USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 947 hydrogens (8 hets) HEADER COMPLEX (PROTO-ONCOGENE/EARLY PROTEIN) 10-JUL-97 1AOT TITLE NMR STRUCTURE OF THE FYN SH2 DOMAIN COMPLEXED WITH A TITLE 2 PHOSPHOTYROSYL PEPTIDE, MINIMIZED AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: FYN PROTEIN-TYROSINE KINASE; COMPND 3 CHAIN: F; COMPND 4 FRAGMENT: SH2 DOMAIN; COMPND 5 SYNONYM: SRC HOMOLOGY 2 DOMAIN; COMPND 6 EC: 2.7.1.112; COMPND 7 ENGINEERED: YES; COMPND 8 MUTATION: YES; COMPND 9 MOL_ID: 2; COMPND 0 MOLECULE: PHOSPHOTYROSYL PEPTIDE; COMPND 1 CHAIN: P SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 CELL_LINE: BL21; SOURCE 6 GENE: LYSS; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 8 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 0 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 1 EXPRESSION_SYSTEM_PLASMID: PRK172; SOURCE 2 EXPRESSION_SYSTEM_GENE: LYSS; SOURCE 3 MOL_ID: 2; SOURCE 4 ORGANISM_SCIENTIFIC: HAMSTER POLYOMAVIRUS; SOURCE 5 ORGANISM_TAXID: 10626 KEYWDS SH2 DOMAIN, SIGNAL TRANSDUCTION, PEPTIDE COMPLEX, COMPLEX KEYWDS 2 (PROTO-ONCOGENE/EARLY PROTEIN) EXPDTA SOLUTION NMR AUTHOR T.D.MULHERN,G.L.SHAW,C.J.MORTON,A.J.DAY,I.D.CAMPBELL REVDAT 2 24-FEB-09 1AOT 1 VERSN REVDAT 1 14-JAN-98 1AOT 0 JRNL AUTH T.D.MULHERN,G.L.SHAW,C.J.MORTON,A.J.DAY, JRNL AUTH 2 I.D.CAMPBELL JRNL TITL THE SH2 DOMAIN FROM THE TYROSINE KINASE FYN IN JRNL TITL 2 COMPLEX WITH A PHOSPHOTYROSYL PEPTIDE REVEALS JRNL TITL 3 INSIGHTS INTO DOMAIN STABILITY AND BINDING JRNL TITL 4 SPECIFICITY. JRNL REF STRUCTURE V. 5 1313 1997 JRNL REFN ISSN 0969-2126 JRNL PMID 9351806 JRNL DOI 10.1016/S0969-2126(97)00283-9 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH A.PINTAR,M.HENSMANN,K.JUMEL,M.PITKEATHLY, REMARK 1 AUTH 2 S.E.HARDING,I.D.CAMPBELL REMARK 1 TITL SOLUTION STUDIES OF THE SH2 DOMAIN FROM THE FYN REMARK 1 TITL 2 TYROSINE KINASE: SECONDARY STRUCTURE, BACKBONE REMARK 1 TITL 3 DYNAMICS AND PROTEIN ASSOCIATION REMARK 1 REF EUR.BIOPHYS.J. V. 24 371 1996 REMARK 1 REFN ISSN 0175-7571 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REFINEMENT DETAILS CAN BE FOUND IN REMARK 3 THE JRNL CITATION ABOVE. REMARK 4 REMARK 4 1AOT COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 293 REMARK 210 PH : 6.0 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NOESY, DQF-COSY, TOCSY, HSQC, REMARK 210 NOESY-HSQC, TOCSY-HSQC, REMARK 210 CBCA(CO)NH, HCCH-TOCSY, XF- REMARK 210 NOESY, XF-TOCSY REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ, 750 MHZ REMARK 210 SPECTROMETER MODEL : OMEGA REMARK 210 SPECTROMETER MANUFACTURER : HOME-BUILT REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : X-PLOR REMARK 210 METHOD USED : DYNAMICAL SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 200 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : LEAST VIOLATIONS REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: NULL REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. REMARK 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 ILE F 2 -167.89 -54.56 REMARK 500 ALA F 4 26.97 44.55 REMARK 500 GLU F 5 41.13 -179.53 REMARK 500 GLU F 6 -69.08 -162.31 REMARK 500 LYS F 11 69.30 -105.44 REMARK 500 PHE F 24 110.71 57.68 REMARK 500 PRO F 27 -159.14 -78.14 REMARK 500 ARG F 34 158.71 177.58 REMARK 500 ASP F 52 44.22 -85.10 REMARK 500 MET F 53 20.41 -161.80 REMARK 500 LYS F 54 -29.63 -174.73 REMARK 500 LYS F 59 -166.62 -104.22 REMARK 500 ALA F 94 -20.16 93.19 REMARK 500 LEU F 100 -175.23 -49.02 REMARK 500 PRO F 103 -159.92 -78.03 REMARK 500 PRO P 208 -169.97 -78.20 REMARK 500 ILE P 209 31.16 -175.48 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG F 19 0.09 SIDE_CHAIN REMARK 500 ARG F 28 0.22 SIDE_CHAIN REMARK 500 ARG F 34 0.14 SIDE_CHAIN REMARK 500 ARG F 48 0.13 SIDE_CHAIN REMARK 500 ARG F 76 0.31 SIDE_CHAIN REMARK 500 ARG F 92 0.29 SIDE_CHAIN REMARK 500 ARG F 99 0.20 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: PTR REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: PHOSPHOTYROSINE BINDING SITE. REMARK 800 SITE_IDENTIFIER: 3IB REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: +3 ILE BINDING SITE. REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1AOU RELATED DB: PDB DBREF 1AOT F 1 106 UNP P06241 FYN_HUMAN 142 247 DBREF 1AOT P 201 211 UNP P03079 TAMI_POVHA 321 331 SEQADV 1AOT SER F 97 UNP P06241 CYS 238 ENGINEERED SEQADV 1AOT SER F 98 UNP P06241 CYS 239 ENGINEERED SEQADV 1AOT SER F 104 UNP P06241 CYS 245 ENGINEERED SEQRES 1 F 106 SER ILE GLN ALA GLU GLU TRP TYR PHE GLY LYS LEU GLY SEQRES 2 F 106 ARG LYS ASP ALA GLU ARG GLN LEU LEU SER PHE GLY ASN SEQRES 3 F 106 PRO ARG GLY THR PHE LEU ILE ARG GLU SER GLU THR THR SEQRES 4 F 106 LYS GLY ALA TYR SER LEU SER ILE ARG ASP TRP ASP ASP SEQRES 5 F 106 MET LYS GLY ASP HIS VAL LYS HIS TYR LYS ILE ARG LYS SEQRES 6 F 106 LEU ASP ASN GLY GLY TYR TYR ILE THR THR ARG ALA GLN SEQRES 7 F 106 PHE GLU THR LEU GLN GLN LEU VAL GLN HIS TYR SER GLU SEQRES 8 F 106 ARG ALA ALA GLY LEU SER SER ARG LEU VAL VAL PRO SER SEQRES 9 F 106 HIS LYS SEQRES 1 P 11 GLU PRO GLN PTR GLU GLU ILE PRO ILE TYR LEU MODRES 1AOT PTR P 204 TYR O-PHOSPHOTYROSINE HET PTR P 204 24 HETNAM PTR O-PHOSPHOTYROSINE HETSYN PTR PHOSPHONOTYROSINE FORMUL 2 PTR C9 H12 N O6 P HELIX 1 1 ARG F 14 LEU F 22 1 9 HELIX 2 2 LEU F 82 TYR F 89 1 8 SHEET 1 A 2 SER F 46 ARG F 48 0 SHEET 2 A 2 VAL F 58 HIS F 60 -1 N LYS F 59 O ILE F 47 SHEET 1 B 2 ARG F 64 LEU F 66 0 SHEET 2 B 2 GLY F 70 TYR F 72 -1 N TYR F 72 O ARG F 64 LINK N PTR P 204 C GLN P 203 1555 1555 1.31 LINK C PTR P 204 N GLU P 205 1555 1555 1.31 SITE *** PTR 7 ARG F 34 SER F 36 THR F 38 SER F 44 SITE *** PTR 7 HIS F 60 TYR F 61 LYS F 62 SITE *** 3IB 5 TYR F 61 ILE F 73 THR F 74 GLY F 95 SITE *** 3IB 5 LEU F 96 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 NoAdj-H: P 204 PTR HN2 : P 204 PTR N : P 203 GLN C :(H bumps) USER MOD Set 1.1: F 84 GLN : amide:sc= -2.03! C(o=-2.1!,f=-0.87!) USER MOD Set 1.2: F 87 GLN : amide:sc= -0.0258 K(o=-2.1,f=-1.4) USER MOD Set 2.1: F 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: F 57 HIS : no HD1:sc= -9.34! C(o=-9.3!,f=-7.2!) USER MOD Single : F 1 SER N :NH3+ 143:sc= 0.183 (180deg=0.0089) USER MOD Single : F 1 SER OG : rot 180:sc= 0.0844 USER MOD Single : F 3 GLN : amide:sc= -1.61 K(o=-1.6,f=-6!) USER MOD Single : F 8 TYR OH : rot 175:sc= -0.692 USER MOD Single : F 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 20 GLN : amide:sc= -0.418 K(o=-0.42,f=-3.2!) USER MOD Single : F 23 SER OG : rot 180:sc= 0 USER MOD Single : F 26 ASN : amide:sc= -2.37! C(o=-2.4!,f=-4.8!) USER MOD Single : F 30 THR OG1 : rot 102:sc= -0.909 USER MOD Single : F 36 SER OG : rot 103:sc= -0.256 USER MOD Single : F 38 THR OG1 : rot 180:sc= 0 USER MOD Single : F 39 THR OG1 : rot 180:sc= 0.0423 USER MOD Single : F 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 43 TYR OH : rot -73:sc= 0.466 USER MOD Single : F 44 SER OG : rot 100:sc= -3.16! USER MOD Single : F 46 SER OG : rot -33:sc= -6.48! USER MOD Single : F 53 MET CE :methyl 167:sc= -21.8! (180deg=-23.7!) USER MOD Single : F 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 60 HIS : no HD1:sc= -7.27! C(o=-7.3!,f=-10!) USER MOD Single : F 61 TYR OH : rot 180:sc= 0.214 USER MOD Single : F 62 LYS NZ :NH3+ 160:sc= -0.375 (180deg=-0.627) USER MOD Single : F 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : F 71 TYR OH : rot -77:sc= 0.233 USER MOD Single : F 72 TYR OH : rot 180:sc= 0 USER MOD Single : F 74 THR OG1 : rot 180:sc= 0.485 USER MOD Single : F 75 THR OG1 : rot 180:sc= 0 USER MOD Single : F 78 GLN : amide:sc= -2.95 K(o=-3,f=-0.38) USER MOD Single : F 81 THR OG1 : rot 101:sc= -0.382! USER MOD Single : F 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : F 88 HIS : no HD1:sc= -0.639 X(o=-0.64,f=-0.45) USER MOD Single : F 89 TYR OH : rot 180:sc= 0 USER MOD Single : F 90 SER OG : rot 180:sc= 0 USER MOD Single : F 97 SER OG : rot 180:sc= 0 USER MOD Single : F 98 SER OG : rot 180:sc= 0 USER MOD Single : F 104 SER OG : rot 180:sc= 0 USER MOD Single : F 105 HIS : no HD1:sc= -3.88! K(o=-3.9!,f=-1.4) USER MOD Single : F 106 LYS NZ :NH3+ -159:sc= -0.127 (180deg=-0.825) USER MOD Single : P 203 GLN : amide:sc= -0.227 K(o=-0.23,f=-0.95) USER MOD Single : P 210 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER F 1 -36.268 22.332 30.244 1.00 2.97 N ATOM 2 CA SER F 1 -35.151 21.545 29.650 1.00 2.56 C ATOM 3 C SER F 1 -35.486 20.054 29.718 1.00 1.88 C ATOM 4 O SER F 1 -34.856 19.298 30.431 1.00 1.84 O ATOM 5 CB SER F 1 -33.864 21.814 30.432 1.00 3.07 C ATOM 6 OG SER F 1 -33.764 23.202 30.715 1.00 3.60 O ATOM 0 H1 SER F 1 -35.881 23.145 30.765 1.00 2.97 H new ATOM 0 H2 SER F 1 -36.894 22.672 29.487 1.00 2.97 H new ATOM 0 H3 SER F 1 -36.809 21.729 30.896 1.00 2.97 H new ATOM 0 HA SER F 1 -35.012 21.840 28.610 1.00 2.56 H new ATOM 0 HB2 SER F 1 -33.863 21.242 31.360 1.00 3.07 H new ATOM 0 HB3 SER F 1 -33.000 21.486 29.854 1.00 3.07 H new ATOM 0 HG SER F 1 -32.941 23.375 31.217 1.00 3.60 H new ATOM 14 N ILE F 2 -36.477 19.624 28.984 1.00 1.50 N ATOM 15 CA ILE F 2 -36.852 18.182 29.010 1.00 1.02 C ATOM 16 C ILE F 2 -35.623 17.325 28.686 1.00 0.85 C ATOM 17 O ILE F 2 -34.507 17.804 28.677 1.00 1.06 O ATOM 18 CB ILE F 2 -37.955 17.915 27.980 1.00 0.84 C ATOM 19 CG1 ILE F 2 -37.569 18.530 26.631 1.00 0.90 C ATOM 20 CG2 ILE F 2 -39.265 18.539 28.465 1.00 1.32 C ATOM 21 CD1 ILE F 2 -38.708 18.318 25.627 1.00 0.90 C ATOM 0 H ILE F 2 -37.042 20.209 28.368 1.00 1.50 H new ATOM 0 HA ILE F 2 -37.220 17.924 30.003 1.00 1.02 H new ATOM 0 HB ILE F 2 -38.081 16.839 27.861 1.00 0.84 H new ATOM 0 HG12 ILE F 2 -37.368 19.595 26.749 1.00 0.90 H new ATOM 0 HG13 ILE F 2 -36.653 18.072 26.259 1.00 0.90 H new ATOM 0 HG21 ILE F 2 -40.051 18.350 27.734 1.00 1.32 H new ATOM 0 HG22 ILE F 2 -39.546 18.098 29.421 1.00 1.32 H new ATOM 0 HG23 ILE F 2 -39.133 19.614 28.586 1.00 1.32 H new ATOM 0 HD11 ILE F 2 -38.433 18.756 24.667 1.00 0.90 H new ATOM 0 HD12 ILE F 2 -38.888 17.250 25.501 1.00 0.90 H new ATOM 0 HD13 ILE F 2 -39.614 18.797 25.998 1.00 0.90 H new ATOM 33 N GLN F 3 -35.819 16.059 28.428 1.00 0.95 N ATOM 34 CA GLN F 3 -34.661 15.170 28.114 1.00 0.95 C ATOM 35 C GLN F 3 -33.700 15.889 27.168 1.00 1.07 C ATOM 36 O GLN F 3 -32.496 15.765 27.275 1.00 1.69 O ATOM 37 CB GLN F 3 -35.166 13.889 27.449 1.00 1.11 C ATOM 38 CG GLN F 3 -34.836 12.687 28.336 1.00 1.40 C ATOM 39 CD GLN F 3 -35.249 12.986 29.778 1.00 1.70 C ATOM 40 OE1 GLN F 3 -36.072 13.847 30.021 1.00 2.32 O ATOM 41 NE2 GLN F 3 -34.709 12.307 30.753 1.00 2.24 N ATOM 0 H GLN F 3 -36.731 15.602 28.421 1.00 0.95 H new ATOM 0 HA GLN F 3 -34.139 14.920 29.038 1.00 0.95 H new ATOM 0 HB2 GLN F 3 -36.242 13.951 27.288 1.00 1.11 H new ATOM 0 HB3 GLN F 3 -34.704 13.769 26.469 1.00 1.11 H new ATOM 0 HG2 GLN F 3 -35.357 11.801 27.974 1.00 1.40 H new ATOM 0 HG3 GLN F 3 -33.769 12.470 28.290 1.00 1.40 H new ATOM 0 HE21 GLN F 3 -34.018 11.584 30.550 1.00 2.24 H new ATOM 0 HE22 GLN F 3 -34.978 12.499 31.718 1.00 2.24 H new ATOM 50 N ALA F 4 -34.224 16.645 26.248 1.00 1.22 N ATOM 51 CA ALA F 4 -33.347 17.381 25.296 1.00 1.51 C ATOM 52 C ALA F 4 -32.237 16.461 24.787 1.00 1.15 C ATOM 53 O ALA F 4 -31.171 16.910 24.417 1.00 1.37 O ATOM 54 CB ALA F 4 -32.721 18.571 26.016 1.00 2.26 C ATOM 0 H ALA F 4 -35.225 16.786 26.113 1.00 1.22 H new ATOM 0 HA ALA F 4 -33.942 17.724 24.450 1.00 1.51 H new ATOM 0 HB1 ALA F 4 -32.077 19.116 25.326 1.00 2.26 H new ATOM 0 HB2 ALA F 4 -33.508 19.233 26.377 1.00 2.26 H new ATOM 0 HB3 ALA F 4 -32.130 18.216 26.860 1.00 2.26 H new ATOM 60 N GLU F 5 -32.471 15.178 24.761 1.00 1.18 N ATOM 61 CA GLU F 5 -31.411 14.251 24.270 1.00 1.40 C ATOM 62 C GLU F 5 -31.900 12.799 24.314 1.00 1.39 C ATOM 63 O GLU F 5 -31.165 11.904 24.680 1.00 2.16 O ATOM 64 CB GLU F 5 -30.168 14.392 25.152 1.00 1.95 C ATOM 65 CG GLU F 5 -30.467 13.834 26.545 1.00 2.20 C ATOM 66 CD GLU F 5 -29.712 14.652 27.594 1.00 2.65 C ATOM 67 OE1 GLU F 5 -28.548 14.363 27.818 1.00 3.01 O ATOM 68 OE2 GLU F 5 -30.311 15.554 28.157 1.00 3.07 O ATOM 0 H GLU F 5 -33.341 14.734 25.055 1.00 1.18 H new ATOM 0 HA GLU F 5 -31.171 14.509 23.239 1.00 1.40 H new ATOM 0 HB2 GLU F 5 -29.330 13.857 24.706 1.00 1.95 H new ATOM 0 HB3 GLU F 5 -29.876 15.440 25.223 1.00 1.95 H new ATOM 0 HG2 GLU F 5 -31.539 13.871 26.741 1.00 2.20 H new ATOM 0 HG3 GLU F 5 -30.169 12.787 26.601 1.00 2.20 H new ATOM 75 N GLU F 6 -33.126 12.550 23.941 1.00 0.87 N ATOM 76 CA GLU F 6 -33.633 11.149 23.962 1.00 1.01 C ATOM 77 C GLU F 6 -34.887 11.044 23.096 1.00 0.99 C ATOM 78 O GLU F 6 -34.886 10.431 22.049 1.00 1.54 O ATOM 79 CB GLU F 6 -33.973 10.752 25.400 1.00 1.24 C ATOM 80 CG GLU F 6 -32.683 10.446 26.163 1.00 1.37 C ATOM 81 CD GLU F 6 -33.014 9.647 27.425 1.00 1.96 C ATOM 82 OE1 GLU F 6 -34.059 9.017 27.446 1.00 2.43 O ATOM 83 OE2 GLU F 6 -32.218 9.680 28.349 1.00 2.47 O ATOM 0 H GLU F 6 -33.795 13.252 23.624 1.00 0.87 H new ATOM 0 HA GLU F 6 -32.866 10.481 23.570 1.00 1.01 H new ATOM 0 HB2 GLU F 6 -34.517 11.558 25.892 1.00 1.24 H new ATOM 0 HB3 GLU F 6 -34.626 9.879 25.403 1.00 1.24 H new ATOM 0 HG2 GLU F 6 -31.999 9.880 25.530 1.00 1.37 H new ATOM 0 HG3 GLU F 6 -32.177 11.374 26.429 1.00 1.37 H new ATOM 90 N TRP F 7 -35.955 11.641 23.532 1.00 0.48 N ATOM 91 CA TRP F 7 -37.224 11.589 22.756 1.00 0.50 C ATOM 92 C TRP F 7 -37.563 12.989 22.247 1.00 0.43 C ATOM 93 O TRP F 7 -38.576 13.198 21.615 1.00 0.45 O ATOM 94 CB TRP F 7 -38.343 11.113 23.676 1.00 0.55 C ATOM 95 CG TRP F 7 -38.237 11.849 24.970 1.00 0.51 C ATOM 96 CD1 TRP F 7 -37.595 11.398 26.071 1.00 0.59 C ATOM 97 CD2 TRP F 7 -38.761 13.163 25.310 1.00 0.46 C ATOM 98 NE1 TRP F 7 -37.706 12.346 27.072 1.00 0.60 N ATOM 99 CE2 TRP F 7 -38.415 13.454 26.650 1.00 0.53 C ATOM 100 CE3 TRP F 7 -39.501 14.120 24.593 1.00 0.43 C ATOM 101 CZ2 TRP F 7 -38.790 14.652 27.259 1.00 0.55 C ATOM 102 CZ3 TRP F 7 -39.879 15.328 25.201 1.00 0.44 C ATOM 103 CH2 TRP F 7 -39.524 15.593 26.532 1.00 0.50 C ATOM 0 H TRP F 7 -36.006 12.170 24.403 1.00 0.48 H new ATOM 0 HA TRP F 7 -37.114 10.908 21.912 1.00 0.50 H new ATOM 0 HB2 TRP F 7 -39.314 11.294 23.216 1.00 0.55 H new ATOM 0 HB3 TRP F 7 -38.265 10.039 23.844 1.00 0.55 H new ATOM 0 HD1 TRP F 7 -37.080 10.452 26.155 1.00 0.59 H new ATOM 0 HE1 TRP F 7 -37.313 12.240 28.007 1.00 0.60 H new ATOM 0 HE3 TRP F 7 -39.780 13.925 23.568 1.00 0.43 H new ATOM 0 HZ2 TRP F 7 -38.515 14.851 28.284 1.00 0.55 H new ATOM 0 HZ3 TRP F 7 -40.446 16.057 24.641 1.00 0.44 H new ATOM 0 HH2 TRP F 7 -39.818 16.524 26.995 1.00 0.50 H new ATOM 114 N TYR F 8 -36.730 13.952 22.536 1.00 0.42 N ATOM 115 CA TYR F 8 -36.998 15.340 22.088 1.00 0.37 C ATOM 116 C TYR F 8 -35.664 16.035 21.795 