.411 3.835 -2.820 1.00 0.58 H new ATOM 0 HB1 ALA A 151 21.288 5.168 -1.920 1.00 0.62 H new ATOM 0 HB2 ALA A 151 19.754 6.067 -1.845 1.00 0.62 H new ATOM 0 HB3 ALA A 151 20.426 5.329 -0.372 1.00 0.62 H new ATOM 2496 N LEU A 152 20.688 2.738 0.043 1.00 0.59 N ATOM 2497 CA LEU A 152 21.452 1.586 0.617 1.00 0.62 C ATOM 2498 C LEU A 152 20.806 0.269 0.161 1.00 0.57 C ATOM 2499 O LEU A 152 21.452 -0.756 0.072 1.00 0.60 O ATOM 2500 CB LEU A 152 21.428 1.676 2.153 1.00 0.69 C ATOM 2501 CG LEU A 152 21.354 3.149 2.596 1.00 0.78 C ATOM 2502 CD1 LEU A 152 19.899 3.614 2.652 1.00 0.94 C ATOM 2503 CD2 LEU A 152 21.970 3.318 3.990 1.00 0.89 C ATOM 0 H LEU A 152 20.483 3.491 0.700 1.00 0.59 H new ATOM 0 HA LEU A 152 22.485 1.618 0.270 1.00 0.62 H new ATOM 0 HB2 LEU A 152 20.571 1.127 2.544 1.00 0.69 H new ATOM 0 HB3 LEU A 152 22.322 1.208 2.566 1.00 0.69 H new ATOM 0 HG LEU A 152 21.907 3.746 1.871 1.00 0.78 H new ATOM 0 HD11 LEU A 152 19.862 4.657 2.967 1.00 0.94 H new ATOM 0 HD12 LEU A 152 19.448 3.517 1.665 1.00 0.94 H new ATOM 0 HD13 LEU A 152 19.348 3.000 3.365 1.00 0.94 H new ATOM 0 HD21 LEU A 152 21.910 4.364 4.290 1.00 0.89 H new ATOM 0 HD22 LEU A 152 21.424 2.704 4.706 1.00 0.89 H new ATOM 0 HD23 LEU A 152 23.014 3.006 3.967 1.00 0.89 H new ATOM 2515 N ILE A 153 19.533 0.302 -0.140 1.00 0.54 N ATOM 2516 CA ILE A 153 18.833 -0.934 -0.606 1.00 0.54 C ATOM 2517 C ILE A 153 18.894 -0.999 -2.139 1.00 0.54 C ATOM 2518 O ILE A 153 18.712 -2.042 -2.734 1.00 0.59 O ATOM 2519 CB ILE A 153 17.369 -0.915 -0.135 1.00 0.55 C ATOM 2520 CG1 ILE A 153 17.290 -0.313 1.274 1.00 0.59 C ATOM 2521 CG2 ILE A 153 16.820 -2.346 -0.100 1.00 0.58 C ATOM 2522 CD1 ILE A 153 15.847 -0.373 1.780 1.00 0.63 C ATOM 0 H ILE A 153 18.946 1.134 -0.083 1.00 0.54 H new ATOM 0 HA ILE A 153 19.323 -1.813 -0.186 1.00 0.54 H new ATOM 0 HB ILE A 153 16.779 -0.313 -0.826 1.00 0.55 H new ATOM 0 HG12 ILE A 153 17.946 -0.860 1.951 1.00 0.59 H new ATOM 0 HG13 ILE A 153 17.638 0.720 1.259 1.00 0.59 H new ATOM 0 HG21 ILE A 153 15.783 -2.330 0.234 1.00 0.58 H new ATOM 0 HG22 ILE A 153 16.873 -2.781 -1.098 1.00 0.58 H new ATOM 0 HG23 ILE A 153 17.414 -2.947 0.589 1.00 0.58 H new ATOM 0 HD11 ILE A 153 15.794 0.055 2.781 1.00 0.63 H new ATOM 0 HD12 ILE A 153 15.202 0.194 1.108 1.00 0.63 H new ATOM 0 HD13 ILE A 153 15.515 -1.411 1.812 1.00 0.63 H new ATOM 2534 N VAL A 154 19.154 0.110 -2.782 1.00 0.54 N ATOM 2535 CA VAL A 154 19.234 0.114 -4.272 1.00 0.59 C ATOM 2536 C VAL A 154 20.454 -0.707 -4.710 1.00 0.62 C ATOM 2537 O VAL A 154 20.328 -1.757 -5.307 1.00 0.64 O ATOM 2538 CB VAL A 154 19.361 1.568 -4.781 1.00 0.61 C ATOM 2539 CG1 VAL A 154 19.858 1.582 -6.234 1.00 0.67 C ATOM 2540 CG2 VAL A 154 17.991 2.259 -4.714 1.00 0.63 C ATOM 0 H VAL A 154 19.315 1.014 -2.338 1.00 0.54 H new ATOM 0 HA VAL A 154 18.331 -0.328 -4.693 1.00 