1.00 0.37 C ATOM 117 O TYR F 8 -34.753 16.027 22.599 1.00 0.49 O ATOM 118 CB TYR F 8 -37.785 16.060 23.192 1.00 0.37 C ATOM 119 CG TYR F 8 -37.431 17.527 23.248 1.00 0.41 C ATOM 120 CD1 TYR F 8 -36.301 17.935 23.962 1.00 1.23 C ATOM 121 CD2 TYR F 8 -38.227 18.472 22.594 1.00 1.10 C ATOM 122 CE1 TYR F 8 -35.962 19.289 24.023 1.00 1.27 C ATOM 123 CE2 TYR F 8 -37.888 19.827 22.653 1.00 1.16 C ATOM 124 CZ TYR F 8 -36.754 20.236 23.367 1.00 0.63 C ATOM 125 OH TYR F 8 -36.422 21.574 23.426 1.00 0.77 O ATOM 0 H TYR F 8 -35.869 13.831 23.068 1.00 0.42 H new ATOM 0 HA TYR F 8 -37.591 15.355 21.174 1.00 0.37 H new ATOM 0 HB2 TYR F 8 -38.854 15.948 23.012 1.00 0.37 H new ATOM 0 HB3 TYR F 8 -37.573 15.595 24.155 1.00 0.37 H new ATOM 0 HD1 TYR F 8 -35.689 17.203 24.467 1.00 1.23 H new ATOM 0 HD2 TYR F 8 -39.102 18.156 22.045 1.00 1.10 H new ATOM 0 HE1 TYR F 8 -35.089 19.604 24.576 1.00 1.27 H new ATOM 0 HE2 TYR F 8 -38.501 20.559 22.148 1.00 1.16 H new ATOM 0 HH TYR F 8 -37.028 22.087 22.851 1.00 0.77 H new ATOM 135 N PHE F 9 -35.544 16.613 20.632 1.00 0.39 N ATOM 136 CA PHE F 9 -34.274 17.288 20.249 1.00 0.41 C ATOM 137 C PHE F 9 -34.381 18.797 20.483 1.00 0.41 C ATOM 138 O PHE F 9 -33.446 19.431 20.929 1.00 0.47 O ATOM 139 CB PHE F 9 -34.005 17.015 18.767 1.00 0.42 C ATOM 140 CG PHE F 9 -33.357 15.655 18.610 1.00 0.44 C ATOM 141 CD1 PHE F 9 -33.561 14.660 19.581 1.00 0.44 C ATOM 142 CD2 PHE F 9 -32.553 15.385 17.493 1.00 0.50 C ATOM 143 CE1 PHE F 9 -32.961 13.404 19.432 1.00 0.47 C ATOM 144 CE2 PHE F 9 -31.955 14.127 17.348 1.00 0.54 C ATOM 145 CZ PHE F 9 -32.158 13.138 18.317 1.00 0.52 C ATOM 0 H PHE F 9 -36.278 16.646 19.925 1.00 0.39 H new ATOM 0 HA PHE F 9 -33.457 16.901 20.859 1.00 0.41 H new ATOM 0 HB2 PHE F 9 -34.938 17.051 18.205 1.00 0.42 H new ATOM 0 HB3 PHE F 9 -33.355 17.788 18.357 1.00 0.42 H new ATOM 0 HD1 PHE F 9 -34.180 14.864 20.442 1.00 0.44 H new ATOM 0 HD2 PHE F 9 -32.395 16.147 16.745 1.00 0.50 H new ATOM 0 HE1 PHE F 9 -33.118 12.639 20.178 1.00 0.47 H new ATOM 0 HE2 PHE F 9 -31.336 13.920 16.487 1.00 0.54 H new ATOM 0 HZ PHE F 9 -31.695 12.169 18.204 1.00 0.52 H new ATOM 155 N GLY F 10 -35.506 19.380 20.179 1.00 0.37 N ATOM 156 CA GLY F 10 -35.660 20.847 20.378 1.00 0.40 C ATOM 157 C GLY F 10 -36.604 21.404 19.318 1.00 0.37 C ATOM 158 O GLY F 10 -37.735 20.978 19.190 1.00 0.46 O ATOM 0 H GLY F 10 -36.325 18.904 19.801 1.00 0.37 H new ATOM 0 HA2 GLY F 10 -36.053 21.051 21.374 1.00 0.40 H new ATOM 0 HA3 GLY F 10 -34.689 21.338 20.311 1.00 0.40 H new ATOM 162 N LYS F 11 -36.145 22.348 18.553 1.00 0.32 N ATOM 163 CA LYS F 11 -37.005 22.932 17.494 1.00 0.31 C ATOM 164 C LYS F 11 -36.530 22.397 16.149 1.00 0.31 C ATOM 165 O LYS F 11 -35.958 23.107 15.345 1.00 0.42 O ATOM 166 CB LYS F 11 -36.892 24.455 17.530 1.00 0.46 C ATOM 167 CG LYS F 11 -36.956 24.925 18.985 1.00 0.60 C ATOM 168 CD LYS F 11 -35.778 25.858 19.272 1.00 1.07 C ATOM 169 CE LYS F 11 -35.772 26.229 20.756 1.00 1.67 C ATOM 170 NZ LYS F 11 -35.192 27.592 20.925 1.00 2.10 N ATOM 0 H LYS F 11 -35.206 22.742 18.616 1.00 0.32 H new ATOM 0 HA LYS F 11 -38.049 22.659 17.651 1.00 0.31 H new ATOM 0 HB2 LYS F 11 -35.956 24.774 17.072 1.00 0.46 H new ATOM 0 HB3 LYS F 11 -37.699 24.906 16.953 1.00 0.46 H new ATOM 0 HG2 LYS F 11 -37.897 25.443 19.170 1.00 0.60 H new ATOM 0 HG3 LYS F 11 -36.927 24.067 19.657 1.00 0.60 H new ATOM 0 HD2 LYS F 11 -34.841 25.371 19.004 1.00 1.07 H new ATOM 0 HD3 LYS F 11 -35.855 26.758 18.661 1.00 1.07 H new ATOM 0 HE2 LYS F 11 -36.787 26.202 21.153 1.00 1.67 H new ATOM 0 HE3 LYS F 11 -35.190 25.502 21.321 1.00 1.67 H new ATOM 0 HZ1 LYS F 11 -35.188 27.845 21.934 1.00 2.10 H new ATOM 0 HZ2 LYS F 11 -34.218 27.602 20.561 1.00 2.10 H new ATOM 0 HZ3 LYS F 11 -35.766 28.281 20.398 1.00 2.10 H new ATOM 184 N LEU F 12 -36.741 21.135 15.919 1.00 0.37 N ATOM 185 CA LEU F 12 -36.281 20.516 14.647 1.00 0.55 C ATOM 186 C LEU F 12 -37.465 20.292 13.705 1.00 0.57 C ATOM 187 O LEU F 12 -38.611 20.429 14.084 1.00 0.60 O ATOM 188 CB LEU F 12 -35.623 19.174 14.970 1.00 0.76 C ATOM 189 CG LEU F 12 -34.853 18.668 13.754 1.00 0.35 C ATOM 190 CD1 LEU F 12 -33.956 19.783 13.212 1.00 1.13 C ATOM 191 CD2 LEU F 12 -33.992 17.472 14.162 1.00 1.34 C ATOM 0 H LEU F 12 -37.216 20.500 16.561 1.00 0.37 H new ATOM 0 HA LEU F 12 -35.569 21.179 14.156 1.00 0.55 H new ATOM 0 HB2 LEU F 12 -34.948 19.285 15.819 1.00 0.76 H new ATOM 0 HB3 LEU F 12 -36.382 18.447 15.259 1.00 0.76 H new ATOM 0 HG LEU F 12 -35.557 18.364 12.979 1.00 0.35 H new ATOM 0 HD11 LEU F 12 -33.407 19.419 12.344 1.00 1.13 H new ATOM 0 HD12 LEU F 12 -34.570 20.635 12.922 1.00 1.13 H new ATOM 0 HD13 LEU F 12 -33.251 20.090 13.984 1.00 1.13 H new ATOM 0 HD21 LEU F 12 -33.441 17.108 13.295 1.00 1.34 H new ATOM 0 HD22 LEU F 12 -33.289 17.777 14.937 1.00 1.34 H new ATOM 0 HD23 LEU F 12 -34.632 16.677 14.545 1.00 1.34 H new ATOM 203 N GLY F 13 -37.192 19.947 12.474 1.00 0.62 N ATOM 204 CA GLY F 13 -38.294 19.711 11.502 1.00 0.67 C ATOM 205 C GLY F 13 -38.352 18.224 11.150 1.00 0.57 C ATOM 206 O GLY F 13 -37.821 17.387 11.852 1.00 0.74 O ATOM 0 H GLY F 13 -36.251 19.819 12.102 1.00 0.62 H new ATOM 0 HA2 GLY F 13 -39.244 20.032 11.928 1.00 0.67 H new ATOM 0 HA3 GLY F 13 -38.132 20.303 10.601 1.00 0.67 H new ATOM 210 N ARG F 14 -38.999 17.889 10.069 1.00 0.50 N ATOM 211 CA ARG F 14 -39.101 16.456 9.669 1.00 0.56 C ATOM 212 C ARG F 14 -37.932 16.080 8.757 1.00 0.51 C ATOM 213 O ARG F 14 -37.608 14.920 8.592 1.00 0.58 O ATOM 214 CB ARG F 14 -40.409 16.237 8.913 1.00 0.67 C ATOM 215 CG ARG F 14 -40.556 17.303 7.826 1.00 0.91 C ATOM 216 CD ARG F 14 -40.759 16.624 6.469 1.00 1.46 C ATOM 217 NE ARG F 14 -42.077 17.027 5.905 1.00 1.67 N ATOM 218 CZ ARG F 14 -42.263 17.024 4.613 1.00 2.11 C ATOM 219 NH1 ARG F 14 -41.403 16.430 3.831 1.00 2.74 N ATOM 220 NH2 ARG F 14 -43.308 17.616 4.102 1.00 2.56 N ATOM 0 H ARG F 14 -39.463 18.547 9.443 1.00 0.50 H new ATOM 0 HA ARG F 14 -39.075 15.834 10.564 1.00 0.56 H new ATOM 0 HB2 ARG F 14 -40.421 15.243 8.466 1.00 0.67 H new ATOM 0 HB3 ARG F 14 -41.252 16.287 9.602 1.00 0.67 H new ATOM 0 HG2 ARG F 14 -41.403 17.952 8.050 1.00 0.91 H new ATOM 0 HG3 ARG F 14 -39.668 17.935 7.799 1.00 0.91 H new ATOM 0 HD2 ARG F 14 -39.958 16.906 5.786 1.00 1.46 H new ATOM 0 HD3 ARG F 14 -40.716 15.541 6.582 1.00 1.46 H new ATOM 0 HE ARG F 14 -42.835 17.305 6.529 1.00 1.67 H new ATOM 0 HH11 ARG F 14 -40.586 15.968 4.230 1.00 2.74 H new ATOM 0 HH12 ARG F 14 -41.548 16.428 2.821 1.00 2.74 H new ATOM 0 HH21 ARG F 14 -43.980 18.081 4.712 1.00 2.56 H new ATOM 0 HH22 ARG F 14 -43.453 17.613 3.092 1.00 2.56 H new ATOM 234 N LYS F 15 -37.307 17.048 8.152 1.00 0.46 N ATOM 235 CA LYS F 15 -36.179 16.752 7.243 1.00 0.50 C ATOM 236 C LYS F 15 -34.924 16.478 8.060 1.00 0.41 C ATOM 237 O LYS F 15 -34.148 15.593 7.752 1.00 0.42 O ATOM 238 CB LYS F 15 -35.937 17.947 6.319 1.00 0.58 C ATOM 239 CG LYS F 15 -35.685 17.447 4.896 1.00 1.06 C ATOM 240 CD LYS F 15 -35.530 18.642 3.954 1.00 1.25 C ATOM 241 CE LYS F 15 -34.963 18.166 2.615 1.00 1.88 C ATOM 242 NZ LYS F 15 -34.768 19.337 1.714 1.00 2.43 N ATOM 0 H LYS F 15 -37.534 18.037 8.252 1.00 0.46 H new ATOM 0 HA LYS F 15 -36.420 15.874 6.643 1.00 0.50 H new ATOM 0 HB2 LYS F 15 -36.800 18.613 6.335 1.00 0.58 H new ATOM 0 HB3 LYS F 15 -35.082 18.525 6.670 1.00 0.58 H new ATOM 0 HG2 LYS F 15 -34.786 16.831 4.870 1.00 1.06 H new ATOM 0 HG3 LYS F 15 -36.513 16.818 4.569 1.00 1.06 H new ATOM 0 HD2 LYS F 15 -36.495 19.126 3.801 1.00 1.25 H new ATOM 0 HD3 LYS F 15 -34.868 19.385 4.398 1.00 1.25 H new ATOM 0 HE2 LYS F 15 -34.015 17.652 2.772 1.00 1.88 H new ATOM 0 HE3 LYS F 15 -35.642 17.448 2.155 1.00 1.88 H new ATOM 0 HZ1 LYS F 15 -34.383 19.014 0.804 1.00 2.43 H new ATOM 0 HZ2 LYS F 15 -35.681 19.809 1.556 1.00 2.43 H new ATOM 0 HZ3 LYS F 15 -34.104 20.006 2.153 1.00 2.43 H new ATOM 256 N ASP F 16 -34.715 17.227 9.103 1.00 0.37 N ATOM 257 CA ASP F 16 -33.522 17.011 9.930 1.00 0.37 C ATOM 258 C ASP F 16 -33.732 15.767 10.778 1.00 0.37 C ATOM 259 O ASP F 16 -32.807 15.056 11.103 1.00 0.51 O ATOM 260 CB ASP F 16 -33.340 18.209 10.839 1.00 0.39 C ATOM 261 CG ASP F 16 -31.860 18.371 11.192 1.00 0.57 C ATOM 262 OD1 ASP F 16 -31.181 17.362 11.291 1.00 1.13 O ATOM 263 OD2 ASP F 16 -31.431 19.501 11.358 1.00 0.78 O ATOM 0 H ASP F 16 -35.328 17.981 9.412 1.00 0.37 H new ATOM 0 HA ASP F 16 -32.642 16.884 9.300 1.00 0.37 H new ATOM 0 HB2 ASP F 16 -33.707 19.110 10.347 1.00 0.39 H new ATOM 0 HB3 ASP F 16 -33.928 18.080 11.748 1.00 0.39 H new ATOM 268 N ALA F 17 -34.954 15.515 11.146 1.00 0.34 N ATOM 269 CA ALA F 17 -35.253 14.323 11.984 1.00 0.40 C ATOM 270 C ALA F 17 -34.985 13.050 11.182 1.00 0.38 C ATOM 271 O ALA F 17 -34.435 12.092 11.686 1.00 0.43 O ATOM 272 CB ALA F 17 -36.719 14.359 12.418 1.00 0.49 C ATOM 0 H ALA F 17 -35.763 16.086 10.902 1.00 0.34 H new ATOM 0 HA ALA F 17 -34.614 14.332 12.867 1.00 0.40 H new ATOM 0 HB1 ALA F 17 -36.938 13.486 13.032 1.00 0.49 H new ATOM 0 HB2 ALA F 17 -36.905 15.265 12.995 1.00 0.49 H new ATOM 0 HB3 ALA F 17 -37.360 14.353 11.536 1.00 0.49 H new ATOM 278 N GLU F 18 -35.368 13.032 9.937 1.00 0.35 N ATOM 279 CA GLU F 18 -35.131 11.818 9.107 1.00 0.37 C ATOM 280 C GLU F 18 -33.628 11.624 8.906 1.00 0.38 C ATOM 281 O GLU F 18 -33.121 10.523 8.972 1.00 0.46 O ATOM 282 CB GLU F 18 -35.811 11.984 7.747 1.00 0.40 C ATOM 283 CG GLU F 18 -35.345 13.288 7.096 1.00 0.82 C ATOM 284 CD GLU F 18 -35.964 13.412 5.703 1.00 1.31 C ATOM 285 OE1 GLU F 18 -36.822 12.606 5.383 1.00 1.63 O ATOM 286 OE2 GLU F 18 -35.569 14.310 4.978 1.00 1.93 O ATOM 0 H GLU F 18 -35.834 13.803 9.458 1.00 0.35 H new ATOM 0 HA GLU F 18 -35.546 10.947 9.614 1.00 0.37 H new ATOM 0 HB2 GLU F 18 -35.570 11.138 7.103 1.00 0.40 H new ATOM 0 HB3 GLU F 18 -36.894 11.994 7.869 1.00 0.40 H new ATOM 0 HG2 GLU F 18 -35.636 14.139 7.712 1.00 0.82 H new ATOM 0 HG3 GLU F 18 -34.257 13.303 7.025 1.00 0.82 H new ATOM 293 N ARG F 19 -32.909 12.684 8.659 1.00 0.39 N ATOM 294 CA ARG F 19 -31.438 12.552 8.453 1.00 0.46 C ATOM 295 C ARG F 19 -30.723 12.586 9.807 1.00 0.45 C ATOM 296 O ARG F 19 -29.539 12.329 9.900 1.00 0.75 O ATOM 297 CB ARG F 19 -30.940 13.708 7.585 1.00 0.62 C ATOM 298 CG ARG F 19 -29.887 13.192 6.602 1.00 1.00 C ATOM 299 CD ARG F 19 -28.519 13.768 6.971 1.00 1.24 C ATOM 300 NE ARG F 19 -27.681 13.883 5.744 1.00 1.90 N ATOM 301 CZ ARG F 19 -28.023 14.711 4.795 1.00 2.52 C ATOM 302 NH1 ARG F 19 -28.891 15.655 5.035 1.00 3.06 N ATOM 303 NH2 ARG F 19 -27.497 14.594 3.607 1.00 3.19 N ATOM 0 H ARG F 19 -33.275 13.634 8.591 1.00 0.39 H new ATOM 0 HA ARG F 19 -31.226 11.605 7.956 1.00 0.46 H new ATOM 0 HB2 ARG F 19 -31.773 14.153 7.041 1.00 0.62 H new ATOM 0 HB3 ARG F 19 -30.514 14.491 8.213 1.00 0.62 H new ATOM 0 HG2 ARG F 19 -29.854 12.103 6.627 1.00 1.00 H new ATOM 0 HG3 ARG F 19 -30.152 13.479 5.585 1.00 1.00 H new ATOM 0 HD2 ARG F 19 -28.638 14.747 7.436 1.00 1.24 H new ATOM 0 HD3 ARG F 19 -28.027 13.126 7.701 1.00 1.24 H new ATOM 0 HE ARG F 19 -26.840 13.314 5.646 1.00 1.90 H new ATOM 0 HH11 ARG F 19 -29.302 15.746 5.964 1.00 3.06 H new ATOM 0 HH12 ARG F 19 -29.159 16.302 4.294 1.00 3.06 H new ATOM 0 HH21 ARG F 19 -26.819 13.856 3.420 1.00 3.19 H new ATOM 0 HH22 ARG F 19 -27.764 15.241 2.865 1.00 3.19 H new ATOM 317 N GLN F 20 -31.433 12.893 10.858 1.00 0.49 N ATOM 318 CA GLN F 20 -30.792 12.940 12.204 1.00 0.47 C ATOM 319 C GLN F 20 -30.818 11.542 12.817 1.00 0.42 C ATOM 320 O GLN F 20 -29.969 11.182 13.608 1.00 0.64 O ATOM 321 CB GLN F 20 -31.557 13.914 13.107 1.00 0.54 C ATOM 322 CG GLN F 20 -31.004 15.328 12.914 1.00 1.02 C ATOM 323 CD GLN F 20 -29.941 15.610 13.977 1.00 1.27 C ATOM 324 OE1 GLN F 20 -30.048 15.152 15.097 1.00 1.92 O ATOM 325 NE2 GLN F 20 -28.911 16.352 13.672 1.00 1.91 N ATOM 0 H GLN F 20 -32.429 13.113 10.844 1.00 0.49 H new ATOM 0 HA GLN F 20 -29.761 13.280 12.108 1.00 0.47 H new ATOM 0 HB2 GLN F 20 -32.620 13.891 12.867 1.00 0.54 H new ATOM 0 HB3 GLN F 20 -31.460 13.613 14.150 1.00 0.54 H new ATOM 0 HG2 GLN F 20 -30.573 15.428 11.918 1.00 1.02 H new ATOM 0 HG3 GLN F 20 -31.810 16.058 12.988 1.00 1.02 H new ATOM 0 HE21 GLN F 20 -28.820 16.737 12.732 1.00 1.91 H new ATOM 0 HE22 GLN F 20 -28.197 16.547 14.374 1.00 1.91 H new ATOM 334 N LEU F 21 -31.785 10.749 12.449 1.00 0.44 N ATOM 335 CA LEU F 21 -31.867 9.370 12.998 1.00 0.50 C ATOM 336 C LEU F 21 -31.107 8.420 12.074 1.00 0.51 C ATOM 337 O LEU F 21 -30.337 7.590 12.514 1.00 0.60 O ATOM 338 CB LEU F 21 -33.333 8.944 13.083 1.00 0.57 C ATOM 339 CG LEU F 21 -33.758 8.865 14.551 1.00 0.65 C ATOM 340 CD1 LEU F 21 -33.314 10.134 15.280 1.00 1.21 C ATOM 341 CD2 LEU F 21 -35.281 8.737 14.634 1.00 1.40 C ATOM 0 H LEU F 21 -32.523 10.998 11.790 1.00 0.44 H new ATOM 0 HA LEU F 21 -31.426 9.340 13.995 1.00 0.50 H new ATOM 0 HB2 LEU F 21 -33.961 9.657 12.549 1.00 0.57 H new ATOM 0 HB3 LEU F 21 -33.470 7.976 12.601 1.00 0.57 H new ATOM 0 HG LEU F 21 -33.293 7.996 15.017 1.00 0.65 H new ATOM 0 HD11 LEU F 21 -33.617 10.078 16.326 1.00 1.21 H new ATOM 0 HD12 LEU F 21 -32.230 10.227 15.221 1.00 1.21 H new ATOM 0 HD13 LEU F 21 -33.779 11.003 14.814 1.00 1.21 H new ATOM 0 HD21 LEU F 21 -35.585 8.681 15.679 1.00 1.40 H new ATOM 0 HD22 LEU F 21 -35.745 9.606 14.167 1.00 1.40 H new ATOM 0 HD23 LEU F 21 -35.599 7.833 14.114 1.00 1.40 H new ATOM 353 N LEU F 22 -31.318 8.540 10.794 1.00 0.48 N ATOM 354 CA LEU F 22 -30.608 7.650 9.834 1.00 0.55 C ATOM 355 C LEU F 22 -29.127 8.035 9.777 1.00 0.67 C ATOM 356 O LEU F 22 -28.260 7.185 9.727 1.00 0.81 O ATOM 357 CB LEU F 22 -31.230 7.798 8.443 1.00 0.54 C ATOM 358 CG LEU F 22 -32.742 7.573 8.528 1.00 0.49 C ATOM 359 CD1 LEU F 22 -33.306 7.360 7.122 1.00 0.99 C ATOM 360 CD2 LEU F 22 -33.031 6.338 9.385 1.00 0.78 C ATOM 0 H LEU F 22 -31.952 9.217 10.370 1.00 0.48 H new ATOM 0 HA LEU F 22 -30.700 6.615 10.164 1.00 0.55 H new ATOM 0 HB2 LEU F 22 -31.022 8.791 8.045 1.00 0.54 H new ATOM 0 HB3 LEU F 22 -30.784 7.079 7.756 1.00 0.54 H new ATOM 0 HG LEU F 22 -33.212 8.446 8.981 1.00 0.49 H new ATOM 0 HD11 LEU F 22 -34.382 7.200 7.182 1.00 0.99 H new ATOM 0 HD12 LEU F 22 -33.104 8.240 6.512 1.00 0.99 H new ATOM 0 HD13 LEU F 22 -32.834 6.488 6.669 1.00 0.99 H new ATOM 0 HD21 LEU F 22 -34.108 6.180 9.444 1.00 0.78 H new ATOM 0 HD22 LEU F 22 -32.560 5.464 8.935 1.00 0.78 H new ATOM 0 HD23 LEU F 22 -32.631 6.489 10.388 1.00 0.78 H new ATOM 372 N SER F 23 -28.826 9.307 9.786 1.00 0.82 N ATOM 373 CA SER F 23 -27.398 9.730 9.733 1.00 0.98 C ATOM 374 C SER F 23 -26.769 9.565 11.118 1.00 1.21 C ATOM 375 O SER F 23 -26.611 10.518 11.856 1.00 2.10 O ATOM 376 CB SER F 23 -27.314 11.196 9.305 1.00 1.35 C ATOM 377 OG SER F 23 -26.027 11.457 8.764 1.00 2.07 