0.59 H new ATOM 0 HB VAL A 154 20.076 2.097 -4.151 1.00 0.61 H new ATOM 0 HG11 VAL A 154 19.943 2.612 -6.580 1.00 0.67 H new ATOM 0 HG12 VAL A 154 20.834 1.099 -6.289 1.00 0.67 H new ATOM 0 HG13 VAL A 154 19.151 1.044 -6.866 1.00 0.67 H new ATOM 0 HG21 VAL A 154 18.083 3.284 -5.073 1.00 0.63 H new ATOM 0 HG22 VAL A 154 17.280 1.718 -5.338 1.00 0.63 H new ATOM 0 HG23 VAL A 154 17.637 2.266 -3.683 1.00 0.63 H new ATOM 2550 N GLU A 155 21.632 -0.225 -4.426 1.00 0.65 N ATOM 2551 CA GLU A 155 22.863 -0.961 -4.834 1.00 0.72 C ATOM 2552 C GLU A 155 22.857 -2.376 -4.246 1.00 0.70 C ATOM 2553 O GLU A 155 23.673 -3.202 -4.603 1.00 0.75 O ATOM 2554 CB GLU A 155 24.094 -0.208 -4.326 1.00 0.79 C ATOM 2555 CG GLU A 155 24.175 1.159 -5.009 1.00 1.53 C ATOM 2556 CD GLU A 155 25.382 1.929 -4.469 1.00 2.04 C ATOM 2557 OE1 GLU A 155 26.471 1.716 -4.977 1.00 2.52 O ATOM 2558 OE2 GLU A 155 25.197 2.718 -3.557 1.00 2.52 O ATOM 0 H GLU A 155 21.796 0.650 -3.927 1.00 0.65 H new ATOM 0 HA GLU A 155 22.890 -1.030 -5.922 1.00 0.72 H new ATOM 0 HB2 GLU A 155 24.036 -0.083 -3.245 1.00 0.79 H new ATOM 0 HB3 GLU A 155 24.996 -0.784 -4.533 1.00 0.79 H new ATOM 0 HG2 GLU A 155 24.264 1.033 -6.088 1.00 1.53 H new ATOM 0 HG3 GLU A 155 23.260 1.723 -4.828 1.00 1.53 H new ATOM 2565 N PHE A 156 21.956 -2.667 -3.347 1.00 0.67 N ATOM 2566 CA PHE A 156 21.931 -4.035 -2.751 1.00 0.68 C ATOM 2567 C PHE A 156 21.723 -5.073 -3.855 1.00 0.70 C ATOM 2568 O PHE A 156 22.281 -6.152 -3.817 1.00 0.71 O ATOM 2569 CB PHE A 156 20.791 -4.149 -1.734 1.00 0.67 C ATOM 2570 CG PHE A 156 20.850 -5.511 -1.072 1.00 0.71 C ATOM 2571 CD1 PHE A 156 21.957 -5.861 -0.287 1.00 0.78 C ATOM 2572 CD2 PHE A 156 19.803 -6.427 -1.248 1.00 0.73 C ATOM 2573 CE1 PHE A 156 22.017 -7.120 0.320 1.00 0.84 C ATOM 2574 CE2 PHE A 156 19.863 -7.687 -0.639 1.00 0.78 C ATOM 2575 CZ PHE A 156 20.971 -8.033 0.145 1.00 0.82 C ATOM 0 H PHE A 156 21.243 -2.025 -3.002 1.00 0.67 H new ATOM 0 HA PHE A 156 22.881 -4.215 -2.248 1.00 0.68 H new ATOM 0 HB2 PHE A 156 20.876 -3.363 -0.984 1.00 0.67 H new ATOM 0 HB3 PHE A 156 19.830 -4.014 -2.230 1.00 0.67 H new ATOM 0 HD1 PHE A 156 22.765 -5.158 -0.150 1.00 0.78 H new ATOM 0 HD2 PHE A 156 18.949 -6.161 -1.854 1.00 0.73 H new ATOM 0 HE1 PHE A 156 22.871 -7.388 0.924 1.00 0.84 H new ATOM 0 HE2 PHE A 156 19.055 -8.391 -0.774 1.00 0.78 H new ATOM 0 HZ PHE A 156 21.018 -9.004 0.614 1.00 0.82 H new ATOM 2585 N TYR A 157 20.923 -4.761 -4.836 1.00 0.72 N ATOM 2586 CA TYR A 157 20.680 -5.732 -5.934 1.00 0.77 C ATOM 2587 C TYR A 157 21.858 -5.704 -6.910 1.00 0.81 C ATOM 2588 O TYR A 157 22.048 -6.611 -7.695 1.00 0.88 O ATOM 2589 CB TYR A 157 19.395 -5.343 -6.669 1.00 0.84 C ATOM 2590 CG TYR A 157 18.196 -5.720 -5.829 1.00 0.91 C ATOM 2591 CD1 TYR A 157 17.755 -7.048 -5.797 1.00 0.99 C ATOM 2592 CD2 TYR A 157 17.527 -4.742 -5.083 1.00 1.02 C ATOM 2593 CE1 TYR A 157 16.644 -7.398 -5.019 1.00 1.13 C ATOM 2594 CE2 TYR A 157 16.417 -5.092 -4.305 1.00 1.16 C ATOM 2595 CZ TYR A 157 15.975 -6.420 -4.274 1.00 1.21 C ATOM 2596 OH TYR A 157 14.881 -6.765 -3.507 1.00 1.40 O ATOM 0 H TYR A 157 20.427 -3.874 -4.923 1.00 0.72 H new ATOM 0 HA TYR A 157 20.578 -6.736 -5.523 1.00 0.77 H new ATOM 0 HB2 TYR A 157 19.389 -4.272 -6.869 1.00 0.84 H new ATOM 0 HB3 TYR A 157 19.349 -5.848 -7.634 1.00 0.84 H new ATOM 0 HD1 TYR A 157 18.271 -7.803 -6.372 1.00 0.99 H new ATOM 0 HD2 TYR A 157 17.867 -3.717 -5.108 1.00 1.02 H new ATOM 0 HE1 TYR A 157 16.304 -8.423 -4.994 1.00 1.13 H new ATOM 0 HE2 TYR A 157 15.902 -4.338 -3.729 1.00 1.16 H new ATOM 0 HH TYR A 157 14.535 -5.968 -3.053 1.00 1.40 H new ATOM 2606 N SER A 158 22.652 -4.668 -6.868 1.00 0.91 N ATOM 2607 CA SER A 158 23.816 -4.584 -7.794 1.00 1.00 C ATOM 2608 C SER A 158 24.949 -5.470 -7.272 1.00 1.13 C ATOM 2609 O SER A 158 25.907 -5.743 -7.968 1.00 1.67 O ATOM 2610 CB SER A 158 24.298 -3.135 -7.876 1.00 1.33 C ATOM 2611 OG SER A 158 25.352 -3.043 -8.825 1.00 1.68 O ATOM 0 H SER A 158 22.544 -3.877 -6.233 1.00 0.91 H new ATOM 0 HA SER A 158 23.517 -4.924 -8.785 1.00 1.00 H new ATOM 0 HB2 SER A 158 23.475 -2.482 -8.165 1.00 1.33 H new ATOM 0 HB3 SER A 158 24.643 -2.799 -6.898 1.00 1.33 H new ATOM 0 HG SER A 158 25.825 -3.900 -8.873 1.00 1.68 H new ATOM 2617 N ARG A 159 24.848 -5.920 -6.052 1.00 1.05 N ATOM 2618 CA ARG A 159 25.920 -6.788 -5.487 1.00 1.28 C ATOM 2619 C ARG A 159 25.845 -8.175 -6.128 1.00 2.04 C ATOM 2620 O ARG A 159 26.892 -8.730 -6.416 1.00 2.72 O ATOM 2621 CB ARG A 159 25.729 -6.914 -3.974 1.00 1.22 C ATOM 2622 CG ARG A 159 25.536 -5.524 -3.366 1.00 1.47 C ATOM 2623 CD ARG A 159 25.676 -5.608 -1.846 1.00 1.72 C ATOM 2624 NE ARG A 159 25.409 -4.270 -1.247 1.00 2.73 N ATOM 2625 CZ ARG A 159 25.174 -4.162 0.032 1.00 3.47 C ATOM 2626 NH1 ARG A 159 25.172 -5.227 0.786 1.00 3.53 N ATOM 2627 NH2 ARG A 159 24.942 -2.991 0.557 1.00 4.58 N ATOM 2628 OXT ARG A 159 24.741 -8.658 -6.320 1.00 2.51 O ATOM 0 H ARG A 159 24.070 -5.725 -5.422 1.00 1.05 H new ATOM 0 HA ARG A 159 26.894 -6.345 -5.695 1.00 1.28 H new ATOM 0 HB2 ARG A 159 24.864 -7.541 -3.757 1.00 1.22 H new ATOM 0 HB3 ARG A 159 26.596 -7.401 -3.527 1.00 1.22 H new ATOM 0 HG2 ARG A 159 26.274 -4.832 -3.772 1.00 1.47 H new ATOM 0 HG3 ARG A 159 24.553 -5.133 -3.630 1.00 1.47 H new ATOM 0 HD2 ARG A 159 24.978 -6.343 -1.446 1.00 1.72 H new ATOM 0 HD3 ARG A 159 26.679 -5.943 -1.581 1.00 1.72 H new ATOM 0 HE ARG A 159 25.410 -3.438 -1.837 1.00 2.73 H new ATOM 0 HH11 ARG A 159 25.354 -6.143 0.376 1.00 3.53 H new ATOM 0 HH12 ARG A 159 24.988 -5.144 1.786 1.00 3.53 H new ATOM 0 HH21 ARG A 159 24.944 -2.158 -0.032 1.00 4.58 H new ATOM 0 HH22 ARG A 159 24.758 -2.908 1.557 1.00 4.58 H new TER 2642 ARG A 159 END