O ATOM 0 H SER F 23 -29.505 10.067 9.828 1.00 0.82 H new ATOM 0 HA SER F 23 -26.862 9.112 9.013 1.00 0.98 H new ATOM 0 HB2 SER F 23 -28.083 11.415 8.564 1.00 1.35 H new ATOM 0 HB3 SER F 23 -27.500 11.847 10.159 1.00 1.35 H new ATOM 0 HG SER F 23 -25.972 12.396 8.488 1.00 2.07 H new ATOM 383 N PHE F 24 -26.409 8.363 11.477 1.00 1.18 N ATOM 384 CA PHE F 24 -25.791 8.138 12.814 1.00 1.49 C ATOM 385 C PHE F 24 -26.745 8.626 13.905 1.00 1.29 C ATOM 386 O PHE F 24 -26.975 9.810 14.058 1.00 1.93 O ATOM 387 CB PHE F 24 -24.473 8.911 12.905 1.00 2.47 C ATOM 388 CG PHE F 24 -23.584 8.271 13.945 1.00 3.10 C ATOM 389 CD1 PHE F 24 -23.430 6.879 13.974 1.00 3.55 C ATOM 390 CD2 PHE F 24 -22.913 9.069 14.879 1.00 3.92 C ATOM 391 CE1 PHE F 24 -22.606 6.287 14.938 1.00 4.55 C ATOM 392 CE2 PHE F 24 -22.089 8.476 15.843 1.00 4.85 C ATOM 393 CZ PHE F 24 -21.935 7.085 15.872 1.00 5.10 C ATOM 0 H PHE F 24 -26.516 7.527 10.902 1.00 1.18 H new ATOM 0 HA PHE F 24 -25.597 7.074 12.950 1.00 1.49 H new ATOM 0 HB2 PHE F 24 -23.973 8.914 11.936 1.00 2.47 H new ATOM 0 HB3 PHE F 24 -24.667 9.951 13.167 1.00 2.47 H new ATOM 0 HD1 PHE F 24 -23.947 6.263 13.253 1.00 3.55 H new ATOM 0 HD2 PHE F 24 -23.031 10.142 14.856 1.00 3.92 H new ATOM 0 HE1 PHE F 24 -22.488 5.214 14.961 1.00 4.55 H new ATOM 0 HE2 PHE F 24 -21.572 9.092 16.564 1.00 4.85 H new ATOM 0 HZ PHE F 24 -21.299 6.628 16.615 1.00 5.10 H new ATOM 403 N GLY F 25 -27.303 7.724 14.665 1.00 1.33 N ATOM 404 CA GLY F 25 -28.242 8.137 15.745 1.00 2.09 C ATOM 405 C GLY F 25 -28.705 6.903 16.519 1.00 1.88 C ATOM 406 O GLY F 25 -28.197 6.594 17.578 1.00 2.44 O ATOM 0 H GLY F 25 -27.149 6.719 14.584 1.00 1.33 H new ATOM 0 HA2 GLY F 25 -27.751 8.839 16.419 1.00 2.09 H new ATOM 0 HA3 GLY F 25 -29.101 8.654 15.317 1.00 2.09 H new ATOM 410 N ASN F 26 -29.666 6.195 15.996 1.00 1.28 N ATOM 411 CA ASN F 26 -30.165 4.980 16.700 1.00 1.26 C ATOM 412 C ASN F 26 -30.883 4.068 15.700 1.00 1.05 C ATOM 413 O ASN F 26 -31.138 4.460 14.579 1.00 1.00 O ATOM 414 CB ASN F 26 -31.141 5.394 17.802 1.00 1.46 C ATOM 415 CG ASN F 26 -30.441 5.313 19.160 1.00 1.81 C ATOM 416 OD1 ASN F 26 -30.542 4.318 19.850 1.00 2.29 O ATOM 417 ND2 ASN F 26 -29.731 6.325 19.576 1.00 2.34 N ATOM 0 H ASN F 26 -30.128 6.405 15.111 1.00 1.28 H new ATOM 0 HA ASN F 26 -29.324 4.445 17.141 1.00 1.26 H new ATOM 0 HB2 ASN F 26 -31.497 6.409 17.625 1.00 1.46 H new ATOM 0 HB3 ASN F 26 -32.015 4.743 17.792 1.00 1.46 H new ATOM 0 HD21 ASN F 26 -29.261 6.281 20.480 1.00 2.34 H new ATOM 0 HD22 ASN F 26 -29.646 7.161 18.997 1.00 2.34 H new ATOM 424 N PRO F 27 -31.189 2.875 16.142 1.00 1.01 N ATOM 425 CA PRO F 27 -31.882 1.875 15.313 1.00 0.91 C ATOM 426 C PRO F 27 -33.380 2.189 15.239 1.00 0.75 C ATOM 427 O PRO F 27 -33.802 3.303 15.475 1.00 0.72 O ATOM 428 CB PRO F 27 -31.635 0.559 16.056 1.00 1.07 C ATOM 429 CG PRO F 27 -31.321 0.940 17.523 1.00 1.19 C ATOM 430 CD PRO F 27 -30.871 2.413 17.510 1.00 1.17 C ATOM 0 HA PRO F 27 -31.526 1.850 14.283 1.00 0.91 H new ATOM 0 HB2 PRO F 27 -32.510 -0.088 16.001 1.00 1.07 H new ATOM 0 HB3 PRO F 27 -30.805 0.011 15.610 1.00 1.07 H new ATOM 0 HG2 PRO F 27 -32.200 0.809 18.154 1.00 1.19 H new ATOM 0 HG3 PRO F 27 -30.539 0.300 17.930 1.00 1.19 H new ATOM 0 HD2 PRO F 27 -31.401 2.998 18.262 1.00 1.17 H new ATOM 0 HD3 PRO F 27 -29.807 2.507 17.725 1.00 1.17 H new ATOM 438 N ARG F 28 -34.185 1.215 14.914 1.00 0.75 N ATOM 439 CA ARG F 28 -35.652 1.459 14.827 1.00 0.67 C ATOM 440 C ARG F 28 -36.245 1.503 16.236 1.00 0.64 C ATOM 441 O ARG F 28 -35.606 1.132 17.200 1.00 0.71 O ATOM 442 CB ARG F 28 -36.311 0.331 14.030 1.00 0.76 C ATOM 443 CG ARG F 28 -36.220 -0.974 14.822 1.00 1.33 C ATOM 444 CD ARG F 28 -36.781 -2.122 13.981 1.00 1.58 C ATOM 445 NE ARG F 28 -36.281 -3.420 14.515 1.00 2.31 N ATOM 446 CZ ARG F 28 -37.055 -4.471 14.509 1.00 2.94 C ATOM 447 NH1 ARG F 28 -37.753 -4.760 13.445 1.00 3.29 N ATOM 448 NH2 ARG F 28 -37.131 -5.232 15.566 1.00 3.67 N ATOM 0 H ARG F 28 -33.890 0.261 14.705 1.00 0.75 H new ATOM 0 HA ARG F 28 -35.833 2.410 14.327 1.00 0.67 H new ATOM 0 HB2 ARG F 28 -37.354 0.575 13.829 1.00 0.76 H new ATOM 0 HB3 ARG F 28 -35.818 0.218 13.064 1.00 0.76 H new ATOM 0 HG2 ARG F 28 -35.183 -1.178 15.089 1.00 1.33 H new ATOM 0 HG3 ARG F 28 -36.778 -0.886 15.754 1.00 1.33 H new ATOM 0 HD2 ARG F 28 -37.871 -2.104 14.002 1.00 1.58 H new ATOM 0 HD3 ARG F 28 -36.480 -2.005 12.940 1.00 1.58 H new ATOM 0 HE ARG F 28 -35.333 -3.487 14.886 1.00 2.31 H new ATOM 0 HH11 ARG F 28 -37.693 -4.165 12.619 1.00 3.29 H new ATOM 0 HH12 ARG F 28 -38.358 -5.581 13.439 1.00 3.29 H new ATOM 0 HH21 ARG F 28 -36.585 -5.006 16.398 1.00 3.67 H new ATOM 0 HH22 ARG F 28 -37.736 -6.053 15.561 1.00 3.67 H new ATOM 462 N GLY F 29 -37.462 1.957 16.366 1.00 0.61 N ATOM 463 CA GLY F 29 -38.090 2.025 17.715 1.00 0.67 C ATOM 464 C GLY F 29 -37.617 3.292 18.433 1.00 0.68 C ATOM 465 O GLY F 29 -37.896 3.498 19.597 1.00 0.83 O ATOM 0 H GLY F 29 -38.047 2.283 15.597 1.00 0.61 H new ATOM 0 HA2 GLY F 29 -39.176 2.030 17.623 1.00 0.67 H new ATOM 0 HA3 GLY F 29 -37.824 1.143 18.297 1.00 0.67 H new ATOM 469 N THR F 30 -36.903 4.142 17.746 1.00 0.59 N ATOM 470 CA THR F 30 -36.414 5.396 18.388 1.00 0.66 C ATOM 471 C THR F 30 -37.324 6.556 17.984 1.00 0.64 C ATOM 472 O THR F 30 -37.313 7.004 16.855 1.00 0.95 O ATOM 473 CB THR F 30 -34.981 5.678 17.929 1.00 0.72 C ATOM 474 OG1 THR F 30 -34.155 4.562 18.239 1.00 0.79 O ATOM 475 CG2 THR F 30 -34.450 6.923 18.641 1.00 0.91 C ATOM 0 H THR F 30 -36.637 4.023 16.769 1.00 0.59 H new ATOM 0 HA THR F 30 -36.428 5.285 19.472 1.00 0.66 H new ATOM 0 HB THR F 30 -34.972 5.847 16.852 1.00 0.72 H new ATOM 0 HG1 THR F 30 -34.003 4.033 17.429 1.00 0.79 H new ATOM 0 HG21 THR F 30 -33.430 7.122 18.313 1.00 0.91 H new ATOM 0 HG22 THR F 30 -35.082 7.778 18.400 1.00 0.91 H new ATOM 0 HG23 THR F 30 -34.459 6.758 19.718 1.00 0.91 H new ATOM 483 N PHE F 31 -38.123 7.038 18.895 1.00 0.53 N ATOM 484 CA PHE F 31 -39.046 8.157 18.561 1.00 0.54 C ATOM 485 C PHE F 31 -38.577 9.445 19.247 1.00 0.61 C ATOM 486 O PHE F 31 -38.692 9.595 20.447 1.00 1.12 O ATOM 487 CB PHE F 31 -40.453 7.806 19.054 1.00 0.66 C ATOM 488 CG PHE F 31 -41.089 6.789 18.134 1.00 0.67 C ATOM 489 CD1 PHE F 31 -40.396 5.623 17.782 1.00 0.97 C ATOM 490 CD2 PHE F 31 -42.380 7.010 17.638 1.00 1.17 C ATOM 491 CE1 PHE F 31 -40.993 4.681 16.936 1.00 1.07 C ATOM 492 CE2 PHE F 31 -42.976 6.069 16.791 1.00 1.46 C ATOM 493 CZ PHE F 31 -42.283 4.904 16.440 1.00 1.20 C ATOM 0 H PHE F 31 -38.176 6.704 19.857 1.00 0.53 H new ATOM 0 HA PHE F 31 -39.054 8.310 17.482 1.00 0.54 H new ATOM 0 HB2 PHE F 31 -40.403 7.409 20.068 1.00 0.66 H new ATOM 0 HB3 PHE F 31 -41.067 8.706 19.094 1.00 0.66 H new ATOM 0 HD1 PHE F 31 -39.400 5.451 18.164 1.00 0.97 H new ATOM 0 HD2 PHE F 31 -42.916 7.907 17.909 1.00 1.17 H new ATOM 0 HE1 PHE F 31 -40.458 3.782 16.666 1.00 1.07 H new ATOM 0 HE2 PHE F 31 -43.971 6.241 16.408 1.00 1.46 H new ATOM 0 HZ PHE F 31 -42.744 4.178 15.787 1.00 1.20 H new ATOM 503 N LEU F 32 -38.061 10.382 18.495 1.00 0.36 N ATOM 504 CA LEU F 32 -37.600 11.661 19.108 1.00 0.45 C ATOM 505 C LEU F 32 -38.714 12.704 18.978 1.00 0.38 C ATOM 506 O LEU F 32 -39.804 12.399 18.546 1.00 0.42 O ATOM 507 CB LEU F 32 -36.345 12.154 18.385 1.00 0.61 C ATOM 508 CG LEU F 32 -36.716 12.599 16.971 1.00 0.65 C ATOM 509 CD1 LEU F 32 -37.186 14.054 17.003 1.00 1.19 C ATOM 510 CD2 LEU F 32 -35.494 12.478 16.060 1.00 1.36 C ATOM 0 H LEU F 32 -37.939 10.316 17.484 1.00 0.36 H new ATOM 0 HA LEU F 32 -37.365 11.503 20.161 1.00 0.45 H new ATOM 0 HB2 LEU F 32 -35.898 12.983 18.934 1.00 0.61 H new ATOM 0 HB3 LEU F 32 -35.600 11.360 18.344 1.00 0.61 H new ATOM 0 HG LEU F 32 -37.517 11.966 16.589 1.00 0.65 H new ATOM 0 HD11 LEU F 32 -37.451 14.373 15.995 1.00 1.19 H new ATOM 0 HD12 LEU F 32 -38.057 14.141 17.652 1.00 1.19 H new ATOM 0 HD13 LEU F 32 -36.385 14.687 17.385 1.00 1.19 H new ATOM 0 HD21 LEU F 32 -35.759 12.795 15.052 1.00 1.36 H new ATOM 0 HD22 LEU F 32 -34.692 13.111 16.441 1.00 1.36 H new ATOM 0 HD23 LEU F 32 -35.158 11.441 16.037 1.00 1.36 H new ATOM 522 N ILE F 33 -38.455 13.930 19.351 1.00 0.35 N ATOM 523 CA ILE F 33 -39.513 14.980 19.251 1.00 0.31 C ATOM 524 C ILE F 33 -38.900 16.257 18.663 1.00 0.29 C ATOM 525 O ILE F 33 -37.701 16.368 18.511 1.00 0.33 O ATOM 526 CB ILE F 33 -40.093 15.250 20.656 1.00 0.34 C ATOM 527 CG1 ILE F 33 -41.197 14.229 20.945 1.00 0.39 C ATOM 528 CG2 ILE F 33 -40.671 16.669 20.750 1.00 0.36 C ATOM 529 CD1 ILE F 33 -41.995 14.665 22.177 1.00 0.43 C ATOM 0 H ILE F 33 -37.559 14.250 19.720 1.00 0.35 H new ATOM 0 HA ILE F 33 -40.319 14.645 18.598 1.00 0.31 H new ATOM 0 HB ILE F 33 -39.292 15.158 21.389 1.00 0.34 H new ATOM 0 HG12 ILE F 33 -41.859 14.141 20.083 1.00 0.39 H new ATOM 0 HG13 ILE F 33 -40.760 13.245 21.113 1.00 0.39 H new ATOM 0 HG21 ILE F 33 -41.073 16.833 21.750 1.00 0.36 H new ATOM 0 HG22 ILE F 33 -39.884 17.396 20.552 1.00 0.36 H new ATOM 0 HG23 ILE F 33 -41.467 16.787 20.015 1.00 0.36 H new ATOM 0 HD11 ILE F 33 -42.780 13.936 22.379 1.00 0.43 H new ATOM 0 HD12 ILE F 33 -41.329 14.730 23.038 1.00 0.43 H new ATOM 0 HD13 ILE F 33 -42.445 15.640 21.992 1.00 0.43 H new ATOM 541 N ARG F 34 -39.715 17.218 18.327 1.00 0.28 N ATOM 542 CA ARG F 34 -39.180 18.483 17.750 1.00 0.30 C ATOM 543 C ARG F 34 -40.346 19.406 17.393 1.00 0.30 C ATOM 544 O ARG F 34 -41.468 18.973 17.234 1.00 0.36 O ATOM 545 CB ARG F 34 -38.364 18.174 16.493 1.00 0.34 C ATOM 546 CG ARG F 34 -38.948 16.950 15.787 1.00 0.46 C ATOM 547 CD ARG F 34 -38.800 17.118 14.273 1.00 0.81 C ATOM 548 NE ARG F 34 -39.607 16.079 13.575 1.00 1.00 N ATOM 549 CZ ARG F 34 -40.681 16.419 12.917 1.00 0.87 C ATOM 550 NH1 ARG F 34 -41.358 17.476 13.275 1.00 1.19 N ATOM 551 NH2 ARG F 34 -41.076 15.704 11.900 1.00 1.59 N ATOM 0 H ARG F 34 -40.729 17.182 18.427 1.00 0.28 H new ATOM 0 HA ARG F 34 -38.536 18.973 18.481 1.00 0.30 H new ATOM 0 HB2 ARG F 34 -38.374 19.032 15.821 1.00 0.34 H new ATOM 0 HB3 ARG F 34 -37.323 17.990 16.760 1.00 0.34 H new ATOM 0 HG2 ARG F 34 -38.434 16.047 16.116 1.00 0.46 H new ATOM 0 HG3 ARG F 34 -39.999 16.832 16.050 1.00 0.46 H new ATOM 0 HD2 ARG F 34 -39.131 18.112 13.973 1.00 0.81 H new ATOM 0 HD3 ARG F 34 -37.752 17.031 13.988 1.00 0.81 H new ATOM 0 HE ARG F 34 -39.320 15.101 13.611 1.00 1.00 H new ATOM 0 HH11 ARG F 34 -41.047 18.036 14.069 1.00 1.19 H new ATOM 0 HH12 ARG F 34 -42.198 17.742 12.761 1.00 1.19 H new ATOM 0 HH21 ARG F 34 -40.545 14.879 11.619 1.00 1.59 H new ATOM 0 HH22 ARG F 34 -41.916 15.970 11.385 1.00 1.59 H new ATOM 565 N GLU F 35 -40.096 20.678 17.282 1.00 0.30 N ATOM 566 CA GLU F 35 -41.195 21.624 16.952 1.00 0.30 C ATOM 567 C GLU F 35 -41.619 21.469 15.492 1.00 0.30 C ATOM 568 O GLU F 35 -40.804 21.477 14.591 1.00 0.34 O ATOM 569 CB GLU F 35 -40.709 23.047 17.182 1.00 0.32 C ATOM 570 CG GLU F 35 -41.002 23.434 18.625 1.00 1.41 C ATOM 571 CD GLU F 35 -40.763 24.934 18.815 1.00 1.41 C ATOM 572 OE1 GLU F 35 -41.134 25.689 17.932 1.00 0.80 O ATOM 573 OE2 GLU F 35 -40.212 25.301 19.840 1.00 2.32 O ATOM 0 H GLU F 35 -39.178 21.104 17.406 1.00 0.30 H new ATOM 0 HA GLU F 35 -42.051 21.407 17.590 1.00 0.30 H new ATOM 0 HB2 GLU F 35 -39.640 23.119 16.981 1.00 0.32 H new ATOM 0 HB3 GLU F 35 -41.209 23.733 16.498 1.00 0.32 H new ATOM 0 HG2 GLU F 35 -42.033 23.185 18.876 1.00 1.41 H new ATOM 0 HG3 GLU F 35 -40.363 22.866 19.301 1.00 1.41 H new ATOM 580 N SER F 36 -42.896 21.344 15.253 1.00 0.30 N ATOM 581 CA SER F 36 -43.384 21.206 13.856 1.00 0.33 C ATOM 582 C SER F 36 -43.429 22.579 13.192 1.00 0.37 C ATOM 583 O SER F 36 -44.032 23.505 13.698 1.00 0.62 O ATOM 584 CB SER F 36 -44.796 20.626 13.860 1.00 0.41 C ATOM 585 OG SER F 36 -44.768 19.306 14.379 1.00 0.45 O ATOM 0 H SER F 36 -43.623 21.332 15.969 1.00 0.30 H new ATOM 0 HA SER F 36 -42.710 20.546 13.310 1.00 0.33 H new ATOM 0 HB2 SER F 36 -45.455 21.251 14.463 1.00 0.41 H new ATOM 0 HB3 SER F 36 -45.201 20.621 12.848 1.00 0.41 H new ATOM 0 HG SER F 36 -45.103 19.309 15.300 1.00 0.45 H new ATOM 591 N GLU F 37 -42.818 22.714 12.052 1.00 0.38 N ATOM 592 CA GLU F 37 -42.852 24.021 11.345 1.00 0.43 C ATOM 593 C GLU F 37 -44.079 24.051 10.437 1.00 0.48 C ATOM 594 O GLU F 37 -44.200 24.881 9.558 1.00 0.54 O ATOM 595 CB GLU F 37 -41.603 24.167 10.489 1.00 0.51 C ATOM 596 CG GLU F 37 -40.375 24.312 11.390 1.00 0.50 C ATOM 597 CD GLU F 37 -39.546 25.514 10.933 1.00 1.12 C ATOM 598 OE1 GLU F 37 -39.509 25.763 9.740 1.00 1.90 O ATOM 599 OE2 GLU F 37 -38.962 26.164 11.785 1.00 1.41 O ATOM 0 H GLU F 37 -42.296 21.976 11.579 1.00 0.38 H new ATOM 0 HA GLU F 37 -42.895 24.833 12.070 1.00 0.43 H new ATOM 0 HB2 GLU F 37 -41.490 23.297 9.842 1.00 0.51 H new ATOM 0 HB3 GLU F 37 -41.695 25.038 9.840 1.00 0.51 H new ATOM 0 HG2 GLU F 37 -40.685 24.443 12.427 1.00 0.50 H new ATOM 0 HG3 GLU F 37 -39.772 23.405 11.350 1.00 0.50 H new ATOM 606 N THR F 38 -44.987 23.140 10.642 1.00 0.50 N ATOM 607 CA THR F 38 -46.208 23.095 9.795 1.00 0.60 C ATOM 608 C THR F 38 -47.192 24.145 10.288 1.00 0.61 C ATOM 609 O THR F 38 -47.816 24.847 9.517 1.00 0.69 O ATOM 610 CB THR F 38 -46.840 21.701 9.896 1.00 0.64 C ATOM 611 OG1 THR F 38 -47.674 21.478 8.768 1.00 0.75 O ATOM 612 CG2 THR F 38 -47.670 21.584 11.179 1.00 0.63 C ATOM 0 H THR F 38 -44.935 22.421 11.364 1.00 0.50 H new ATOM 0 HA THR F 38 -45.951 23.299 8.756 1.00 0.60 H new ATOM 0 HB THR F 38 -46.047 20.954 9.921 1.00 0.64 H new ATOM 0 HG1 THR F 38 -48.077 20.587 8.830 1.00 0.75 H new ATOM 0 HG21 THR F 38 -48.112 20.589 11.237 1.00 0.63 H new ATOM 0 HG22 THR F 38 -47.027 21.746 12.044 1.00 0.63 H new ATOM 0 HG23 THR F 38 -48.462 22.333 11.170 1.00 0.63 H new ATOM 620 N THR F 39 -47.334 24.251 11.574 1.00 0.56 N ATOM 621 CA THR F 39 -48.284 25.256 12.130 1.00 0.61 C ATOM 622 C THR F 39 -47.499 26.404 12.769 1.00 0.57 C ATOM 623 O THR F 39 -46.290 26.470 12.667 1.00 0.54 O ATOM 624 CB THR F 39 -49.189 24.585 13.172 1.00 0.64 C ATOM 625 OG1 THR F 39 -50.369 25.357 13.337 1.00 1.06 O ATOM 626 CG2 THR F 39 -48.461 24.474 14.513 1.00 0.67 C ATOM 0 H THR F 39 -46.837 23.689 12.266 1.00 0.56 H new ATOM 0 HA THR F 39 -48.905 25.656 11.329 1.00 0.61 H new ATOM 0 HB THR F 39 -49.447 23.584 12.826 1.00 0.64 H new ATOM 0 HG1 THR F 39 -50.949 24.929 14.001 1.00 1.06 H new ATOM 0 HG21 THR F 39 -49.114 23.996 15.243 1.00 0.67 H new ATOM 0 HG22 THR F 39 -47.558 23.877 14.388 1.00 0.67 H new ATOM 0 HG23 THR F 39 -48.191 25.470 14.864 1.00 0.67 H new ATOM 634 N LYS F 40 -48.177 27.306 13.428 1.00 0.58 N ATOM 635 CA LYS F 40 -47.471 28.444 14.076 1.00 0.57 C ATOM 636 C LYS F 40 -46.223 27.912 14.770 1.00 0.50 C ATOM 637 O LYS F 40 -45.183 28.540 14.786 1.00 0.52 O ATOM 638 CB LYS F 40 -48.391 29.089 15.112 1.00 0.61 C ATOM 639 CG LYS F 40 -49.807 29.188 14.546 1.00 0.68 C ATOM 640 CD LYS F 40 -50.610 30.213 15.351 1.00 1.23 C ATOM 641 CE LYS F 40 -52.102 29.896 15.236 1.00 1.83 C ATOM 642 NZ LYS F 40 -52.888 31.158 15.347 1.00 2.34 N ATOM 0 H LYS F 40 -49.190 27.302 13.544 1.00 0.58 H new ATOM 0 HA LYS F 40 -47.195 29.186 13.327 1.00 0.57 H new ATOM 0 HB2 LYS F 40 -48.395 28.498 16.028 1.00 0.61 H new ATOM 0 HB3 LYS F 40 -48.022 30.081 15.374 1.00 0.61 H new ATOM 0 HG2 LYS F 40 -49.771 29.482 13.497 1.00 0.68 H new ATOM 0 HG3 LYS F 40 -50.295 28.214 14.588 1.00 0.68 H new ATOM 0 HD2 LYS F 40 -50.302 30.192 16.396 1.00 1.23 H new ATOM 0 HD3 LYS F 40 -50.411 31.219 14.980 1.00 1.23 H new ATOM 0 HE2 LYS F 40 -52.309 29.409 14.283 1.00 1.83 H new ATOM 0 HE3 LYS F 40 -52.398 29.200 16.021 1.00 1.83 H new ATOM 0 HZ1 LYS F 40 -53.903 30.943 15.269 1.00 2.34 H new ATOM 0 HZ2 LYS F 40 -52.699 31.605 16.267 1.00 2.34 H new ATOM 0 HZ3 LYS F 40 -52.612 31.807 14.583 1.00 2.34 H new ATOM 656 N GLY F 41 -46.328 26.747 15.338 1.00 0.44 N ATOM 657 CA GLY F 41 -45.166 26.140 16.032 1.00 0.38 C ATOM 658 C GLY F 41 -45.661 25.062 16.995 1.00 0.36 C ATOM 659 O GLY F 41 -45.636 25.224 18.199 1.00 0.38 O ATOM 0 H GLY F 41 -47.179 26.184 15.351 1.00 0.44 H new ATOM 0 HA2 GLY F 41 -44.479 25.707 15.305 1.00 0.38 H new ATOM 0 HA3 GLY F 41 -44.613 26.905 16.577 1.00 0.38 H new ATOM 663 N ALA F 42 -46.098 23.957 16.465 1.00 0.35 N ATOM 664 CA ALA F 42 -46.585 22.846 17.323 1.00 0.35 C ATOM 665 C ALA F 42 -45.391 21.985 17.695 1.00 0.32 C ATOM 666 O ALA F 42 -44.259 22.405 17.577 1.00 0.32 O ATOM 667 CB ALA F 42 -47.596 22.013 16.531 1.00 0.38 C ATOM 0 H ALA F 42 -46.139 23.775 15.462 1.00 0.35 H new ATOM 0 HA ALA F 42 -47.065 23.231 18.223 1.00 0.35 H new ATOM 0 HB1 ALA F 42 -47.959 21.195 17.152 1.00 0.38 H new ATOM 0 HB2 ALA F 42 -48.434 22.644 16.235 1.00 0.38 H new ATOM 0 HB3 ALA F 42 -47.115 21.607 15.641 1.00 0.38 H new ATOM 673 N TYR F 43 -45.618 20.785 18.130 1.00 0.32 N ATOM 674 CA TYR F 43 -44.467 19.920 18.473 1.00 0.31 C ATOM 675 C TYR F 43 -44.445 18.735 17.524 1.00 0.29 C ATOM 676 O TYR F 43 -45.185 18.688 16.563 1.00 0.31 O ATOM 677 CB TYR F 43 -44.573 19.428 19.909 1.00 0.34 C ATOM 678 CG TYR F 43 -43.398 19.965 20.681 1.00 0.38 C ATOM 679 CD1 TYR F 43 -42.097 19.793 20.185 1.00 0.39 C ATOM 680 CD2 TYR F 43 -43.608 20.651 21.882 1.00 0.45 C ATOM 681 CE1 TYR F 43 -41.008 20.314 20.899 1.00 0.47 C ATOM 682 CE2 TYR F 43 -42.522 21.166 22.593 1.00 0.54 C ATOM 683 CZ TYR F 43 -41.224 21.001 22.104 1.00 0.55 C ATOM 684 OH TYR F 43 -40.159 21.519 22.809 1.00 0.65 O ATOM 0 H TYR F 43 -46.540 20.369 18.262 1.00 0.32 H new ATOM 0 HA TYR F 43 -43.546 20.495 18.377 1.00 0.31 H new ATOM 0 HB2 TYR F 43 -45.508 19.765 20.358 1.00 0.34 H new ATOM 0 HB3 TYR F 43 -44.580 18.338 19.937 1.00 0.34 H new ATOM 0 HD1 TYR F 43 -41.935 19.262 19.258 1.00 0.39 H new ATOM 0 HD2 TYR F 43 -44.611 20.782 22.260 1.00 0.45 H new ATOM 0 HE1 TYR F 43 -40.004 20.187 20.522 1.00 0.47 H new ATOM 0 HE2 TYR F 43 -42.686 21.692 23.522 1.00 0.54 H new ATOM 0 HH TYR F 43 -39.666 20.790 23.240 1.00 0.65 H new ATOM 694 N SER F 44 -43.596 17.782 17.764 1.00 0.28 N ATOM 695 CA SER F 44 -43.535 16.623 16.842 1.00 0.27 C ATOM 696 C SER F 44 -42.865 15.435 17.513 1.00 0.27 C ATOM 697 O SER F 44 -42.198 15.555 18.520 1.00 0.28 O ATOM 698 CB SER F 44 -42.725 17.020 15.623 1.00 0.28 C ATOM 699 OG SER F 44 -42.520 15.885 14.794 1.00 1.32 O ATOM 0 H SER F 44 -42.948 17.755 18.551 1.00 0.28 H new ATOM 0 HA SER F 44 -44.549 16.338 16.560 1.00 0.27 H new ATOM 0 HB2 SER F 44 -43.246 17.799 15.067 1.00 0.28 H new ATOM 0 HB3 SER F 44 -41.766 17.435 15.931 1.00 0.28 H new ATOM 0 HG SER F 44 -43.160 15.902 14.052 1.00 1.32 H new ATOM 705 N LEU F 45 -43.031 14.288 16.934 1.00 0.27 N ATOM 706 CA LEU F 45 -42.401 13.064 17.494 1.00 0.28 C ATOM 707 C LEU F 45 -41.856 12.223 16.342 1.00 0.26 C ATOM 708 O LEU F 45 -42.525 11.354 15.820 1.00 0.32 O ATOM 709 CB LEU F 45 -43.430 12.249 18.276 1.00 0.34 C ATOM 710 CG LEU F 45 -42.801 10.916 18.683 1.00 0.45 C ATOM 711 CD1 LEU F 45 -41.715 11.165 19.729 1.00 1.17 C ATOM 712 CD2 LEU F 45 -43.871 10.003 19.271 1.00 1.24 C ATOM 0 H LEU F 45 -43.581 14.141 16.088 1.00 0.27 H new ATOM 0 HA LEU F 45 -41.594 13.348 18.169 1.00 0.28 H new ATOM 0 HB2 LEU F 45 -43.753 12.799 19.160 1.00 0.34 H new ATOM 0 HB3 LEU F 45 -44.317 12.077 17.666 1.00 0.34 H new ATOM 0 HG LEU F 45 -42.362 10.441 17.806 1.00 0.45 H new ATOM 0 HD11 LEU F 45 -41.266 10.216 20.020 1.00 1.17 H new ATOM 0 HD12 LEU F 45 -40.948 11.816 19.309 1.00 1.17 H new ATOM 0 HD13 LEU F 45 -42.156 11.641 20.605 1.00 1.17 H new ATOM 0 HD21 LEU F 45 -43.420 9.054 19.560 1.00 1.24 H new ATOM 0 HD22 LEU F 45 -44.312 10.477 20.148 1.00 1.24 H new ATOM 0 HD23 LEU F 45 -44.646 9.824 18.526 1.00 1.24 H new ATOM 724 N SER F 46 -40.646 12.481 15.938 1.00 0.26 N ATOM 725 CA SER F 46 -40.054 11.706 14.813 1.00 0.26 C ATOM 726 C SER F 46 -39.826 10.264 15.256 1.00 0.28 C ATOM 727 O SER F 46 -39.745 9.969 16.431 1.00 0.39 O ATOM 728 CB SER F 46 -38.721 12.334 14.402 1.00 0.30 C ATOM 729 OG SER F 46 -38.638 13.652 14.924 1.00 1.33 O ATOM 0 H SER F 46 -40.039 13.196 16.338 1.00 0.26 H new ATOM 0 HA SER F 46 -40.736 11.721 13.963 1.00 0.26 H new ATOM 0 HB2 SER F 46 -37.893 11.731 14.774 1.00 0.30 H new ATOM 0 HB3 SER F 46 -38.637 12.356 13.315 1.00 0.30 H new ATOM 0 HG SER F 46 -39.532 14.052 14.945 1.00 1.33 H new ATOM 735 N ILE F 47 -39.729 9.361 14.322 1.00 0.27 N ATOM 736 CA ILE F 47 -39.512 7.936 14.688 1.00 0.32 C ATOM 737 C ILE F 47 -38.506 7.302 13.720 1.00 0.34 C ATOM 738 O ILE F 47 -38.399 7.691 12.575 1.00 0.54 O ATOM 739 CB ILE F 47 -40.856 7.186 14.635 1.00 0.38 C ATOM 740 CG1 ILE F 47 -41.118 6.646 13.224 1.00 0.81 C ATOM 741 CG2 ILE F 47 -41.987 8.143 15.019 1.00 0.82 C ATOM 742 CD1 ILE F 47 -42.404 5.816 13.227 1.00 0.80 C ATOM 0 H ILE F 47 -39.791 9.549 13.321 1.00 0.27 H new ATOM 0 HA ILE F 47 -39.110 7.872 15.699 1.00 0.32 H new ATOM 0 HB ILE F 47 -40.815 6.350 15.333 1.00 0.38 H new ATOM 0 HG12 ILE F 47 -41.207 7.471 12.518 1.00 0.81 H new ATOM 0 HG13 ILE F 47 -40.278 6.034 12.895 1.00 0.81 H new ATOM 0 HG21 ILE F 47 -42.939 7.614 14.982 1.00 0.82 H new ATOM 0 HG22 ILE F 47 -41.819 8.518 16.029 1.00 0.82 H new ATOM 0 HG23 ILE F 47 -42.009 8.979 14.320 1.00 0.82 H new ATOM 0 HD11 ILE F 47 -42.591 5.432 12.224 1.00 0.80 H new ATOM 0 HD12 ILE F 47 -42.297 4.982 13.921 1.00 0.80 H new ATOM 0 HD13 ILE F 47 -43.240 6.442 13.538 1.00 0.80 H new ATOM 754 N ARG F 48 -37.776 6.321 14.173 1.00 0.33 N ATOM 755 CA ARG F 48 -36.787 5.651 13.284 1.00 0.35 C ATOM 756 C ARG F 48 -37.259 4.224 13.014 1.00 0.38 C ATOM 757 O ARG F 48 -37.580 3.489 13.926 1.00 0.50 O ATOM 758 CB ARG F 48 -35.420 5.615 13.970 1.00 0.42 C ATOM 759 CG ARG F 48 -34.321 5.836 12.929 1.00 0.79 C ATOM 760 CD ARG F 48 -34.038 4.524 12.195 1.00 0.69 C ATOM 761 NE ARG F 48 -32.586 4.204 12.293 1.00 0.93 N ATOM 762 CZ ARG F 48 -32.135 3.061 11.852 1.00 0.71 C ATOM 763 NH1 ARG F 48 -32.931 2.029 11.776 1.00 1.43 N ATOM 764 NH2 ARG F 48 -30.887 2.950 11.487 1.00 0.96 N ATOM 0 H ARG F 48 -37.822 5.954 15.123 1.00 0.33 H new ATOM 0 HA ARG F 48 -36.701 6.200 12.346 1.00 0.35 H new ATOM 0 HB2 ARG F 48 -35.367 6.385 14.740 1.00 0.42 H new ATOM 0 HB3 ARG F 48 -35.276 4.656 14.468 1.00 0.42 H new ATOM 0 HG2 ARG F 48 -34.628 6.603 12.218 1.00 0.79 H new ATOM 0 HG3 ARG F 48 -33.414 6.196 13.414 1.00 0.79 H new ATOM 0 HD2 ARG F 48 -34.629 3.717 12.628 1.00 0.69 H new ATOM 0 HD3 ARG F 48 -34.333 4.609 11.149 1.00 0.69 H new ATOM 0 HE ARG F 48 -31.943 4.880 12.706 1.00 0.93 H new ATOM 0 HH11 ARG F 48 -33.906 2.115 12.061 1.00 1.43 H new ATOM 0 HH12 ARG F 48 -32.577 1.137 11.431 1.00 1.43 H new ATOM 0 HH21 ARG F 48 -30.265 3.756 11.546 1.00 0.96 H new ATOM 0 HH22 ARG F 48 -30.534 2.057 11.142 1.00 0.96 H new ATOM 778 N ASP F 49 -37.317 3.822 11.776 1.00 0.39 N ATOM 779 CA ASP F 49 -37.783 2.439 11.481 1.00 0.45 C ATOM 780 C ASP F 49 -37.098 1.901 10.221 1.00 0.45 C ATOM 781 O ASP F 49 -37.589 2.058 9.121 1.00 0.88 O ATOM 782 CB ASP F 49 -39.298 2.451 11.267 1.00 0.53 C ATOM 783 CG ASP F 49 -39.759 1.067 10.804 1.00 1.17 C ATOM 784 OD1 ASP F 49 -39.045 0.111 11.059 1.00 1.81 O ATOM 785 OD2 ASP F 49 -40.818 0.987 10.204 1.00 1.63 O ATOM 0 H ASP F 49 -37.065 4.384 10.963 1.00 0.39 H new ATOM 0 HA ASP F 49 -37.530 1.794 12.323 1.00 0.45 H new ATOM 0 HB2 ASP F 49 -39.805 2.724 12.193 1.00 0.53 H new ATOM 0 HB3 ASP F 49 -39.565 3.202 10.524 1.00 0.53 H new ATOM 790 N TRP F 50 -35.977 1.251 10.376 1.00 0.50 N ATOM 791 CA TRP F 50 -35.272 0.683 9.191 1.00 0.50 C ATOM 792 C TRP F 50 -35.978 -0.616 8.783 1.00 0.58 C ATOM 793 O TRP F 50 -36.713 -1.199 9.556 1.00 0.64 O ATOM 794 CB TRP F 50 -33.808 0.408 9.561 1.00 0.62 C ATOM 795 CG TRP F 50 -33.213 -0.552 8.585 1.00 0.67 C ATOM 796 CD1 TRP F 50 -32.342 -0.236 7.604 1.00 0.65 C ATOM 797 CD2 TRP F 50 -33.432 -1.978 8.492 1.00 0.80 C ATOM 798 NE1 TRP F 50 -32.031 -1.384 6.897 1.00 0.73 N ATOM 799 CE2 TRP F 50 -32.672 -2.488 7.417 1.00 0.85 C ATOM 800 CE3 TRP F 50 -34.217 -2.864 9.233 1.00 0.92 C ATOM 801 CZ2 TRP F 50 -32.689 -3.842 7.091 1.00 1.01 C ATOM 802 CZ3 TRP F 50 -34.240 -4.231 8.913 1.00 1.10 C ATOM 803 CH2 TRP F 50 -33.474 -4.719 7.843 1.00 1.14 C ATOM 0 H TRP F 50 -35.518 1.088 11.272 1.00 0.50 H new ATOM 0 HA TRP F 50 -35.295 1.383 8.356 1.00 0.50 H new ATOM 0 HB2 TRP F 50 -33.242 1.339 9.561 1.00 0.62 H new ATOM 0 HB3 TRP F 50 -33.749 -0.001 10.570 1.00 0.62 H new ATOM 0 HD1 TRP F 50 -31.952 0.751 7.404 1.00 0.65 H new ATOM 0 HE1 TRP F 50 -31.406 -1.410 6.092 1.00 0.73 H new ATOM 0 HE3 TRP F 50 -34.810 -2.496 10.057 1.00 0.92 H new ATOM 0 HZ2 TRP F 50 -32.100 -4.211 6.264 1.00 1.01 H new ATOM 0 HZ3 TRP F 50 -34.849 -4.909 9.492 1.00 1.10 H new ATOM 0 HH2 TRP F 50 -33.492 -5.771 7.601 1.00 1.14 H new ATOM 814 N ASP F 51 -35.777 -1.067 7.574 1.00 0.64 N ATOM 815 CA ASP F 51 -36.458 -2.319 7.128 1.00 0.81 C ATOM 816 C ASP F 51 -35.506 -3.167 6.276 1.00 0.91 C ATOM 817 O ASP F 51 -34.562 -2.669 5.697 1.00 0.83 O ATOM 818 CB ASP F 51 -37.692 -1.950 6.301 1.00 0.84 C ATOM 819 CG ASP F 51 -38.878 -2.811 6.742 1.00 1.00 C ATOM 820 OD1 ASP F 51 -38.661 -3.736 7.506 1.00 1.16 O ATOM 821 OD2 ASP F 51 -39.983 -2.529 6.307 1.00 1.24 O ATOM 0 H ASP F 51 -35.175 -0.626 6.879 1.00 0.64 H new ATOM 0 HA ASP F 51 -36.755 -2.897 8.003 1.00 0.81 H new ATOM 0 HB2 ASP F 51 -37.928 -0.894 6.431 1.00 0.84 H new ATOM 0 HB3 ASP F 51 -37.492 -2.104 5.241 1.00 0.84 H new ATOM 826 N ASP F 52 -35.752 -4.449 6.202 1.00 1.10 N ATOM 827 CA ASP F 52 -34.868 -5.345 5.398 1.00 1.22 C ATOM 828 C ASP F 52 -35.306 -5.342 3.930 1.00 1.25 C ATOM 829 O ASP F 52 -35.375 -6.378 3.298 1.00 1.44 O ATOM 830 CB ASP F 52 -34.960 -6.773 5.951 1.00 1.44 C ATOM 831 CG ASP F 52 -36.275 -7.420 5.505 1.00 2.11 C ATOM 832 OD1 ASP F 52 -37.287 -7.151 6.131 1.00 2.71 O ATOM 833 OD2 ASP F 52 -36.246 -8.173 4.546 1.00 2.58 O ATOM 0 H ASP F 52 -36.531 -4.916 6.666 1.00 1.10 H new ATOM 0 HA ASP F 52 -33.841 -4.985 5.463 1.00 1.22 H new ATOM 0 HB2 ASP F 52 -34.115 -7.364 5.598 1.00 1.44 H new ATOM 0 HB3 ASP F 52 -34.904 -6.755 7.039 1.00 1.44 H new ATOM 838 N MET F 53 -35.597 -4.198 3.374 1.00 1.11 N ATOM 839 CA MET F 53 -36.018 -4.169 1.951 1.00 1.21 C ATOM 840 C MET F 53 -35.875 -2.758 1.377 1.00 1.10 C ATOM 841 O MET F 53 -36.485 -2.426 0.380 1.00 1.31 O ATOM 842 CB MET F 53 -37.473 -4.631 1.829 1.00 1.43 C ATOM 843 CG MET F 53 -38.415 -3.521 2.304 1.00 1.75 C ATOM 844 SD MET F 53 -39.407 -4.131 3.688 1.00 1.61 S ATOM 845 CE MET F 53 -38.024 -4.667 4.722 1.00 1.71 C ATOM 0 H MET F 53 -35.561 -3.292 3.841 1.00 1.11 H new ATOM 0 HA MET F 53 -35.375 -4.843 1.386 1.00 1.21 H new ATOM 0 HB2 MET F 53 -37.696 -4.890 0.794 1.00 1.43 H new ATOM 0 HB3 MET F 53 -37.629 -5.531 2.424 1.00 1.43 H new ATOM 0 HG2 MET F 53 -37.840 -2.647 2.611 1.00 1.75 H new ATOM 0 HG3 MET F 53 -39.064 -3.205 1.488 1.00 1.75 H new ATOM 0 HE1 MET F 53 -38.382 -4.870 5.731 1.00 1.71 H new ATOM 0 HE2 MET F 53 -37.586 -5.573 4.303 1.00 1.71 H new ATOM 0 HE3 MET F 53 -37.269 -3.881 4.756 1.00 1.71 H new ATOM 855 N LYS F 54 -35.078 -1.921 1.983 1.00 0.95 N ATOM 856 CA LYS F 54 -34.923 -0.548 1.439 1.00 0.89 C ATOM 857 C LYS F 54 -33.853 0.228 2.212 1.00 0.73 C ATOM 858 O LYS F 54 -33.208 1.104 1.671 1.00 0.81 O ATOM 859 CB LYS F 54 -36.258 0.191 1.536 1.00 1.01 C ATOM 860 CG LYS F 54 -36.826 0.034 2.948 1.00 0.92 C ATOM 861 CD LYS F 54 -37.985 1.014 3.143 1.00 1.36 C ATOM 862 CE LYS F 54 -39.261 0.237 3.472 1.00 1.52 C ATOM 863 NZ LYS F 54 -40.413 1.180 3.538 1.00 1.58 N ATOM 0 H LYS F 54 -34.535 -2.127 2.821 1.00 0.95 H new ATOM 0 HA LYS F 54 -34.612 -0.621 0.397 1.00 0.89 H new ATOM 0 HB2 LYS F 54 -36.119 1.247 1.304 1.00 1.01 H new ATOM 0 HB3 LYS F 54 -36.960 -0.207 0.804 1.00 1.01 H new ATOM 0 HG2 LYS F 54 -37.171 -0.989 3.101 1.00 0.92 H new ATOM 0 HG3 LYS F 54 -36.048 0.222 3.688 1.00 0.92 H new ATOM 0 HD2 LYS F 54 -37.754 1.712 3.948 1.00 1.36 H new ATOM 0 HD3 LYS F 54 -38.130 1.606 2.240 1.00 1.36 H new ATOM 0 HE2 LYS F 54 -39.443 -0.523 2.712 1.00 1.52 H new ATOM 0 HE3 LYS F 54 -39.148 -0.283 4.423 1.00 1.52 H new ATOM 0 HZ1 LYS F 54 -41.281 0.653 3.762 1.00 1.58 H new ATOM 0 HZ2 LYS F 54 -40.239 1.890 4.278 1.00 1.58 H new ATOM 0 HZ3 LYS F 54 -40.524 1.657 2.620 1.00 1.58 H new ATOM 877 N GLY F 55 -33.661 -0.064 3.468 1.00 0.62 N ATOM 878 CA GLY F 55 -32.648 0.678 4.241 1.00 0.57 C ATOM 879 C GLY F 55 -33.320 1.315 5.450 1.00 0.50 C ATOM 880 O GLY F 55 -34.435 0.983 5.798 1.00 0.50 O ATOM 0 H GLY F 55 -34.165 -0.785 3.985 1.00 0.62 H new ATOM 0 HA2 GLY F 55 -31.852 0.006 4.562 1.00 0.57 H new ATOM 0 HA3 GLY F 55 -32.186 1.445 3.619 1.00 0.57 H new ATOM 884 N ASP F 56 -32.653 2.218 6.099 1.00 0.53 N ATOM 885 CA ASP F 56 -33.257 2.860 7.292 1.00 0.48 C ATOM 886 C ASP F 56 -34.331 3.851 6.841 1.00 0.44 C ATOM 887 O ASP F 56 -34.470 4.139 5.669 1.00 0.48 O ATOM 888 CB ASP F 56 -32.171 3.602 8.072 1.00 0.54 C ATOM 889 CG ASP F 56 -30.840 2.859 7.934 1.00 1.14 C ATOM 890 OD1 ASP F 56 -30.612 1.943 8.708 1.00 1.42 O ATOM 891 OD2 ASP F 56 -30.071 3.219 7.058 1.00 2.06 O ATOM 0 H ASP F 56 -31.716 2.540 5.856 1.00 0.53 H new ATOM 0 HA ASP F 56 -33.707 2.100 7.931 1.00 0.48 H new ATOM 0 HB2 ASP F 56 -32.071 4.620 7.696 1.00 0.54 H new ATOM 0 HB3 ASP F 56 -32.450 3.676 9.123 1.00 0.54 H new ATOM 896 N HIS F 57 -35.085 4.383 7.761 1.00 0.39 N ATOM 897 CA HIS F 57 -36.140 5.361 7.391 1.00 0.38 C ATOM 898 C HIS F 57 -36.535 6.140 8.638 1.00 0.32 C ATOM 899 O HIS F 57 -35.977 5.954 9.701 1.00 0.30 O ATOM 900 CB HIS F 57 -37.366 4.633 6.840 1.00 0.40 C ATOM 901 CG HIS F 57 -37.281 4.565 5.340 1.00 0.66 C ATOM 902 ND1 HIS F 57 -38.124 3.763 4.587 1.00 1.41 N ATOM 903 CD2 HIS F 57 -36.461 5.198 4.438 1.00 1.02 C ATOM 904 CE1 HIS F 57 -37.796 3.933 3.293 1.00 1.54 C ATOM 905 NE2 HIS F 57 -36.788 4.797 3.146 1.00 1.18 N ATOM 0 H HIS F 57 -35.014 4.180 8.758 1.00 0.39 H new ATOM 0 HA HIS F 57 -35.759 6.036 6.624 1.00 0.38 H new ATOM 0 HB2 HIS F 57 -37.422 3.627 7.257 1.00 0.40 H new ATOM 0 HB3 HIS F 57 -38.276 5.154 7.139 1.00 0.40 H new ATOM 0 HD2 HIS F 57 -35.681 5.900 4.693 1.00 1.02 H new ATOM 0 HE1 HIS F 57 -38.288 3.432 2.473 1.00 1.54 H new ATOM 0 HE2 HIS F 57 -36.352 5.098 2.274 1.00 1.18 H new ATOM 913 N VAL F 58 -37.488 7.012 8.521 1.00 0.30 N ATOM 914 CA VAL F 58 -37.905 7.802 9.704 1.00 0.26 C ATOM 915 C VAL F 58 -39.302 8.387 9.471 1.00 0.27 C ATOM 916 O VAL F 58 -39.557 9.050 8.485 1.00 0.49 O ATOM 917 CB VAL F 58 -36.875 8.917 9.932 1.00 0.28 C ATOM 918 CG1 VAL F 58 -37.538 10.157 10.545 1.00 0.93 C ATOM 919 CG2 VAL F 58 -35.797 8.412 10.885 1.00 0.89 C ATOM 0 H VAL F 58 -37.996 7.212 7.659 1.00 0.30 H new ATOM 0 HA VAL F 58 -37.950 7.167 10.589 1.00 0.26 H new ATOM 0 HB VAL F 58 -36.440 9.190 8.971 1.00 0.28 H new ATOM 0 HG11 VAL F 58 -36.788 10.933 10.697 1.00 0.93 H new ATOM 0 HG12 VAL F 58 -38.311 10.527 9.871 1.00 0.93 H new ATOM 0 HG13 VAL F 58 -37.987 9.894 11.503 1.00 0.93 H new ATOM 0 HG21 VAL F 58 -35.061 9.199 11.052 1.00 0.89 H new ATOM 0 HG22 VAL F 58 -36.253 8.134 11.835 1.00 0.89 H new ATOM 0 HG23 VAL F 58 -35.305 7.542 10.450 1.00 0.89 H new ATOM 929 N LYS F 59 -40.196 8.157 10.388 1.00 0.34 N ATOM 930 CA LYS F 59 -41.572 8.707 10.254 1.00 0.37 C ATOM 931 C LYS F 59 -41.706 9.895 11.200 1.00 0.33 C ATOM 932 O LYS F 59 -40.729 10.394 11.718 1.00 0.41 O ATOM 933 CB LYS F 59 -42.592 7.630 10.631 1.00 0.39 C ATOM 934 CG LYS F 59 -43.754 7.655 9.636 1.00 0.68 C ATOM 935 CD LYS F 59 -44.138 6.221 9.266 1.00 1.15 C ATOM 936 CE LYS F 59 -44.798 6.210 7.886 1.00 1.53 C ATOM 937 NZ LYS F 59 -44.494 4.923 7.200 1.00 2.05 N ATOM 0 H LYS F 59 -40.032 7.607 11.231 1.00 0.34 H new ATOM 0 HA LYS F 59 -41.755 9.023 9.227 1.00 0.37 H new ATOM 0 HB2 LYS F 59 -42.118 6.648 10.628 1.00 0.39 H new ATOM 0 HB3 LYS F 59 -42.961 7.802 11.642 1.00 0.39 H new ATOM 0 HG2 LYS F 59 -44.609 8.171 10.072 1.00 0.68 H new ATOM 0 HG3 LYS F 59 -43.469 8.209 8.742 1.00 0.68 H new ATOM 0 HD2 LYS F 59 -43.253 5.585 9.263 1.00 1.15 H new ATOM 0 HD3 LYS F 59 -44.821 5.812 10.011 1.00 1.15 H new ATOM 0 HE2 LYS F 59 -45.876 6.335 7.986 1.00 1.53 H new ATOM 0 HE3 LYS F 59 -44.434 7.047 7.290 1.00 1.53 H new ATOM 0 HZ1 LYS F 59 -44.943 4.915 6.262 1.00 2.05 H new ATOM 0 HZ2 LYS F 59 -43.465 4.822 7.092 1.00 2.05 H new ATOM 0 HZ3 LYS F 59 -44.862 4.132 7.766 1.00 2.05 H new ATOM 951 N HIS F 60 -42.897 10.357 11.438 1.00 0.32 N ATOM 952 CA HIS F 60 -43.060 11.512 12.366 1.00 0.29 C ATOM 953 C HIS F 60 -44.493 11.569 12.887 1.00 0.31 C ATOM 954 O HIS F 60 -45.431 11.184 12.218 1.00 0.41 O ATOM 955 CB HIS F 60 -42.746 12.825 11.646 1.00 0.34 C ATOM 956 CG HIS F 60 -41.586 12.635 10.709 1.00 0.32 C ATOM 957 ND1 HIS F 60 -40.271 12.766 11.126 1.00 0.31 N ATOM 958 CD2 HIS F 60 -41.526 12.327 9.372 1.00 0.41 C ATOM 959 CE1 HIS F 60 -39.482 12.539 10.061 1.00 0.36 C ATOM 960 NE2 HIS F 60 -40.196 12.267 8.965 1.00 0.42 N ATOM 0 H HIS F 60 -43.760 9.991 11.036 1.00 0.32 H new ATOM 0 HA HIS F 60 -42.369 11.378 13.198 1.00 0.29 H new ATOM 0 HB2 HIS F 60 -43.621 13.162 11.090 1.00 0.34 H new ATOM 0 HB3 HIS F 60 -42.512 13.601 12.374 1.00 0.34 H new ATOM 0 HD2 HIS F 60 -42.380 12.157 8.734 1.00 0.41 H new ATOM 0 HE1 HIS F 60 -38.403 12.572 10.088 1.00 0.36 H new ATOM 0 HE2 HIS F 60 -39.843 12.060 8.031 1.00 0.42 H new ATOM 968 N TYR F 61 -44.660 12.067 14.077 1.00 0.27 N ATOM 969 CA TYR F 61 -46.024 12.182 14.661 1.00 0.31 C ATOM 970 C TYR F 61 -46.219 13.613 15.167 1.00 0.30 C ATOM 971 O TYR F 61 -45.857 13.947 16.278 1.00 0.32 O ATOM 972 CB TYR F 61 -46.176 11.191 15.819 1.00 0.34 C ATOM 973 CG TYR F 61 -46.535 9.831 15.270 1.00 0.43 C ATOM 974 CD1 TYR F 61 -45.525 8.941 14.888 1.00 0.70 C ATOM 975 CD2 TYR F 61 -47.879 9.461 15.144 1.00 1.16 C ATOM 976 CE1 TYR F 61 -45.859 7.681 14.378 1.00 0.79 C ATOM 977 CE2 TYR F 61 -48.214 8.201 14.634 1.00 1.37 C ATOM 978 CZ TYR F 61 -47.203 7.311 14.251 1.00 0.92 C ATOM 979 OH TYR F 61 -47.533 6.069 13.748 1.00 1.19 O ATOM 0 H TYR F 61 -43.905 12.402 14.676 1.00 0.27 H new ATOM 0 HA TYR F 61 -46.775 11.952 13.905 1.00 0.31 H new ATOM 0 HB2 TYR F 61 -45.247 11.133 16.387 1.00 0.34 H new ATOM 0 HB3 TYR F 61 -46.949 11.534 16.507 1.00 0.34 H new ATOM 0 HD1 TYR F 61 -44.488 9.226 14.987 1.00 0.70 H new ATOM 0 HD2 TYR F 61 -48.658 10.148 15.440 1.00 1.16 H new ATOM 0 HE1 TYR F 61 -45.080 6.994 14.082 1.00 0.79 H new ATOM 0 HE2 TYR F 61 -49.251 7.916 14.536 1.00 1.37 H new ATOM 0 HH TYR F 61 -48.508 5.973 13.727 1.00 1.19 H new ATOM 989 N LYS F 62 -46.775 14.463 14.347 1.00 0.31 N ATOM 990 CA LYS F 62 -46.984 15.880 14.756 1.00 0.30 C ATOM 991 C LYS F 62 -47.690 15.938 16.110 1.00 0.31 C ATOM 992 O LYS F 62 -48.802 15.474 16.265 1.00 0.35 O ATOM 993 CB LYS F 62 -47.838 16.587 13.702 1.00 0.36 C ATOM 994 CG LYS F 62 -48.014 18.057 14.082 1.00 0.58 C ATOM 995 CD LYS F 62 -49.418 18.273 14.649 1.00 1.05 C ATOM 996 CE LYS F 62 -50.424 18.353 13.498 1.00 1.35 C ATOM 997 NZ LYS F 62 -51.653 17.591 13.859 1.00 1.86 N ATOM 0 H LYS F 62 -47.095 14.235 13.406 1.00 0.31 H new ATOM 0 HA LYS F 62 -46.017 16.376 14.841 1.00 0.30 H new ATOM 0 HB2 LYS F 62 -47.364 16.509 12.724 1.00 0.36 H new ATOM 0 HB3 LYS F 62 -48.811 16.103 13.624 1.00 0.36 H new ATOM 0 HG2 LYS F 62 -47.264 18.345 14.819 1.00 0.58 H new ATOM 0 HG3 LYS F 62 -47.862 18.690 13.208 1.00 0.58 H new ATOM 0 HD2 LYS F 62 -49.681 17.455 15.320 1.00 1.05 H new ATOM 0 HD3 LYS F 62 -49.448 19.190 15.237 1.00 1.05 H new ATOM 0 HE2 LYS F 62 -50.676 19.393 13.292 1.00 1.35 H new ATOM 0 HE3 LYS F 62 -49.985 17.945 12.588 1.00 1.35 H new ATOM 0 HZ1 LYS F 62 -52.445 17.908 13.264 1.00 1.86 H new ATOM 0 HZ2 LYS F 62 -51.490 16.575 13.705 1.00 1.86 H new ATOM 0 HZ3 LYS F 62 -51.883 17.757 14.860 1.00 1.86 H new ATOM 1011 N ILE F 63 -47.049 16.513 17.090 1.00 0.31 N ATOM 1012 CA ILE F 63 -47.676 16.613 18.436 1.00 0.35 C ATOM 1013 C ILE F 63 -48.469 17.919 18.528 1.00 0.35 C ATOM 1014 O ILE F 63 -48.031 18.958 18.076 1.00 0.57 O ATOM 1015 CB ILE F 63 -46.579 16.595 19.512 1.00 0.38 C ATOM 1016 CG1 ILE F 63 -46.202 15.146 19.826 1.00 0.42 C ATOM 1017 CG2 ILE F 63 -47.079 17.265 20.798 1.00 0.47 C ATOM 1018 CD1 ILE F 63 -44.717 14.931 19.543 1.00 0.98 C ATOM 0 H ILE F 63 -46.116 16.918 17.015 1.00 0.31 H new ATOM 0 HA ILE F 63 -48.348 15.769 18.593 1.00 0.35 H new ATOM 0 HB ILE F 63 -45.713 17.140 19.137 1.00 0.38 H new ATOM 0 HG12 ILE F 63 -46.420 14.921 20.870 1.00 0.42 H new ATOM 0 HG13 ILE F 63 -46.800 14.465 19.221 1.00 0.42 H new ATOM 0 HG21 ILE F 63 -46.290 17.244 21.550 1.00 0.47 H new ATOM 0 HG22 ILE F 63 -47.352 18.299 20.587 1.00 0.47 H new ATOM 0 HG23 ILE F 63 -47.951 16.729 21.172 1.00 0.47 H new ATOM 0 HD11 ILE F 63 -44.450 13.898 19.767 1.00 0.98 H new ATOM 0 HD12 ILE F 63 -44.513 15.139 18.493 1.00 0.98 H new ATOM 0 HD13 ILE F 63 -44.127 15.602 20.167 1.00 0.98 H new ATOM 1030 N ARG F 64 -49.622 17.872 19.129 1.00 0.37 N ATOM 1031 CA ARG F 64 -50.436 19.107 19.277 1.00 0.44 C ATOM 1032 C ARG F 64 -50.442 19.499 20.751 1.00 0.37 C ATOM 1033 O ARG F 64 -49.809 18.861 21.569 1.00 0.69 O ATOM 1034 CB ARG F 64 -51.868 18.843 18.809 1.00 0.60 C ATOM 1035 CG ARG F 64 -52.278 19.907 17.789 1.00 1.09 C ATOM 1036 CD ARG F 64 -51.214 20.001 16.694 1.00 1.02 C ATOM 1037 NE ARG F 64 -51.858 20.399 15.410 1.00 1.36 N ATOM 1038 CZ ARG F 64 -52.346 21.601 15.268 1.00 1.54 C ATOM 1039 NH1 ARG F 64 -52.061 22.530 16.139 1.00 1.85 N ATOM 1040 NH2 ARG F 64 -53.121 21.874 14.253 1.00 2.17 N ATOM 0 H ARG F 64 -50.037 17.029 19.525 1.00 0.37 H new ATOM 0 HA ARG F 64 -50.013 19.910 18.673 1.00 0.44 H new ATOM 0 HB2 ARG F 64 -51.939 17.851 18.363 1.00 0.60 H new ATOM 0 HB3 ARG F 64 -52.549 18.859 19.660 1.00 0.60 H new ATOM 0 HG2 ARG F 64 -53.244 19.654 17.352 1.00 1.09 H new ATOM 0 HG3 ARG F 64 -52.394 20.872 18.282 1.00 1.09 H new ATOM 0 HD2 ARG F 64 -50.453 20.730 16.973 1.00 1.02 H new ATOM 0 HD3 ARG F 64 -50.710 19.042 16.578 1.00 1.02 H new ATOM 0 HE ARG F 64 -51.917 19.731 14.641 1.00 1.36 H new ATOM 0 HH11 ARG F 64 -51.456 22.317 16.932 1.00 1.85 H new ATOM 0 HH12 ARG F 64 -52.443 23.469 16.027 1.00 1.85 H new ATOM 0 HH21 ARG F 64 -53.344 21.148 13.572 1.00 2.17 H new ATOM 0 HH22 ARG F 64 -53.503 22.813 14.141 1.00 2.17 H new ATOM 1054 N LYS F 65 -51.143 20.534 21.109 1.00 0.52 N ATOM 1055 CA LYS F 65 -51.161 20.935 22.540 1.00 0.48 C ATOM 1056 C LYS F 65 -52.431 21.720 22.852 1.00 0.49 C ATOM 1057 O LYS F 65 -52.789 22.651 22.159 1.00 0.61 O ATOM 1058 CB LYS F 65 -49.940 21.805 22.840 1.00 0.75 C ATOM 1059 CG LYS F 65 -50.026 22.327 24.276 1.00 0.86 C ATOM 1060 CD LYS F 65 -49.006 23.451 24.472 1.00 1.24 C ATOM 1061 CE LYS F 65 -49.601 24.527 25.382 1.00 1.93 C ATOM 1062 NZ LYS F 65 -49.097 25.866 24.963 1.00 2.57 N ATOM 0 H LYS F 65 -51.699 21.115 20.481 1.00 0.52 H new ATOM 0 HA LYS F 65 -51.137 20.038 23.159 1.00 0.48 H new ATOM 0 HB2 LYS F 65 -49.026 21.226 22.706 1.00 0.75 H new ATOM 0 HB3 LYS F 65 -49.894 22.640 22.140 1.00 0.75 H new ATOM 0 HG2 LYS F 65 -51.032 22.694 24.481 1.00 0.86 H new ATOM 0 HG3 LYS F 65 -49.832 21.518 24.981 1.00 0.86 H new ATOM 0 HD2 LYS F 65 -48.091 23.054 24.911 1.00 1.24 H new ATOM 0 HD3 LYS F 65 -48.736 23.883 23.509 1.00 1.24 H new ATOM 0 HE2 LYS F 65 -50.689 24.503 25.328 1.00 1.93 H new ATOM 0 HE3 LYS F 65 -49.329 24.332 26.419 1.00 1.93 H new ATOM 0 HZ1 LYS F 65 -49.501 26.598 25.581 1.00 2.57 H new ATOM 0 HZ2 LYS F 65 -48.060 25.885 25.036 1.00 2.57 H new ATOM 0 HZ3 LYS F 65 -49.378 26.050 23.979 1.00 2.57 H new ATOM 1076 N LEU F 66 -53.106 21.356 23.905 1.00 0.49 N ATOM 1077 CA LEU F 66 -54.348 22.087 24.282 1.00 0.67 C ATOM 1078 C LEU F 66 -53.968 23.443 24.860 1.00 0.80 C ATOM 1079 O LEU F 66 -52.962 23.586 25.525 1.00 1.03 O ATOM 1080 CB LEU F 66 -55.119 21.296 25.346 1.00 0.92 C ATOM 1081 CG LEU F 66 -55.869 20.116 24.714 1.00 1.02 C ATOM 1082 CD1 LEU F 66 -56.500 20.531 23.385 1.00 1.44 C ATOM 1083 CD2 LEU F 66 -54.896 18.966 24.465 1.00 1.27 C ATOM 0 H LEU F 66 -52.852 20.584 24.521 1.00 0.49 H new ATOM 0 HA LEU F 66 -54.974 22.212 23.398 1.00 0.67 H new ATOM 0 HB2 LEU F 66 -54.427 20.929 26.104 1.00 0.92 H new ATOM 0 HB3 LEU F 66 -55.827 21.953 25.852 1.00 0.92 H new ATOM 0 HG LEU F 66 -56.656 19.799 25.399 1.00 1.02 H new ATOM 0 HD11 LEU F 66 -57.028 19.681 22.952 1.00 1.44 H new ATOM 0 HD12 LEU F 66 -57.203 21.346 23.555 1.00 1.44 H new ATOM 0 HD13 LEU F 66 -55.720 20.862 22.699 1.00 1.44 H new ATOM 0 HD21 LEU F 66 -55.430 18.128 24.016 1.00 1.27 H new ATOM 0 HD22 LEU F 66 -54.107 19.297 23.790 1.00 1.27 H new ATOM 0 HD23 LEU F 66 -54.456 18.651 25.411 1.00 1.27 H new ATOM 1095 N ASP F 67 -54.773 24.438 24.630 1.00 0.88 N ATOM 1096 CA ASP F 67 -54.467 25.774 25.197 1.00 1.11 C ATOM 1097 C ASP F 67 -54.702 25.702 26.700 1.00 1.32 C ATOM 1098 O ASP F 67 -54.219 26.515 27.463 1.00 1.60 O ATOM 1099 CB ASP F 67 -55.396 26.815 24.582 1.00 1.20 C ATOM 1100 CG ASP F 67 -54.600 27.721 23.640 1.00 1.45 C ATOM 1101 OD1 ASP F 67 -53.503 27.339 23.269 1.00 2.02 O ATOM 1102 OD2 ASP F 67 -55.102 28.782 23.306 1.00 1.62 O ATOM 0 H ASP F 67 -55.627 24.383 24.075 1.00 0.88 H new ATOM 0 HA ASP F 67 -53.436 26.056 24.983 1.00 1.11 H new ATOM 0 HB2 ASP F 67 -56.200 26.322 24.035 1.00 1.20 H new ATOM 0 HB3 ASP F 67 -55.862 27.410 25.367 1.00 1.20 H new ATOM 1107 N ASN F 68 -55.433 24.709 27.125 1.00 1.36 N ATOM 1108 CA ASN F 68 -55.698 24.543 28.577 1.00 1.77 C ATOM 1109 C ASN F 68 -54.540 23.761 29.192 1.00 1.90 C ATOM 1110 O ASN F 68 -54.448 23.601 30.393 1.00 2.29 O ATOM 1111 CB ASN F 68 -56.993 23.755 28.769 1.00 1.96 C ATOM 1112 CG ASN F 68 -58.150 24.502 28.103 1.00 1.95 C ATOM 1113 OD1 ASN F 68 -58.633 25.486 28.626 1.00 2.15 O ATOM 1114 ND2 ASN F 68 -58.618 24.072 26.963 1.00 2.02 N ATOM 0 H ASN F 68 -55.859 24.003 26.524 1.00 1.36 H new ATOM 0 HA ASN F 68 -55.793 25.518 29.055 1.00 1.77 H new ATOM 0 HB2 ASN F 68 -56.893 22.759 28.337 1.00 1.96 H new ATOM 0 HB3 ASN F 68 -57.196 23.622 29.832 1.00 1.96 H new ATOM 0 HD21 ASN F 68 -59.390 24.562 26.511 1.00 2.02 H new ATOM 0 HD22 ASN F 68 -58.212 23.246 26.524 1.00 2.02 H new ATOM 1121 N GLY F 69 -53.658 23.266 28.368 1.00 1.63 N ATOM 1122 CA GLY F 69 -52.511 22.487 28.885 1.00 1.86 C ATOM 1123 C GLY F 69 -52.785 20.998 28.675 1.00 0.98 C ATOM 1124 O GLY F 69 -53.270 20.316 29.556 1.00 1.35 O ATOM 0 H GLY F 69 -53.688 23.371 27.354 1.00 1.63 H new ATOM 0 HA2 GLY F 69 -51.596 22.778 28.369 1.00 1.86 H new ATOM 0 HA3 GLY F 69 -52.361 22.696 29.944 1.00 1.86 H new ATOM 1128 N GLY F 70 -52.485 20.490 27.512 1.00 0.68 N ATOM 1129 CA GLY F 70 -52.732 19.057 27.242 1.00 0.86 C ATOM 1130 C GLY F 70 -51.895 18.604 26.041 1.00 0.72 C ATOM 1131 O GLY F 70 -52.362 18.598 24.923 1.00 1.01 O ATOM 0 H GLY F 70 -52.078 21.013 26.737 1.00 0.68 H new ATOM 0 HA2 GLY F 70 -52.477 18.463 28.120 1.00 0.86 H new ATOM 0 HA3 GLY F 70 -53.791 18.892 27.042 1.00 0.86 H new ATOM 1135 N TYR F 71 -50.662 18.224 26.254 1.00 0.47 N ATOM 1136 CA TYR F 71 -49.823 17.771 25.105 1.00 0.45 C ATOM 1137 C TYR F 71 -50.329 16.408 24.616 1.00 0.43 C ATOM 1138 O TYR F 71 -50.371 15.452 25.363 1.00 0.68 O ATOM 1139 CB TYR F 71 -48.366 17.619 25.560 1.00 0.59 C ATOM 1140 CG TYR F 71 -47.570 18.865 25.244 1.00 0.54 C ATOM 1141 CD1 TYR F 71 -47.766 19.549 24.039 1.00 1.14 C ATOM 1142 CD2 TYR F 71 -46.622 19.329 26.162 1.00 1.19 C ATOM 1143 CE1 TYR F 71 -47.014 20.697 23.757 1.00 1.23 C ATOM 1144 CE2 TYR F 71 -45.873 20.474 25.884 1.00 1.12 C ATOM 1145 CZ TYR F 71 -46.068 21.160 24.680 1.00 0.58 C ATOM 1146 OH TYR F 71 -45.327 22.291 24.402 1.00 0.64 O ATOM 0 H TYR F 71 -50.203 18.208 27.165 1.00 0.47 H new ATOM 0 HA TYR F 71 -49.885 18.506 24.302 1.00 0.45 H new ATOM 0 HB2 TYR F 71 -48.334 17.424 26.632 1.00 0.59 H new ATOM 0 HB3 TYR F 71 -47.914 16.759 25.066 1.00 0.59 H new ATOM 0 HD1 TYR F 71 -48.496 19.192 23.327 1.00 1.14 H new ATOM 0 HD2 TYR F 71 -46.469 18.799 27.090 1.00 1.19 H new ATOM 0 HE1 TYR F 71 -47.164 21.225 22.827 1.00 1.23 H new ATOM 0 HE2 TYR F 71 -45.144 20.830 26.597 1.00 1.12 H new ATOM 0 HH TYR F 71 -44.620 22.069 23.760 1.00 0.64 H new ATOM 1156 N TYR F 72 -50.707 16.302 23.370 1.00 0.30 N ATOM 1157 CA TYR F 72 -51.200 14.988 22.858 1.00 0.27 C ATOM 1158 C TYR F 72 -50.823 14.821 21.385 1.00 0.29 C ATOM 1159 O TYR F 72 -51.132 15.659 20.563 1.00 0.35 O ATOM 1160 CB TYR F 72 -52.729 14.923 22.968 1.00 0.30 C ATOM 1161 CG TYR F 72 -53.352 15.945 22.046 1.00 0.30 C ATOM 1162 CD1 TYR F 72 -53.650 15.612 20.720 1.00 1.00 C ATOM 1163 CD2 TYR F 72 -53.624 17.230 22.519 1.00 1.12 C ATOM 1164 CE1 TYR F 72 -54.217 16.560 19.869 1.00 1.05 C ATOM 1165 CE2 TYR F 72 -54.193 18.184 21.668 1.00 1.12 C ATOM 1166 CZ TYR F 72 -54.490 17.849 20.341 1.00 0.41 C ATOM 1167 OH TYR F 72 -55.050 18.789 19.500 1.00 0.50 O ATOM 0 H TYR F 72 -50.697 17.061 22.689 1.00 0.30 H new ATOM 0 HA TYR F 72 -50.744 14.197 23.454 1.00 0.27 H new ATOM 0 HB2 TYR F 72 -53.079 13.924 22.708 1.00 0.30 H new ATOM 0 HB3 TYR F 72 -53.037 15.112 23.996 1.00 0.30 H new ATOM 0 HD1 TYR F 72 -53.440 14.618 20.355 1.00 1.00 H new ATOM 0 HD2 TYR F 72 -53.395 17.488 23.542 1.00 1.12 H new ATOM 0 HE1 TYR F 72 -54.445 16.300 18.846 1.00 1.05 H new ATOM 0 HE2 TYR F 72 -54.403 19.178 22.034 1.00 1.12 H new ATOM 0 HH TYR F 72 -55.175 19.630 19.987 1.00 0.50 H new ATOM 1177 N ILE F 73 -50.206 13.730 21.023 1.00 0.29 N ATOM 1178 CA ILE F 73 -49.900 13.527 19.581 1.00 0.36 C ATOM 1179 C ILE F 73 -51.210 13.087 18.940 1.00 0.37 C ATOM 1180 O ILE F 73 -51.487 13.347 17.786 1.00 0.43 O ATOM 1181 CB ILE F 73 -48.828 12.448 19.391 1.00 0.40 C ATOM 1182 CG1 ILE F 73 -47.876 12.451 20.592 1.00 0.77 C ATOM 1183 CG2 ILE F 73 -48.046 12.742 18.110 1.00 0.87 C ATOM 1184 CD1 ILE F 73 -46.689 11.524 20.315 1.00 0.63 C ATOM 0 H ILE F 73 -49.906 12.984 21.650 1.00 0.29 H new ATOM 0 HA ILE F 73 -49.510 14.439 19.129 1.00 0.36 H new ATOM 0 HB ILE F 73 -49.300 11.469 19.315 1.00 0.40 H new ATOM 0 HG12 ILE F 73 -47.521 13.464 20.784 1.00 0.77 H new ATOM 0 HG13 ILE F 73 -48.404 12.123 21.487 1.00 0.77 H new ATOM 0 HG21 ILE F 73 -47.281 11.979 17.967 1.00 0.87 H new ATOM 0 HG22 ILE F 73 -48.727 12.737 17.259 1.00 0.87 H new ATOM 0 HG23 ILE F 73 -47.572 13.720 18.190 1.00 0.87 H new ATOM 0 HD11 ILE F 73 -46.015 11.530 21.172 1.00 0.63 H new ATOM 0 HD12 ILE F 73 -47.051 10.510 20.145 1.00 0.63 H new ATOM 0 HD13 ILE F 73 -46.155 11.871 19.431 1.00 0.63 H new ATOM 1196 N THR F 74 -52.039 12.464 19.732 1.00 0.34 N ATOM 1197 CA THR F 74 -53.376 12.030 19.266 1.00 0.38 C ATOM 1198 C THR F 74 -54.372 12.525 20.305 1.00 0.37 C ATOM 1199 O THR F 74 -54.096 12.529 21.487 1.00 0.33 O ATOM 1200 CB THR F 74 -53.449 10.504 19.136 1.00 0.40 C ATOM 1201 OG1 THR F 74 -54.659 10.034 19.707 1.00 0.43 O ATOM 1202 CG2 THR F 74 -52.265 9.851 19.852 1.00 0.37 C ATOM 0 H THR F 74 -51.836 12.235 20.705 1.00 0.34 H new ATOM 0 HA THR F 74 -53.593 12.438 18.279 1.00 0.38 H new ATOM 0 HB THR F 74 -53.414 10.242 18.079 1.00 0.40 H new ATOM 0 HG1 THR F 74 -54.704 9.059 19.621 1.00 0.43 H new ATOM 0 HG21 THR F 74 -52.331 8.768 19.751 1.00 0.37 H new ATOM 0 HG22 THR F 74 -51.333 10.201 19.408 1.00 0.37 H new ATOM 0 HG23 THR F 74 -52.286 10.119 20.908 1.00 0.37 H new ATOM 1210 N THR F 75 -55.503 12.986 19.880 1.00 0.46 N ATOM 1211 CA THR F 75 -56.491 13.532 20.856 1.00 0.52 C ATOM 1212 C THR F 75 -56.983 12.439 21.804 1.00 0.54 C ATOM 1213 O THR F 75 -57.688 12.706 22.757 1.00 0.63 O ATOM 1214 CB THR F 75 -57.661 14.140 20.094 1.00 0.65 C ATOM 1215 OG1 THR F 75 -58.377 13.114 19.421 1.00 0.70 O ATOM 1216 CG2 THR F 75 -57.111 15.142 19.080 1.00 0.72 C ATOM 0 H THR F 75 -55.794 13.012 18.903 1.00 0.46 H new ATOM 0 HA THR F 75 -56.008 14.301 21.459 1.00 0.52 H new ATOM 0 HB THR F 75 -58.337 14.644 20.784 1.00 0.65 H new ATOM 0 HG1 THR F 75 -59.130 13.507 18.933 1.00 0.70 H new ATOM 0 HG21 THR F 75 -57.936 15.588 18.525 1.00 0.72 H new ATOM 0 HG22 THR F 75 -56.561 15.924 19.603 1.00 0.72 H new ATOM 0 HG23 THR F 75 -56.443 14.630 18.388 1.00 0.72 H new ATOM 1224 N ARG F 76 -56.611 11.216 21.566 1.00 0.50 N ATOM 1225 CA ARG F 76 -57.049 10.122 22.468 1.00 0.57 C ATOM 1226 C ARG F 76 -56.351 10.273 23.823 1.00 0.58 C ATOM 1227 O ARG F 76 -56.779 9.713 24.813 1.00 0.71 O ATOM 1228 CB ARG F 76 -56.681 8.771 21.850 1.00 0.60 C ATOM 1229 CG ARG F 76 -56.988 7.653 22.848 1.00 1.12 C ATOM 1230 CD ARG F 76 -57.283 6.358 22.088 1.00 1.51 C ATOM 1231 NE ARG F 76 -58.665 5.900 22.406 1.00 2.13 N ATOM 1232 CZ ARG F 76 -58.857 4.716 22.920 1.00 2.77 C ATOM 1233 NH1 ARG F 76 -58.773 3.655 22.165 1.00 3.37 N ATOM 1234 NH2 ARG F 76 -59.134 4.593 24.190 1.00 3.31 N ATOM 0 H ARG F 76 -56.022 10.927 20.785 1.00 0.50 H new ATOM 0 HA ARG F 76 -58.129 10.173 22.606 1.00 0.57 H new ATOM 0 HB2 ARG F 76 -57.243 8.615 20.929 1.00 0.60 H new ATOM 0 HB3 ARG F 76 -55.624 8.756 21.585 1.00 0.60 H new ATOM 0 HG2 ARG F 76 -56.142 7.508 23.520 1.00 1.12 H new ATOM 0 HG3 ARG F 76 -57.843 7.927 23.466 1.00 1.12 H new ATOM 0 HD2 ARG F 76 -57.180 6.522 21.015 1.00 1.51 H new ATOM 0 HD3 ARG F 76 -56.561 5.589 22.364 1.00 1.51 H new ATOM 0 HE ARG F 76 -59.460 6.512 22.222 1.00 2.13 H new ATOM 0 HH11 ARG F 76 -58.557 3.751 21.173 1.00 3.37 H new ATOM 0 HH12 ARG F 76 -58.923 2.730 22.567 1.00 3.37 H new ATOM 0 HH21 ARG F 76 -59.200 5.422 24.780 1.00 3.31 H new ATOM 0 HH22 ARG F 76 -59.284 3.668 24.592 1.00 3.31 H new ATOM 1248 N ALA F 77 -55.275 11.020 23.882 1.00 0.49 N ATOM 1249 CA ALA F 77 -54.569 11.182 25.188 1.00 0.58 C ATOM 1250 C ALA F 77 -53.667 12.426 25.176 1.00 0.47 C ATOM 1251 O ALA F 77 -52.849 12.609 24.297 1.00 0.43 O ATOM 1252 CB ALA F 77 -53.711 9.944 25.451 1.00 0.68 C ATOM 0 H ALA F 77 -54.861 11.517 23.094 1.00 0.49 H new ATOM 0 HA ALA F 77 -55.316 11.302 25.973 1.00 0.58 H new ATOM 0 HB1 ALA F 77 -53.193 10.056 26.403 1.00 0.68 H new ATOM 0 HB2 ALA F 77 -54.348 9.060 25.486 1.00 0.68 H new ATOM 0 HB3 ALA F 77 -52.979 9.832 24.651 1.00 0.68 H new ATOM 1258 N GLN F 78 -53.802 13.263 26.172 1.00 0.50 N ATOM 1259 CA GLN F 78 -52.956 14.483 26.273 1.00 0.46 C ATOM 1260 C GLN F 78 -52.218 14.446 27.614 1.00 0.50 C ATOM 1261 O GLN F 78 -52.443 13.574 28.429 1.00 0.55 O ATOM 1262 CB GLN F 78 -53.830 15.742 26.211 1.00 0.52 C ATOM 1263 CG GLN F 78 -55.207 15.456 26.813 1.00 0.78 C ATOM 1264 CD GLN F 78 -56.199 15.093 25.703 1.00 0.89 C ATOM 1265 OE1 GLN F 78 -57.396 15.190 25.891 1.00 1.84 O ATOM 1266 NE2 GLN F 78 -55.754 14.676 24.548 1.00 0.98 N ATOM 0 H GLN F 78 -54.474 13.148 26.930 1.00 0.50 H new ATOM 0 HA GLN F 78 -52.248 14.508 25.445 1.00 0.46 H new ATOM 0 HB2 GLN F 78 -53.349 16.555 26.754 1.00 0.52 H new ATOM 0 HB3 GLN F 78 -53.937 16.069 25.177 1.00 0.52 H new ATOM 0 HG2 GLN F 78 -55.137 14.639 27.531 1.00 0.78 H new ATOM 0 HG3 GLN F 78 -55.563 16.330 27.359 1.00 0.78 H new ATOM 0 HE21 GLN F 78 -54.750 14.594 24.388 1.00 0.98 H new ATOM 0 HE22 GLN F 78 -56.410 14.433 23.806 1.00 0.98 H new ATOM 1275 N PHE F 79 -51.337 15.378 27.852 1.00 0.53 N ATOM 1276 CA PHE F 79 -50.589 15.380 29.143 1.00 0.59 C ATOM 1277 C PHE F 79 -50.332 16.816 29.576 1.00 0.71 C ATOM 1278 O PHE F 79 -50.904 17.740 29.053 1.00 1.10 O ATOM 1279 CB PHE F 79 -49.259 14.651 28.962 1.00 0.54 C ATOM 1280 CG PHE F 79 -49.530 13.171 28.863 1.00 0.49 C ATOM 1281 CD1 PHE F 79 -50.094 12.647 27.697 1.00 1.06 C ATOM 1282 CD2 PHE F 79 -49.236 12.328 29.940 1.00 0.80 C ATOM 1283 CE1 PHE F 79 -50.364 11.281 27.603 1.00 1.16 C ATOM 1284 CE2 PHE F 79 -49.504 10.957 29.846 1.00 0.73 C ATOM 1285 CZ PHE F 79 -50.069 10.433 28.677 1.00 0.59 C ATOM 0 H PHE F 79 -51.102 16.136 27.211 1.00 0.53 H new ATOM 0 HA PHE F 79 -51.177 14.872 29.907 1.00 0.59 H new ATOM 0 HB2 PHE F 79 -48.754 15.004 28.063 1.00 0.54 H new ATOM 0 HB3 PHE F 79 -48.597 14.859 29.802 1.00 0.54 H new ATOM 0 HD1 PHE F 79 -50.321 13.300 26.867 1.00 1.06 H new ATOM 0 HD2 PHE F 79 -48.803 12.734 30.842 1.00 0.80 H new ATOM 0 HE1 PHE F 79 -50.801 10.878 26.701 1.00 1.16 H new ATOM 0 HE2 PHE F 79 -49.275 10.304 30.675 1.00 0.73 H new ATOM 0 HZ PHE F 79 -50.277 9.376 28.604 1.00 0.59 H new ATOM 1295 N GLU F 80 -49.491 17.020 30.538 1.00 0.58 N ATOM 1296 CA GLU F 80 -49.237 18.409 30.987 1.00 0.65 C ATOM 1297 C GLU F 80 -47.969 18.954 30.329 1.00 0.63 C ATOM 1298 O GLU F 80 -47.849 20.140 30.094 1.00 0.69 O ATOM 1299 CB GLU F 80 -49.082 18.421 32.506 1.00 0.73 C ATOM 1300 CG GLU F 80 -47.981 17.441 32.917 1.00 0.67 C ATOM 1301 CD GLU F 80 -48.573 16.361 33.825 1.00 1.25 C ATOM 1302 OE1 GLU F 80 -49.312 16.715 34.729 1.00 1.92 O ATOM 1303 OE2 GLU F 80 -48.276 15.199 33.601 1.00 1.70 O ATOM 0 H GLU F 80 -48.971 16.294 31.031 1.00 0.58 H new ATOM 0 HA GLU F 80 -50.076 19.042 30.698 1.00 0.65 H new ATOM 0 HB2 GLU F 80 -48.835 19.426 32.849 1.00 0.73 H new ATOM 0 HB3 GLU F 80 -50.024 18.145 32.980 1.00 0.73 H new ATOM 0 HG2 GLU F 80 -47.537 16.984 32.032 1.00 0.67 H new ATOM 0 HG3 GLU F 80 -47.183 17.971 33.437 1.00 0.67 H new ATOM 1310 N THR F 81 -47.016 18.114 30.038 1.00 0.57 N ATOM 1311 CA THR F 81 -45.763 18.620 29.408 1.00 0.58 C ATOM 1312 C THR F 81 -45.168 17.528 28.523 1.00 0.51 C ATOM 1313 O THR F 81 -45.742 16.470 28.353 1.00 0.45 O ATOM 1314 CB THR F 81 -44.764 19.011 30.507 1.00 0.62 C ATOM 1315 OG1 THR F 81 -43.461 18.578 30.159 1.00 0.60 O ATOM 1316 CG2 THR F 81 -45.162 18.336 31.803 1.00 0.61 C ATOM 0 H THR F 81 -47.048 17.109 30.207 1.00 0.57 H new ATOM 0 HA THR F 81 -45.982 19.496 28.797 1.00 0.58 H new ATOM 0 HB THR F 81 -44.771 20.095 30.621 1.00 0.62 H new ATOM 0 HG1 THR F 81 -42.947 19.336 29.809 1.00 0.60 H new ATOM 0 HG21 THR F 81 -44.456 18.610 32.587 1.00 0.61 H new ATOM 0 HG22 THR F 81 -46.164 18.657 32.088 1.00 0.61 H new ATOM 0 HG23 THR F 81 -45.153 17.254 31.668 1.00 0.61 H new ATOM 1324 N LEU F 82 -44.027 17.776 27.953 1.00 0.55 N ATOM 1325 CA LEU F 82 -43.405 16.753 27.075 1.00 0.52 C ATOM 1326 C LEU F 82 -42.627 15.766 27.935 1.00 0.51 C ATOM 1327 O LEU F 82 -42.482 14.614 27.593 1.00 0.51 O ATOM 1328 CB LEU F 82 -42.490 17.437 26.065 1.00 0.59 C ATOM 1329 CG LEU F 82 -43.351 18.328 25.169 1.00 0.48 C ATOM 1330 CD1 LEU F 82 -42.662 19.672 24.966 1.00 0.74 C ATOM 1331 CD2 LEU F 82 -43.564 17.654 23.813 1.00 0.78 C ATOM 0 H LEU F 82 -43.498 18.642 28.057 1.00 0.55 H new ATOM 0 HA LEU F 82 -44.174 16.209 26.526 1.00 0.52 H new ATOM 0 HB2 LEU F 82 -41.734 18.031 26.578 1.00 0.59 H new ATOM 0 HB3 LEU F 82 -41.961 16.695 25.467 1.00 0.59 H new ATOM 0 HG LEU F 82 -44.318 18.484 25.648 1.00 0.48 H new ATOM 0 HD11 LEU F 82 -43.279 20.304 24.327 1.00 0.74 H new ATOM 0 HD12 LEU F 82 -42.522 20.159 25.931 1.00 0.74 H new ATOM 0 HD13 LEU F 82 -41.692 19.516 24.494 1.00 0.74 H new ATOM 0 HD21 LEU F 82 -44.178 18.295 23.181 1.00 0.78 H new ATOM 0 HD22 LEU F 82 -42.599 17.488 23.333 1.00 0.78 H new ATOM 0 HD23 LEU F 82 -44.067 16.698 23.957 1.00 0.78 H new ATOM 1343 N GLN F 83 -42.152 16.203 29.063 1.00 0.53 N ATOM 1344 CA GLN F 83 -41.420 15.282 29.966 1.00 0.53 C ATOM 1345 C GLN F 83 -42.443 14.356 30.635 1.00 0.50 C ATOM 1346 O GLN F 83 -42.198 13.184 30.853 1.00 0.47 O ATOM 1347 CB GLN F 83 -40.682 16.090 31.036 1.00 0.57 C ATOM 1348 CG GLN F 83 -39.277 15.516 31.229 1.00 0.92 C ATOM 1349 CD GLN F 83 -39.135 14.983 32.656 1.00 1.40 C ATOM 1350 OE1 GLN F 83 -39.510 13.862 32.939 1.00 2.12 O ATOM 1351 NE2 GLN F 83 -38.606 15.744 33.575 1.00 2.00 N ATOM 0 H GLN F 83 -42.240 17.162 29.399 1.00 0.53 H new ATOM 0 HA GLN F 83 -40.693 14.698 29.402 1.00 0.53 H new ATOM 0 HB2 GLN F 83 -40.621 17.137 30.739 1.00 0.57 H new ATOM 0 HB3 GLN F 83 -41.232 16.057 31.976 1.00 0.57 H new ATOM 0 HG2 GLN F 83 -39.098 14.716 30.511 1.00 0.92 H new ATOM 0 HG3 GLN F 83 -38.529 16.286 31.041 1.00 0.92 H new ATOM 0 HE21 GLN F 83 -38.291 16.685 33.339 1.00 2.00 H new ATOM 0 HE22 GLN F 83 -38.508 15.398 34.529 1.00 2.00 H new ATOM 1360 N GLN F 84 -43.600 14.878 30.951 1.00 0.52 N ATOM 1361 CA GLN F 84 -44.648 14.036 31.596 1.00 0.51 C ATOM 1362 C GLN F 84 -45.231 13.066 30.568 1.00 0.48 C ATOM 1363 O GLN F 84 -45.564 11.941 30.884 1.00 0.51 O ATOM 1364 CB GLN F 84 -45.769 14.923 32.159 1.00 0.53 C ATOM 1365 CG GLN F 84 -45.348 15.599 33.486 1.00 0.60 C ATOM 1366 CD GLN F 84 -44.272 14.786 34.212 1.00 0.86 C ATOM 1367 OE1 GLN F 84 -44.568 14.024 35.111 1.00 1.50 O ATOM 1368 NE2 GLN F 84 -43.025 14.921 33.851 1.00 1.45 N ATOM 0 H GLN F 84 -43.863 15.850 30.790 1.00 0.52 H new ATOM 0 HA GLN F 84 -44.196 13.474 32.413 1.00 0.51 H new ATOM 0 HB2 GLN F 84 -46.031 15.688 31.428 1.00 0.53 H new ATOM 0 HB3 GLN F 84 -46.662 14.321 32.324 1.00 0.53 H new ATOM 0 HG2 GLN F 84 -44.972 16.602 33.282 1.00 0.60 H new ATOM 0 HG3 GLN F 84 -46.219 15.710 34.132 1.00 0.60 H new ATOM 0 HE21 GLN F 84 -42.779 15.561 33.096 1.00 1.45 H new ATOM 0 HE22 GLN F 84 -42.296 14.386 34.324 1.00 1.45 H new ATOM 1377 N LEU F 85 -45.350 13.480 29.339 1.00 0.44 N ATOM 1378 CA LEU F 85 -45.903 12.556 28.304 1.00 0.43 C ATOM 1379 C LEU F 85 -44.822 11.578 27.893 1.00 0.47 C ATOM 1380 O LEU F 85 -45.094 10.451 27.589 1.00 0.55 O ATOM 1381 CB LEU F 85 -46.419 13.359 27.096 1.00 0.43 C ATOM 1382 CG LEU F 85 -45.381 13.378 25.968 1.00 0.40 C ATOM 1383 CD1 LEU F 85 -45.718 12.295 24.943 1.00 0.41 C ATOM 1384 CD2 LEU F 85 -45.390 14.740 25.298 1.00 0.47 C ATOM 0 H LEU F 85 -45.092 14.409 29.005 1.00 0.44 H new ATOM 0 HA LEU F 85 -46.746 11.999 28.713 1.00 0.43 H new ATOM 0 HB2 LEU F 85 -47.348 12.920 26.733 1.00 0.43 H new ATOM 0 HB3 LEU F 85 -46.647 14.380 27.403 1.00 0.43 H new ATOM 0 HG LEU F 85 -44.391 13.185 26.380 1.00 0.40 H new ATOM 0 HD11 LEU F 85 -44.979 12.310 24.142 1.00 0.41 H new ATOM 0 HD12 LEU F 85 -45.708 11.319 25.428 1.00 0.41 H new ATOM 0 HD13 LEU F 85 -46.708 12.483 24.527 1.00 0.41 H new ATOM 0 HD21 LEU F 85 -44.652 14.756 24.496 1.00 0.47 H new ATOM 0 HD22 LEU F 85 -46.380 14.936 24.885 1.00 0.47 H new ATOM 0 HD23 LEU F 85 -45.144 15.508 26.031 1.00 0.47 H new ATOM 1396 N VAL F 86 -43.595 11.975 27.902 1.00 0.44 N ATOM 1397 CA VAL F 86 -42.556 11.001 27.541 1.00 0.49 C ATOM 1398 C VAL F 86 -42.490 10.015 28.701 1.00 0.49 C ATOM 1399 O VAL F 86 -42.021 8.900 28.588 1.00 0.54 O ATOM 1400 CB VAL F 86 -41.215 11.697 27.349 1.00 0.57 C ATOM 1401 CG1 VAL F 86 -41.352 12.746 26.246 1.00 0.65 C ATOM 1402 CG2 VAL F 86 -40.814 12.375 28.653 1.00 0.61 C ATOM 0 H VAL F 86 -43.271 12.913 28.139 1.00 0.44 H new ATOM 0 HA VAL F 86 -42.787 10.497 26.602 1.00 0.49 H new ATOM 0 HB VAL F 86 -40.453 10.970 27.068 1.00 0.57 H new ATOM 0 HG11 VAL F 86 -40.396 13.249 26.102 1.00 0.65 H new ATOM 0 HG12 VAL F 86 -41.650 12.260 25.317 1.00 0.65 H new ATOM 0 HG13 VAL F 86 -42.108 13.478 26.532 1.00 0.65 H new ATOM 0 HG21 VAL F 86 -39.854 12.875 28.523 1.00 0.61 H new ATOM 0 HG22 VAL F 86 -41.571 13.109 28.930 1.00 0.61 H new ATOM 0 HG23 VAL F 86 -40.729 11.627 29.441 1.00 0.61 H new ATOM 1412 N GLN F 87 -42.990 10.438 29.827 1.00 0.46 N ATOM 1413 CA GLN F 87 -43.005 9.567 31.022 1.00 0.50 C ATOM 1414 C GLN F 87 -44.063 8.484 30.848 1.00 0.50 C ATOM 1415 O GLN F 87 -43.866 7.335 31.190 1.00 0.54 O ATOM 1416 CB GLN F 87 -43.379 10.406 32.234 1.00 0.51 C ATOM 1417 CG GLN F 87 -43.251 9.556 33.494 1.00 0.57 C ATOM 1418 CD GLN F 87 -43.282 10.460 34.728 1.00 1.29 C ATOM 1419 OE1 GLN F 87 -42.582 11.451 34.787 1.00 1.94 O ATOM 1420 NE2 GLN F 87 -44.070 10.158 35.724 1.00 1.95 N ATOM 0 H GLN F 87 -43.393 11.364 29.967 1.00 0.46 H new ATOM 0 HA GLN F 87 -42.023 9.113 31.154 1.00 0.50 H new ATOM 0 HB2 GLN F 87 -42.728 11.278 32.302 1.00 0.51 H new ATOM 0 HB3 GLN F 87 -44.399 10.777 32.133 1.00 0.51 H new ATOM 0 HG2 GLN F 87 -44.064 8.832 33.541 1.00 0.57 H new ATOM 0 HG3 GLN F 87 -42.320 8.989 33.469 1.00 0.57 H new ATOM 0 HE21 GLN F 87 -44.658 9.326 35.675 1.00 1.95 H new ATOM 0 HE22 GLN F 87 -44.098 10.754 36.551 1.00 1.95 H new ATOM 1429 N HIS F 88 -45.194 8.863 30.335 1.00 0.47 N ATOM 1430 CA HIS F 88 -46.301 7.899 30.145 1.00 0.49 C ATOM 1431 C HIS F 88 -46.038 7.045 28.913 1.00 0.49 C ATOM 1432 O HIS F 88 -46.281 5.852 28.894 1.00 0.54 O ATOM 1433 CB HIS F 88 -47.597 8.678 29.947 1.00 0.47 C ATOM 1434 CG HIS F 88 -48.768 7.822 30.341 1.00 0.53 C ATOM 1435 ND1 HIS F 88 -49.126 7.623 31.665 1.00 1.26 N ATOM 1436 CD2 HIS F 88 -49.674 7.106 29.597 1.00 1.19 C ATOM 1437 CE1 HIS F 88 -50.204 6.818 31.678 1.00 1.04 C ATOM 1438 NE2 HIS F 88 -50.579 6.473 30.443 1.00 0.80 N ATOM 0 H HIS F 88 -45.400 9.816 30.035 1.00 0.47 H new ATOM 0 HA HIS F 88 -46.377 7.252 31.019 1.00 0.49 H new ATOM 0 HB2 HIS F 88 -47.581 9.588 30.547 1.00 0.47 H new ATOM 0 HB3 HIS F 88 -47.693 8.985 28.905 1.00 0.47 H new ATOM 0 HD2 HIS F 88 -49.682 7.044 28.519 1.00 1.19 H new ATOM 0 HE1 HIS F 88 -50.705 6.491 32.577 1.00 1.04 H new ATOM 0 HE2 HIS F 88 -51.361 5.874 30.177 1.00 0.80 H new ATOM 1446 N TYR F 89 -45.548 7.652 27.879 1.00 0.47 N ATOM 1447 CA TYR F 89 -45.278 6.885 26.641 1.00 0.51 C ATOM 1448 C TYR F 89 -44.093 5.949 26.883 1.00 0.57 C ATOM 1449 O TYR F 89 -43.921 4.953 26.209 1.00 0.63 O ATOM 1450 CB TYR F 89 -44.946 7.835 25.487 1.00 0.49 C ATOM 1451 CG TYR F 89 -46.184 8.566 25.028 1.00 0.50 C ATOM 1452 CD1 TYR F 89 -46.940 9.295 25.945 1.00 0.53 C ATOM 1453 CD2 TYR F 89 -46.563 8.531 23.680 1.00 0.67 C ATOM 1454 CE1 TYR F 89 -48.073 9.991 25.526 1.00 0.56 C ATOM 1455 CE2 TYR F 89 -47.702 9.226 23.257 1.00 0.71 C ATOM 1456 CZ TYR F 89 -48.458 9.957 24.181 1.00 0.57 C ATOM 1457 OH TYR F 89 -49.580 10.646 23.765 1.00 0.63 O ATOM 0 H TYR F 89 -45.322 8.646 27.836 1.00 0.47 H new ATOM 0 HA TYR F 89 -46.165 6.308 26.378 1.00 0.51 H new ATOM 0 HB2 TYR F 89 -44.190 8.553 25.806 1.00 0.49 H new ATOM 0 HB3 TYR F 89 -44.520 7.272 24.656 1.00 0.49 H new ATOM 0 HD1 TYR F 89 -46.647 9.321 26.984 1.00 0.53 H new ATOM 0 HD2 TYR F 89 -45.977 7.969 22.968 1.00 0.67 H new ATOM 0 HE1 TYR F 89 -48.654 10.557 26.240 1.00 0.56 H new ATOM 0 HE2 TYR F 89 -47.997 9.198 22.219 1.00 0.71 H new ATOM 0 HH TYR F 89 -49.704 10.517 22.801 1.00 0.63 H new ATOM 1467 N SER F 90 -43.278 6.264 27.848 1.00 0.59 N ATOM 1468 CA SER F 90 -42.106 5.406 28.149 1.00 0.68 C ATOM 1469 C SER F 90 -42.601 4.006 28.481 1.00 0.68 C ATOM 1470 O SER F 90 -41.957 3.017 28.189 1.00 0.77 O ATOM 1471 CB SER F 90 -41.343 5.979 29.345 1.00 0.76 C ATOM 1472 OG SER F 90 -40.036 6.355 28.938 1.00 0.89 O ATOM 0 H SER F 90 -43.376 7.086 28.444 1.00 0.59 H new ATOM 0 HA SER F 90 -41.439 5.370 27.287 1.00 0.68 H new ATOM 0 HB2 SER F 90 -41.872 6.843 29.747 1.00 0.76 H new ATOM 0 HB3 SER F 90 -41.288 5.239 30.143 1.00 0.76 H new ATOM 0 HG SER F 90 -39.548 6.724 29.704 1.00 0.89 H new ATOM 1478 N GLU F 91 -43.751 3.918 29.084 1.00 0.66 N ATOM 1479 CA GLU F 91 -44.307 2.589 29.433 1.00 0.73 C ATOM 1480 C GLU F 91 -45.339 2.189 28.379 1.00 0.69 C ATOM 1481 O GLU F 91 -45.759 1.051 28.315 1.00 0.75 O ATOM 1482 CB GLU F 91 -44.979 2.659 30.806 1.00 0.82 C ATOM 1483 CG GLU F 91 -44.111 3.486 31.757 1.00 1.32 C ATOM 1484 CD GLU F 91 -44.058 2.801 33.124 1.00 1.83 C ATOM 1485 OE1 GLU F 91 -44.932 1.993 33.394 1.00 1.79 O ATOM 1486 OE2 GLU F 91 -43.145 3.096 33.877 1.00 2.58 O ATOM 0 H GLU F 91 -44.330 4.714 29.350 1.00 0.66 H new ATOM 0 HA GLU F 91 -43.505 1.851 29.463 1.00 0.73 H new ATOM 0 HB2 GLU F 91 -45.968 3.108 30.716 1.00 0.82 H new ATOM 0 HB3 GLU F 91 -45.120 1.655 31.206 1.00 0.82 H new ATOM 0 HG2 GLU F 91 -43.105 3.590 31.351 1.00 1.32 H new ATOM 0 HG3 GLU F 91 -44.519 4.492 31.858 1.00 1.32 H new ATOM 1493 N ARG F 92 -45.760 3.112 27.551 1.00 0.62 N ATOM 1494 CA ARG F 92 -46.775 2.743 26.514 1.00 0.61 C ATOM 1495 C ARG F 92 -46.575 3.570 25.242 1.00 0.54 C ATOM 1496 O ARG F 92 -45.992 4.630 25.262 1.00 0.57 O ATOM 1497 CB ARG F 92 -48.178 3.000 27.068 1.00 0.64 C ATOM 1498 CG ARG F 92 -48.232 2.579 28.538 1.00 0.85 C ATOM 1499 CD ARG F 92 -49.681 2.621 29.027 1.00 1.09 C ATOM 1500 NE ARG F 92 -49.746 2.121 30.429 1.00 1.29 N ATOM 1501 CZ ARG F 92 -50.645 1.236 30.765 1.00 1.66 C ATOM 1502 NH1 ARG F 92 -51.912 1.550 30.737 1.00 2.12 N ATOM 1503 NH2 ARG F 92 -50.277 0.038 31.128 1.00 2.43 N ATOM 0 H ARG F 92 -45.454 4.085 27.545 1.00 0.62 H new ATOM 0 HA ARG F 92 -46.655 1.688 26.267 1.00 0.61 H new ATOM 0 HB2 ARG F 92 -48.431 4.056 26.972 1.00 0.64 H new ATOM 0 HB3 ARG F 92 -48.916 2.442 26.492 1.00 0.64 H new ATOM 0 HG2 ARG F 92 -47.826 1.574 28.655 1.00 0.85 H new ATOM 0 HG3 ARG F 92 -47.614 3.244 29.141 1.00 0.85 H new ATOM 0 HD2 ARG F 92 -50.064 3.640 28.975 1.00 1.09 H new ATOM 0 HD3 ARG F 92 -50.312 2.010 28.382 1.00 1.09 H new ATOM 0 HE ARG F 92 -49.088 2.470 31.126 1.00 1.29 H new ATOM 0 HH11 ARG F 92 -52.199 2.487 30.453 1.00 2.12 H new ATOM 0 HH12 ARG F 92 -52.615 0.859 30.999 1.00 2.12 H new ATOM 0 HH21 ARG F 92 -49.287 -0.207 31.149 1.00 2.43 H new ATOM 0 HH22 ARG F 92 -50.979 -0.654 31.391 1.00 2.43 H new ATOM 1517 N ALA F 93 -47.070 3.097 24.129 1.00 0.54 N ATOM 1518 CA ALA F 93 -46.919 3.872 22.865 1.00 0.54 C ATOM 1519 C ALA F 93 -47.947 5.003 22.862 1.00 0.51 C ATOM 1520 O ALA F 93 -47.695 6.076 22.356 1.00 0.60 O ATOM 1521 CB ALA F 93 -47.162 2.957 21.660 1.00 0.59 C ATOM 0 H ALA F 93 -47.570 2.212 24.041 1.00 0.54 H new ATOM 0 HA ALA F 93 -45.910 4.280 22.800 1.00 0.54 H new ATOM 0 HB1 ALA F 93 -47.050 3.530 20.740 1.00 0.59 H new ATOM 0 HB2 ALA F 93 -46.438 2.142 21.670 1.00 0.59 H new ATOM 0 HB3 ALA F 93 -48.171 2.547 21.712 1.00 0.59 H new ATOM 1527 N ALA F 94 -49.102 4.751 23.428 1.00 0.57 N ATOM 1528 CA ALA F 94 -50.187 5.776 23.486 1.00 0.71 C ATOM 1529 C ALA F 94 -51.111 5.595 22.286 1.00 0.75 C ATOM 1530 O ALA F 94 -52.245 6.032 22.294 1.00 0.94 O ATOM 1531 CB ALA F 94 -49.603 7.190 23.480 1.00 0.80 C ATOM 0 H ALA F 94 -49.342 3.859 23.861 1.00 0.57 H new ATOM 0 HA ALA F 94 -50.747 5.643 24.411 1.00 0.71 H new ATOM 0 HB1 ALA F 94 -50.413 7.918 23.523 1.00 0.80 H new ATOM 0 HB2 ALA F 94 -48.953 7.319 24.345 1.00 0.80 H new ATOM 0 HB3 ALA F 94 -49.027 7.342 22.567 1.00 0.80 H new ATOM 1537 N GLY F 95 -50.647 4.941 21.256 1.00 0.67 N ATOM 1538 CA GLY F 95 -51.522 4.731 20.074 1.00 0.82 C ATOM 1539 C GLY F 95 -50.715 4.831 18.777 1.00 0.73 C ATOM 1540 O GLY F 95 -51.140 4.357 17.742 1.00 0.82 O ATOM 0 H GLY F 95 -49.709 4.547 21.184 1.00 0.67 H new ATOM 0 HA2 GLY F 95 -51.998 3.752 20.137 1.00 0.82 H new ATOM 0 HA3 GLY F 95 -52.320 5.474 20.070 1.00 0.82 H new ATOM 1544 N LEU F 96 -49.563 5.448 18.805 1.00 0.67 N ATOM 1545 CA LEU F 96 -48.772 5.565 17.552 1.00 0.69 C ATOM 1546 C LEU F 96 -48.031 4.252 17.275 1.00 0.76 C ATOM 1547 O LEU F 96 -48.014 3.349 18.088 1.00 0.93 O ATOM 1548 CB LEU F 96 -47.782 6.726 17.673 1.00 0.66 C ATOM 1549 CG LEU F 96 -46.575 6.321 18.516 1.00 0.70 C ATOM 1550 CD1 LEU F 96 -45.666 7.534 18.688 1.00 0.69 C ATOM 1551 CD2 LEU F 96 -47.023 5.838 19.892 1.00 1.09 C ATOM 0 H LEU F 96 -49.142 5.870 19.633 1.00 0.67 H new ATOM 0 HA LEU F 96 -49.445 5.764 16.718 1.00 0.69 H new ATOM 0 HB2 LEU F 96 -47.452 7.034 16.681 1.00 0.66 H new ATOM 0 HB3 LEU F 96 -48.276 7.586 18.126 1.00 0.66 H new ATOM 0 HG LEU F 96 -46.044 5.513 18.013 1.00 0.70 H new ATOM 0 HD11 LEU F 96 -44.800 7.257 19.289 1.00 0.69 H new ATOM 0 HD12 LEU F 96 -45.333 7.881 17.710 1.00 0.69 H new ATOM 0 HD13 LEU F 96 -46.215 8.332 19.189 1.00 0.69 H new ATOM 0 HD21 LEU F 96 -46.150 5.553 20.480 1.00 1.09 H new ATOM 0 HD22 LEU F 96 -47.558 6.639 20.402 1.00 1.09 H new ATOM 0 HD23 LEU F 96 -47.681 4.976 19.779 1.00 1.09 H new ATOM 1563 N SER F 97 -47.443 4.138 16.116 1.00 0.90 N ATOM 1564 CA SER F 97 -46.722 2.885 15.745 1.00 1.00 C ATOM 1565 C SER F 97 -45.834 2.413 16.894 1.00 0.87 C ATOM 1566 O SER F 97 -45.827 1.251 17.248 1.00 1.01 O ATOM 1567 CB SER F 97 -45.856 3.147 14.511 1.00 1.41 C ATOM 1568 OG SER F 97 -45.993 2.066 13.600 1.00 1.83 O ATOM 0 H SER F 97 -47.431 4.866 15.402 1.00 0.90 H new ATOM 0 HA SER F 97 -47.457 2.109 15.530 1.00 1.00 H new ATOM 0 HB2 SER F 97 -46.157 4.080 14.034 1.00 1.41 H new ATOM 0 HB3 SER F 97 -44.812 3.261 14.803 1.00 1.41 H new ATOM 0 HG SER F 97 -45.440 2.233 12.808 1.00 1.83 H new ATOM 1574 N SER F 98 -45.081 3.298 17.475 1.00 0.99 N ATOM 1575 CA SER F 98 -44.189 2.886 18.596 1.00 1.27 C ATOM 1576 C SER F 98 -44.122 4.002 19.635 1.00 1.18 C ATOM 1577 O SER F 98 -44.482 5.131 19.374 1.00 1.54 O ATOM 1578 CB SER F 98 -42.786 2.602 18.058 1.00 1.85 C ATOM 1579 OG SER F 98 -42.395 1.288 18.428 1.00 2.47 O ATOM 0 H SER F 98 -45.042 4.286 17.226 1.00 0.99 H new ATOM 0 HA SER F 98 -44.587 1.984 19.060 1.00 1.27 H new ATOM 0 HB2 SER F 98 -42.773 2.705 16.973 1.00 1.85 H new ATOM 0 HB3 SER F 98 -42.078 3.329 18.456 1.00 1.85 H new ATOM 0 HG SER F 98 -41.497 1.104 18.082 1.00 2.47 H new ATOM 1585 N ARG F 99 -43.671 3.693 20.816 1.00 1.08 N ATOM 1586 CA ARG F 99 -43.593 4.733 21.875 1.00 1.11 C ATOM 1587 C ARG F 99 -42.330 5.579 21.700 1.00 1.04 C ATOM 1588 O ARG F 99 -41.528 5.354 20.815 1.00 1.57 O ATOM 1589 CB ARG F 99 -43.564 4.058 23.248 1.00 1.26 C ATOM 1590 CG ARG F 99 -42.207 3.381 23.456 1.00 1.50 C ATOM 1591 CD ARG F 99 -42.174 2.721 24.836 1.00 1.67 C ATOM 1592 NE ARG F 99 -41.277 1.532 24.797 1.00 2.27 N ATOM 1593 CZ ARG F 99 -41.737 0.356 25.127 1.00 2.80 C ATOM 1594 NH1 ARG F 99 -42.930 -0.008 24.745 1.00 3.28 N ATOM 1595 NH2 ARG F 99 -41.004 -0.454 25.841 1.00 3.37 N ATOM 0 H ARG F 99 -43.353 2.765 21.094 1.00 1.08 H new ATOM 0 HA ARG F 99 -44.466 5.381 21.797 1.00 1.11 H new ATOM 0 HB2 ARG F 99 -43.738 4.796 24.031 1.00 1.26 H new ATOM 0 HB3 ARG F 99 -44.364 3.322 23.320 1.00 1.26 H new ATOM 0 HG2 ARG F 99 -42.038 2.635 22.680 1.00 1.50 H new ATOM 0 HG3 ARG F 99 -41.406 4.115 23.373 1.00 1.50 H new ATOM 0 HD2 ARG F 99 -41.820 3.432 25.583 1.00 1.67 H new ATOM 0 HD3 ARG F 99 -43.179 2.422 25.132 1.00 1.67 H new ATOM 0 HE ARG F 99 -40.303 1.637 24.512 1.00 2.27 H new ATOM 0 HH11 ARG F 99 -43.503 0.626 24.189 1.00 3.28 H new ATOM 0 HH12 ARG F 99 -43.290 -0.927 25.003 1.00 3.28 H new ATOM 0 HH21 ARG F 99 -40.072 -0.168 26.141 1.00 3.37 H new ATOM 0 HH22 ARG F 99 -41.363 -1.373 26.099 1.00 3.37 H new ATOM 1609 N LEU F 100 -42.170 6.557 22.547 1.00 0.77 N ATOM 1610 CA LEU F 100 -40.972 7.459 22.476 1.00 0.68 C ATOM 1611 C LEU F 100 -39.694 6.614 22.374 1.00 0.58 C ATOM 1612 O LEU F 100 -39.749 5.406 22.267 1.00 0.71 O ATOM 1613 CB LEU F 100 -40.894 8.357 23.729 1.00 0.68 C ATOM 1614 CG LEU F 100 -41.767 7.788 24.854 1.00 0.77 C ATOM 1615 CD1 LEU F 100 -41.307 6.367 25.179 1.00 1.63 C ATOM 1616 CD2 LEU F 100 -41.659 8.660 26.098 1.00 1.24 C ATOM 0 H LEU F 100 -42.824 6.778 23.298 1.00 0.77 H new ATOM 0 HA LEU F 100 -41.066 8.093 21.594 1.00 0.68 H new ATOM 0 HB2 LEU F 100 -39.860 8.432 24.066 1.00 0.68 H new ATOM 0 HB3 LEU F 100 -41.223 9.366 23.481 1.00 0.68 H new ATOM 0 HG LEU F 100 -42.807 7.773 24.527 1.00 0.77 H new ATOM 0 HD11 LEU F 100 -41.925 5.958 25.979 1.00 1.63 H new ATOM 0 HD12 LEU F 100 -41.402 5.742 24.291 1.00 1.63 H new ATOM 0 HD13 LEU F 100 -40.265 6.386 25.499 1.00 1.63 H new ATOM 0 HD21 LEU F 100 -42.284 8.245 26.889 1.00 1.24 H new ATOM 0 HD22 LEU F 100 -40.622 8.690 26.433 1.00 1.24 H new ATOM 0 HD23 LEU F 100 -41.994 9.671 25.864 1.00 1.24 H new ATOM 1628 N VAL F 101 -38.542 7.241 22.399 1.00 0.53 N ATOM 1629 CA VAL F 101 -37.266 6.469 22.292 1.00 0.57 C ATOM 1630 C VAL F 101 -37.358 5.184 23.115 1.00 0.68 C ATOM 1631 O VAL F 101 -37.683 5.203 24.286 1.00 0.95 O ATOM 1632 CB VAL F 101 -36.091 7.313 22.797 1.00 0.72 C ATOM 1633 CG1 VAL F 101 -35.385 7.957 21.603 1.00 1.20 C ATOM 1634 CG2 VAL F 101 -36.585 8.406 23.749 1.00 1.60 C ATOM 0 H VAL F 101 -38.431 8.251 22.489 1.00 0.53 H new ATOM 0 HA VAL F 101 -37.102 6.216 21.244 1.00 0.57 H new ATOM 0 HB VAL F 101 -35.398 6.668 23.337 1.00 0.72 H new ATOM 0 HG11 VAL F 101 -34.548 8.559 21.957 1.00 1.20 H new ATOM 0 HG12 VAL F 101 -35.016 7.178 20.935 1.00 1.20 H new ATOM 0 HG13 VAL F 101 -36.088 8.593 21.065 1.00 1.20 H new ATOM 0 HG21 VAL F 101 -35.737 8.995 24.098 1.00 1.60 H new ATOM 0 HG22 VAL F 101 -37.287 9.055 23.225 1.00 1.60 H new ATOM 0 HG23 VAL F 101 -37.083 7.947 24.603 1.00 1.60 H new ATOM 1644 N VAL F 102 -37.079 4.063 22.504 1.00 0.84 N ATOM 1645 CA VAL F 102 -37.154 2.771 23.239 1.00 1.02 C ATOM 1646 C VAL F 102 -35.856 2.545 24.038 1.00 1.37 C ATOM 1647 O VAL F 102 -35.907 2.353 25.236 1.00 2.09 O ATOM 1648 CB VAL F 102 -37.398 1.631 22.233 1.00 1.38 C ATOM 1649 CG1 VAL F 102 -36.822 0.312 22.762 1.00 2.38 C ATOM 1650 CG2 VAL F 102 -38.902 1.470 22.014 1.00 1.84 C ATOM 0 H VAL F 102 -36.802 3.989 21.525 1.00 0.84 H new ATOM 0 HA VAL F 102 -37.982 2.792 23.948 1.00 1.02 H new ATOM 0 HB VAL F 102 -36.904 1.878 21.294 1.00 1.38 H new ATOM 0 HG11 VAL F 102 -37.004 -0.481 22.037 1.00 2.38 H new ATOM 0 HG12 VAL F 102 -35.749 0.421 22.919 1.00 2.38 H new ATOM 0 HG13 VAL F 102 -37.303 0.058 23.707 1.00 2.38 H new ATOM 0 HG21 VAL F 102 -39.082 0.664 21.302 1.00 1.84 H new ATOM 0 HG22 VAL F 102 -39.384 1.231 22.962 1.00 1.84 H new ATOM 0 HG23 VAL F 102 -39.314 2.400 21.621 1.00 1.84 H new ATOM 1660 N PRO F 103 -34.732 2.576 23.361 1.00 1.69 N ATOM 1661 CA PRO F 103 -33.421 2.376 24.006 1.00 2.26 C ATOM 1662 C PRO F 103 -32.983 3.652 24.730 1.00 2.05 C ATOM 1663 O PRO F 103 -33.784 4.511 25.037 1.00 2.47 O ATOM 1664 CB PRO F 103 -32.484 2.075 22.836 1.00 3.34 C ATOM 1665 CG PRO F 103 -33.156 2.674 21.578 1.00 3.50 C ATOM 1666 CD PRO F 103 -34.655 2.808 21.903 1.00 2.38 C ATOM 0 HA PRO F 103 -33.431 1.584 24.755 1.00 2.26 H new ATOM 0 HB2 PRO F 103 -31.502 2.518 23.000 1.00 3.34 H new ATOM 0 HB3 PRO F 103 -32.335 1.001 22.723 1.00 3.34 H new ATOM 0 HG2 PRO F 103 -32.724 3.644 21.333 1.00 3.50 H new ATOM 0 HG3 PRO F 103 -33.003 2.029 20.713 1.00 3.50 H new ATOM 0 HD2 PRO F 103 -35.034 3.795 21.636 1.00 2.38 H new ATOM 0 HD3 PRO F 103 -35.249 2.079 21.352 1.00 2.38 H new ATOM 1674 N SER F 104 -31.712 3.782 24.999 1.00 2.36 N ATOM 1675 CA SER F 104 -31.217 5.001 25.696 1.00 2.97 C ATOM 1676 C SER F 104 -30.103 5.639 24.864 1.00 2.98 C ATOM 1677 O SER F 104 -29.074 5.038 24.624 1.00 3.54 O ATOM 1678 CB SER F 104 -30.671 4.617 27.073 1.00 3.74 C ATOM 1679 OG SER F 104 -31.718 4.076 27.864 1.00 4.33 O ATOM 0 H SER F 104 -30.995 3.095 24.765 1.00 2.36 H new ATOM 0 HA SER F 104 -32.035 5.711 25.818 1.00 2.97 H new ATOM 0 HB2 SER F 104 -29.867 3.888 26.967 1.00 3.74 H new ATOM 0 HB3 SER F 104 -30.245 5.492 27.564 1.00 3.74 H new ATOM 0 HG SER F 104 -31.368 3.829 28.745 1.00 4.33 H new ATOM 1685 N HIS F 105 -30.300 6.851 24.420 1.00 2.74 N ATOM 1686 CA HIS F 105 -29.254 7.526 23.600 1.00 3.27 C ATOM 1687 C HIS F 105 -27.876 7.270 24.215 1.00 3.94 C ATOM 1688 O HIS F 105 -26.874 7.248 23.529 1.00 4.63 O ATOM 1689 CB HIS F 105 -29.525 9.031 23.567 1.00 3.26 C ATOM 1690 CG HIS F 105 -29.240 9.621 24.920 1.00 3.14 C ATOM 1691 ND1 HIS F 105 -28.307 10.629 25.106 1.00 3.58 N ATOM 1692 CD2 HIS F 105 -29.755 9.354 26.164 1.00 3.33 C ATOM 1693 CE1 HIS F 105 -28.289 10.929 26.417 1.00 3.99 C ATOM 1694 NE2 HIS F 105 -29.154 10.181 27.108 1.00 3.95 N ATOM 0 H HIS F 105 -31.141 7.403 24.590 1.00 2.74 H new ATOM 0 HA HIS F 105 -29.277 7.129 22.585 1.00 3.27 H new ATOM 0 HB2 HIS F 105 -28.900 9.507 22.812 1.00 3.26 H new ATOM 0 HB3 HIS F 105 -30.562 9.219 23.288 1.00 3.26 H new ATOM 0 HD2 HIS F 105 -30.512 8.614 26.378 1.00 3.33 H new ATOM 0 HE1 HIS F 105 -27.653 11.683 26.857 1.00 3.99 H new ATOM 0 HE2 HIS F 105 -29.335 10.210 28.111 1.00 3.95 H new ATOM 1702 N LYS F 106 -27.820 7.078 25.505 1.00 4.15 N ATOM 1703 CA LYS F 106 -26.515 6.825 26.168 1.00 5.05 C ATOM 1704 C LYS F 106 -25.690 5.846 25.328 1.00 5.59 C ATOM 1705 O LYS F 106 -26.263 4.886 24.841 1.00 5.57 O ATOM 1706 CB LYS F 106 -26.768 6.231 27.554 1.00 5.66 C ATOM 1707 CG LYS F 106 -27.228 4.778 27.414 1.00 6.58 C ATOM 1708 CD LYS F 106 -27.417 4.168 28.805 1.00 7.28 C ATOM 1709 CE LYS F 106 -26.070 4.122 29.528 1.00 8.02 C ATOM 1710 NZ LYS F 106 -25.097 3.339 28.715 1.00 8.85 N ATOM 1711 OXT LYS F 106 -24.500 6.075 25.187 1.00 6.30 O ATOM 0 H LYS F 106 -28.627 7.086 26.128 1.00 4.15 H new ATOM 0 HA LYS F 106 -25.964 7.760 26.264 1.00 5.05 H new ATOM 0 HB2 LYS F 106 -25.858 6.279 28.153 1.00 5.66 H new ATOM 0 HB3 LYS F 106 -27.526 6.814 28.078 1.00 5.66 H new ATOM 0 HG2 LYS F 106 -28.163 4.733 26.855 1.00 6.58 H new ATOM 0 HG3 LYS F 106 -26.492 4.205 26.850 1.00 6.58 H new ATOM 0 HD2 LYS F 106 -28.130 4.759 29.379 1.00 7.28 H new ATOM 0 HD3 LYS F 106 -27.831 3.163 28.720 1.00 7.28 H new ATOM 0 HE2 LYS F 106 -25.696 5.133 29.688 1.00 8.02 H new ATOM 0 HE3 LYS F 106 -26.188 3.667 30.511 1.00 8.02 H new ATOM 0 HZ1 LYS F 106 -24.325 3.003 29.326 1.00 8.85 H new ATOM 0 HZ2 LYS F 106 -25.580 2.523 28.287 1.00 8.85 H new ATOM 0 HZ3 LYS F 106 -24.706 3.943 27.964 1.00 8.85 H new TER 1725 LYS F 106 ATOM 1726 N GLU P 201 -51.916 13.926 0.307 1.00 5.73 N ATOM 1727 CA GLU P 201 -50.567 14.318 0.804 1.00 5.09 C ATOM 1728 C GLU P 201 -50.607 14.464 2.328 1.00 4.19 C ATOM 1729 O GLU P 201 -50.876 15.532 2.840 1.00 3.95 O ATOM 1730 CB GLU P 201 -50.159 15.652 0.174 1.00 5.35 C ATOM 1731 CG GLU P 201 -51.387 16.558 0.058 1.00 5.97 C ATOM 1732 CD GLU P 201 -51.002 17.848 -0.668 1.00 6.51 C ATOM 1733 OE1 GLU P 201 -50.750 17.781 -1.860 1.00 7.26 O ATOM 1734 OE2 GLU P 201 -50.966 18.881 -0.020 1.00 6.44 O ATOM 0 HA GLU P 201 -49.842 13.551 0.531 1.00 5.09 H new ATOM 0 HB2 GLU P 201 -49.394 16.135 0.782 1.00 5.35 H new ATOM 0 HB3 GLU P 201 -49.724 15.483 -0.811 1.00 5.35 H new ATOM 0 HG2 GLU P 201 -52.181 16.045 -0.485 1.00 5.97 H new ATOM 0 HG3 GLU P 201 -51.777 16.789 1.049 1.00 5.97 H new ATOM 1743 N PRO P 202 -50.336 13.378 3.007 1.00 4.13 N ATOM 1744 CA PRO P 202 -50.330 13.343 4.480 1.00 3.63 C ATOM 1745 C PRO P 202 -49.038 13.960 5.024 1.00 2.65 C ATOM 1746 O PRO P 202 -47.970 13.767 4.479 1.00 2.98 O ATOM 1747 CB PRO P 202 -50.400 11.848 4.803 1.00 4.59 C ATOM 1748 CG PRO P 202 -49.875 11.106 3.550 1.00 5.29 C ATOM 1749 CD PRO P 202 -50.010 12.086 2.369 1.00 5.05 C ATOM 0 HA PRO P 202 -51.147 13.909 4.926 1.00 3.63 H new ATOM 0 HB2 PRO P 202 -49.794 11.611 5.677 1.00 4.59 H new ATOM 0 HB3 PRO P 202 -51.422 11.548 5.033 1.00 4.59 H new ATOM 0 HG2 PRO P 202 -48.837 10.803 3.686 1.00 5.29 H new ATOM 0 HG3 PRO P 202 -50.450 10.198 3.368 1.00 5.29 H new ATOM 0 HD2 PRO P 202 -49.086 12.147 1.794 1.00 5.05 H new ATOM 0 HD3 PRO P 202 -50.794 11.773 1.679 1.00 5.05 H new ATOM 1757 N GLN P 203 -49.128 14.699 6.096 1.00 2.04 N ATOM 1758 CA GLN P 203 -47.906 15.325 6.673 1.00 1.65 C ATOM 1759 C GLN P 203 -47.547 14.627 7.986 1.00 1.41 C ATOM 1760 O GLN P 203 -46.447 14.751 8.486 1.00 2.14 O ATOM 1761 CB GLN P 203 -48.170 16.808 6.941 1.00 2.31 C ATOM 1762 CG GLN P 203 -48.505 17.513 5.625 1.00 3.09 C ATOM 1763 CD GLN P 203 -49.949 18.018 5.670 1.00 3.87 C ATOM 1764 OE1 GLN P 203 -50.415 18.470 6.697 1.00 4.29 O ATOM 1765 NE2 GLN P 203 -50.681 17.961 4.591 1.00 4.57 N ATOM 0 H GLN P 203 -49.995 14.896 6.597 1.00 2.04 H new ATOM 0 HA GLN P 203 -47.080 15.224 5.969 1.00 1.65 H new ATOM 0 HB2 GLN P 203 -48.994 16.920 7.646 1.00 2.31 H new ATOM 0 HB3 GLN P 203 -47.294 17.267 7.399 1.00 2.31 H new ATOM 0 HG2 GLN P 203 -47.822 18.347 5.463 1.00 3.09 H new ATOM 0 HG3 GLN P 203 -48.375 16.826 4.789 1.00 3.09 H new ATOM 0 HE21 GLN P 203 -50.290 17.582 3.729 1.00 4.57 H new ATOM 0 HE22 GLN P 203 -51.644 18.296 4.610 1.00 4.57 H new HETATM 1774 N PTR P 204 -48.467 13.892 8.549 1.00 0.81 N HETATM 1775 CA PTR P 204 -48.178 13.188 9.830 1.00 0.55 C HETATM 1776 C PTR P 204 -49.211 12.081 10.050 1.00 0.57 C HETATM 1777 O PTR P 204 -50.340 12.176 9.609 1.00 0.83 O HETATM 1778 CB PTR P 204 -48.246 14.187 10.987 1.00 0.43 C HETATM 1779 CG PTR P 204 -47.007 15.049 10.982 1.00 0.36 C HETATM 1780 CD1 PTR P 204 -45.807 14.553 11.507 1.00 1.01 C HETATM 1781 CD2 PTR P 204 -47.057 16.345 10.455 1.00 0.96 C HETATM 1782 CE1 PTR P 204 -44.658 15.353 11.504 1.00 1.04 C HETATM 1783 CE2 PTR P 204 -45.909 17.145 10.452 1.00 0.95 C HETATM 1784 CZ PTR P 204 -44.709 16.649 10.976 1.00 0.42 C HETATM 1785 OH PTR P 204 -43.535 17.467 10.973 1.00 0.51 O HETATM 1786 P PTR P 204 -43.320 18.559 9.823 1.00 0.67 P HETATM 1787 O1P PTR P 204 -44.258 19.685 10.030 1.00 1.55 O HETATM 1788 O2P PTR P 204 -43.574 17.941 8.503 1.00 1.44 O HETATM 1789 O3P PTR P 204 -41.928 19.061 9.874 1.00 1.74 O HETATM 0 HE2 PTR P 204 -45.949 18.154 10.042 1.00 0.95 H new HETATM 0 HE1 PTR P 204 -43.724 14.967 11.913 1.00 1.04 H new HETATM 0 HD2 PTR P 204 -47.991 16.731 10.047 1.00 0.96 H new HETATM 0 HD1 PTR P 204 -45.768 13.544 11.918 1.00 1.01 H new HETATM 0 HB3 PTR P 204 -49.135 14.810 10.892 1.00 0.43 H new HETATM 0 HB2 PTR P 204 -48.329 13.656 11.935 1.00 0.43 H new HETATM 0 HA PTR P 204 -47.181 12.749 9.786 1.00 0.55 H new HETATM 0 H PTR P 204 -49.260 13.603 7.976 1.00 0.81 H new ATOM 1798 N GLU P 205 -48.835 11.032 10.729 1.00 0.60 N ATOM 1799 CA GLU P 205 -49.797 9.921 10.977 1.00 0.64 C ATOM 1800 C GLU P 205 -50.654 10.253 12.200 1.00 0.63 C ATOM 1801 O GLU P 205 -50.159 10.366 13.304 1.00 0.89 O ATOM 1802 CB GLU P 205 -49.024 8.625 11.232 1.00 0.77 C ATOM 1803 CG GLU P 205 -48.209 8.263 9.989 1.00 0.99 C ATOM 1804 CD GLU P 205 -48.460 6.799 9.622 1.00 1.38 C ATOM 1805 OE1 GLU P 205 -48.612 5.998 10.530 1.00 1.87 O ATOM 1806 OE2 GLU P 205 -48.495 6.503 8.439 1.00 1.91 O ATOM 0 H GLU P 205 -47.904 10.896 11.123 1.00 0.60 H new ATOM 0 HA GLU P 205 -50.440 9.795 10.106 1.00 0.64 H new ATOM 0 HB2 GLU P 205 -48.363 8.746 12.090 1.00 0.77 H new ATOM 0 HB3 GLU P 205 -49.716 7.818 11.474 1.00 0.77 H new ATOM 0 HG2 GLU P 205 -48.488 8.910 9.157 1.00 0.99 H new ATOM 0 HG3 GLU P 205 -47.148 8.425 10.177 1.00 0.99 H new ATOM 1813 N GLU P 206 -51.935 10.411 12.013 1.00 0.65 N ATOM 1814 CA GLU P 206 -52.821 10.736 13.166 1.00 0.69 C ATOM 1815 C GLU P 206 -53.563 9.475 13.613 1.00 0.73 C ATOM 1816 O GLU P 206 -54.404 8.955 12.907 1.00 0.87 O ATOM 1817 CB GLU P 206 -53.835 11.802 12.744 1.00 0.81 C ATOM 1818 CG GLU P 206 -53.111 12.936 12.016 1.00 1.24 C ATOM 1819 CD GLU P 206 -54.113 14.034 11.656 1.00 1.72 C ATOM 1820 OE1 GLU P 206 -55.212 14.002 12.184 1.00 2.00 O ATOM 1821 OE2 GLU P 206 -53.763 14.889 10.858 1.00 2.28 O ATOM 0 H GLU P 206 -52.407 10.329 11.112 1.00 0.65 H new ATOM 0 HA GLU P 206 -52.218 11.113 13.992 1.00 0.69 H new ATOM 0 HB2 GLU P 206 -54.591 11.362 12.093 1.00 0.81 H new ATOM 0 HB3 GLU P 206 -54.355 12.191 13.619 1.00 0.81 H new ATOM 0 HG2 GLU P 206 -52.322 13.343 12.648 1.00 1.24 H new ATOM 0 HG3 GLU P 206 -52.632 12.556 11.114 1.00 1.24 H new ATOM 1828 N ILE P 207 -53.259 8.979 14.781 1.00 0.82 N ATOM 1829 CA ILE P 207 -53.947 7.753 15.272 1.00 0.92 C ATOM 1830 C ILE P 207 -55.463 7.910 15.086 1.00 1.03 C ATOM 1831 O ILE P 207 -56.056 8.818 15.635 1.00 1.65 O ATOM 1832 CB ILE P 207 -53.635 7.559 16.758 1.00 0.89 C ATOM 1833 CG1 ILE P 207 -52.188 7.086 16.916 1.00 0.90 C ATOM 1834 CG2 ILE P 207 -54.579 6.510 17.350 1.00 1.17 C ATOM 1835 CD1 ILE P 207 -51.327 8.239 17.436 1.00 0.81 C ATOM 0 H ILE P 207 -52.564 9.370 15.416 1.00 0.82 H new ATOM 0 HA ILE P 207 -53.599 6.887 14.709 1.00 0.92 H new ATOM 0 HB ILE P 207 -53.771 8.505 17.282 1.00 0.89 H new ATOM 0 HG12 ILE P 207 -52.143 6.244 17.607 1.00 0.90 H new ATOM 0 HG13 ILE P 207 -51.803 6.734 15.959 1.00 0.90 H new ATOM 0 HG21 ILE P 207 -54.354 6.374 18.408 1.00 1.17 H new ATOM 0 HG22 ILE P 207 -55.610 6.844 17.238 1.00 1.17 H new ATOM 0 HG23 ILE P 207 -54.445 5.563 16.826 1.00 1.17 H new ATOM 0 HD11 ILE P 207 -50.297 7.902 17.548 1.00 0.81 H new ATOM 0 HD12 ILE P 207 -51.363 9.067 16.729 1.00 0.81 H new ATOM 0 HD13 ILE P 207 -51.708 8.570 18.402 1.00 0.81 H new ATOM 1847 N PRO P 208 -56.049 7.023 14.319 1.00 1.35 N ATOM 1848 CA PRO P 208 -57.498 7.046 14.048 1.00 1.49 C ATOM 1849 C PRO P 208 -58.273 6.472 15.238 1.00 2.03 C ATOM 1850 O PRO P 208 -57.722 6.240 16.296 1.00 2.74 O ATOM 1851 CB PRO P 208 -57.648 6.150 12.816 1.00 2.51 C ATOM 1852 CG PRO P 208 -56.406 5.228 12.793 1.00 3.19 C ATOM 1853 CD PRO P 208 -55.329 5.919 13.651 1.00 2.33 C ATOM 0 HA PRO P 208 -57.888 8.051 13.887 1.00 1.49 H new ATOM 0 HB2 PRO P 208 -58.566 5.564 12.871 1.00 2.51 H new ATOM 0 HB3 PRO P 208 -57.705 6.747 11.906 1.00 2.51 H new ATOM 0 HG2 PRO P 208 -56.647 4.243 13.193 1.00 3.19 H new ATOM 0 HG3 PRO P 208 -56.052 5.080 11.773 1.00 3.19 H new ATOM 0 HD2 PRO P 208 -54.895 5.230 14.376 1.00 2.33 H new ATOM 0 HD3 PRO P 208 -54.510 6.292 13.037 1.00 2.33 H new ATOM 1861 N ILE P 209 -59.546 6.240 15.072 1.00 2.23 N ATOM 1862 CA ILE P 209 -60.355 5.682 16.191 1.00 3.29 C ATOM 1863 C ILE P 209 -61.774 5.405 15.695 1.00 3.45 C ATOM 1864 O ILE P 209 -62.732 5.494 16.437 1.00 4.34 O ATOM 1865 CB ILE P 209 -60.403 6.690 17.341 1.00 3.94 C ATOM 1866 CG1 ILE P 209 -61.020 6.025 18.574 1.00 4.83 C ATOM 1867 CG2 ILE P 209 -61.255 7.892 16.932 1.00 4.53 C ATOM 1868 CD1 ILE P 209 -59.912 5.653 19.561 1.00 5.56 C ATOM 0 H ILE P 209 -60.061 6.413 14.209 1.00 2.23 H new ATOM 0 HA ILE P 209 -59.902 4.755 16.544 1.00 3.29 H new ATOM 0 HB ILE P 209 -59.392 7.024 17.574 1.00 3.94 H new ATOM 0 HG12 ILE P 209 -61.731 6.702 19.048 1.00 4.83 H new ATOM 0 HG13 ILE P 209 -61.575 5.134 18.280 1.00 4.83 H new ATOM 0 HG21 ILE P 209 -61.289 8.610 17.752 1.00 4.53 H new ATOM 0 HG22 ILE P 209 -60.818 8.365 16.053 1.00 4.53 H new ATOM 0 HG23 ILE P 209 -62.266 7.559 16.700 1.00 4.53 H new ATOM 0 HD11 ILE P 209 -60.351 5.179 20.439 1.00 5.56 H new ATOM 0 HD12 ILE P 209 -59.218 4.961 19.085 1.00 5.56 H new ATOM 0 HD13 ILE P 209 -59.377 6.553 19.864 1.00 5.56 H new ATOM 1880 N TYR P 210 -61.914 5.073 14.442 1.00 2.82 N ATOM 1881 CA TYR P 210 -63.264 4.793 13.890 1.00 3.15 C ATOM 1882 C TYR P 210 -63.571 3.300 14.020 1.00 3.78 C ATOM 1883 O TYR P 210 -62.776 2.535 14.529 1.00 4.19 O ATOM 1884 CB TYR P 210 -63.295 5.196 12.415 1.00 2.86 C ATOM 1885 CG TYR P 210 -62.027 4.736 11.736 1.00 3.08 C ATOM 1886 CD1 TYR P 210 -61.735 3.370 11.650 1.00 3.61 C ATOM 1887 CD2 TYR P 210 -61.144 5.677 11.192 1.00 3.56 C ATOM 1888 CE1 TYR P 210 -60.560 2.943 11.020 1.00 4.41 C ATOM 1889 CE2 TYR P 210 -59.969 5.250 10.562 1.00 4.39 C ATOM 1890 CZ TYR P 210 -59.677 3.884 10.476 1.00 4.74 C ATOM 1891 OH TYR P 210 -58.518 3.463 9.855 1.00 5.83 O ATOM 0 H TYR P 210 -61.147 4.984 13.776 1.00 2.82 H new ATOM 0 HA TYR P 210 -64.012 5.362 14.442 1.00 3.15 H new ATOM 0 HB2 TYR P 210 -64.163 4.754 11.925 1.00 2.86 H new ATOM 0 HB3 TYR P 210 -63.395 6.278 12.325 1.00 2.86 H new ATOM 0 HD1 TYR P 210 -62.416 2.645 12.070 1.00 3.61 H new ATOM 0 HD2 TYR P 210 -61.369 6.731 11.258 1.00 3.56 H new ATOM 0 HE1 TYR P 210 -60.335 1.889 10.954 1.00 4.41 H new ATOM 0 HE2 TYR P 210 -59.288 5.975 10.142 1.00 4.39 H new ATOM 0 HH TYR P 210 -58.018 4.242 9.532 1.00 5.83 H new ATOM 1901 N LEU P 211 -64.718 2.878 13.562 1.00 4.19 N ATOM 1902 CA LEU P 211 -65.074 1.435 13.660 1.00 5.15 C ATOM 1903 C LEU P 211 -64.318 0.648 12.588 1.00 5.53 C ATOM 1904 O LEU P 211 -64.417 1.018 11.429 1.00 5.35 O ATOM 1905 CB LEU P 211 -66.580 1.266 13.449 1.00 5.62 C ATOM 1906 CG LEU P 211 -67.224 0.758 14.740 1.00 6.44 C ATOM 1907 CD1 LEU P 211 -68.725 0.560 14.519 1.00 6.92 C ATOM 1908 CD2 LEU P 211 -66.587 -0.575 15.138 1.00 7.14 C ATOM 1909 OXT LEU P 211 -63.652 -0.310 12.943 1.00 6.33 O ATOM 0 H LEU P 211 -65.424 3.470 13.124 1.00 4.19 H new ATOM 0 HA LEU P 211 -64.800 1.060 14.646 1.00 5.15 H new ATOM 0 HB2 LEU P 211 -67.026 2.217 13.158 1.00 5.62 H new ATOM 0 HB3 LEU P 211 -66.767 0.564 12.636 1.00 5.62 H new ATOM 0 HG LEU P 211 -67.067 1.487 15.535 1.00 6.44 H new ATOM 0 HD11 LEU P 211 -69.184 0.198 15.439 1.00 6.92 H new ATOM 0 HD12 LEU P 211 -69.179 1.510 14.236 1.00 6.92 H new ATOM 0 HD13 LEU P 211 -68.883 -0.169 13.724 1.00 6.92 H new ATOM 0 HD21 LEU P 211 -67.046 -0.937 16.058 1.00 7.14 H new ATOM 0 HD22 LEU P 211 -66.743 -1.304 14.343 1.00 7.14 H new ATOM 0 HD23 LEU P 211 -65.518 -0.434 15.297 1.00 7.14 H new TER 1921 LEU P 211 CONECT 1759 1774 CONECT 1774 1759 1775 1790 CONECT 1775 1774 1776 1778 1791 CONECT 1776 1775 1777 1798 CONECT 1777 1776 CONECT 1778 1775 1779 1792 1793 CONECT 1779 1778 1780 1781 CONECT 1780 1779 1782 1794 CONECT 1781 1779 1783 1795 CONECT 1782 1780 1784 1796 CONECT 1783 1781 1784 1797 CONECT 1784 1782 1783 1785 CONECT 1785 1784 1786 CONECT 1786 1785 1787 1788 1789 CONECT 1787 1786 CONECT 1788 1786 CONECT 1789 1786 CONECT 1790 1774 CONECT 1791 1775 CONECT 1792 1778 CONECT 1793 1778 CONECT 1794 1780 CONECT 1795 1781 CONECT 1796 1782 CONECT 1797 1783 CONECT 1798 1776 END