USER MOD reduce.3.24.130724 H: found=0, std=0, add=1170, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1171 hydrogens (0 hets) HEADER RHO-GTPASE INHIBITOR 11-MAY-97 1GDF TITLE STRUCTURE OF RHOGDI: A C-TERMINAL BINDING DOMAIN TARGETS AN TITLE 2 N-TERMINAL INHIBITORY PEPTIDE TO GTPASES, NMR, MINIMIZED TITLE 3 AVERAGE STRUCTURE COMPND MOL_ID: 1; COMPND 2 MOLECULE: RHOGDI; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: ISOPRENE BINDING DOMAIN; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; SOURCE 3 ORGANISM_COMMON: CATTLE; SOURCE 4 ORGANISM_TAXID: 9913; SOURCE 5 CELL_LINE: BL21; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET11A KEYWDS RHO-GTPASE INHIBITOR, NUCLEOTIDE EXCHANGE, ISOPRENE BINDING EXPDTA SOLUTION NMR AUTHOR M.K.ROSEN,Y.Q.GOSSER REVDAT 2 24-FEB-09 1GDF 1 VERSN REVDAT 1 19-NOV-97 1GDF 0 JRNL AUTH Y.Q.GOSSER,T.K.NOMANBHOY,B.AGHAZADEH,D.MANOR, JRNL AUTH 2 C.COMBS,R.A.CERIONE,M.K.ROSEN JRNL TITL C-TERMINAL BINDING DOMAIN OF RHO GDP-DISSOCIATION JRNL TITL 2 INHIBITOR DIRECTS N-TERMINAL INHIBITORY PEPTIDE TO JRNL TITL 3 GTPASES. JRNL REF NATURE V. 387 814 1997 JRNL REFN ISSN 0028-0836 JRNL PMID 9194563 JRNL DOI 10.1038/42961 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.0 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1GDF 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) : 303 REMARK 210 PH : 6.8 REMARK 210 IONIC STRENGTH : NULL REMARK 210 PRESSURE : NULL REMARK 210 SAMPLE CONTENTS : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : HNCACB, CBCACONNH, HNCO, CCC- REMARK 210 TOCSY-NNH, HCC-TOCSY-NNH, 15N- REMARK 210 TOCSY, HCCH-TOCSY, HCCH-COSY, REMARK 210 15N-NOESY, 15N/13C-NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : UNITY+ REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE, NMRVIEW, X-PLOR REMARK 210 METHOD USED : HYBRID DISTANCE GEOMETRY/ REMARK 210 SIMULATED ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 40 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NO DISTANCE VIOLATIONS 0.3 REMARK 210 ANGSTROMS, THEN LOWEST OVERALL REMARK 210 ENERGY 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 ASP A 64 85.99 52.68 REMARK 500 CYS A 79 -166.34 -160.30 REMARK 500 GLU A 106 105.74 -50.27 REMARK 500 ARG A 120 -66.94 -149.45 REMARK 500 GLN A 130 119.26 -162.12 REMARK 500 ASP A 140 132.81 -170.09 REMARK 500 ARG A 152 -39.47 -167.10 REMARK 500 ALA A 153 -75.20 -136.37 REMARK 500 GLU A 154 -145.00 -143.37 REMARK 500 ASP A 183 -151.18 -121.45 REMARK 500 ASP A 185 -15.58 -171.25 REMARK 500 THR A 187 -166.29 -175.93 REMARK 500 LYS A 199 -154.24 -154.93 REMARK 500 GLU A 201 51.56 -143.19 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 A 74 0.26 SIDE_CHAIN REMARK 500 ARG A 111 0.29 SIDE_CHAIN REMARK 500 ARG A 117 0.27 SIDE_CHAIN REMARK 500 ARG A 120 0.22 SIDE_CHAIN REMARK 500 ARG A 134 0.23 SIDE_CHAIN REMARK 500 ARG A 152 0.32 SIDE_CHAIN REMARK 500 ARG A 172 0.24 SIDE_CHAIN REMARK 500 ARG A 180 0.21 SIDE_CHAIN REMARK 500 ARG A 186 0.24 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1AJW RELATED DB: PDB DBREF 1GDF A 60 204 UNP P19803 GDIR_BOVIN 60 204 SEQRES 1 A 145 ALA VAL SER ALA ASP PRO ASN VAL PRO ASN VAL VAL VAL SEQRES 2 A 145 THR ARG LEU THR LEU VAL CYS SER THR ALA PRO GLY PRO SEQRES 3 A 145 LEU GLU LEU ASP LEU THR GLY ASP LEU GLU SER PHE LYS SEQRES 4 A 145 LYS GLN SER PHE VAL LEU LYS GLU GLY VAL GLU TYR ARG SEQRES 5 A 145 ILE LYS ILE SER PHE ARG VAL ASN ARG GLU ILE VAL SER SEQRES 6 A 145 GLY MET LYS TYR ILE GLN HIS THR TYR ARG LYS GLY VAL SEQRES 7 A 145 LYS ILE ASP LYS THR ASP TYR MET VAL GLY SER TYR GLY SEQRES 8 A 145 PRO ARG ALA GLU GLU TYR GLU PHE LEU THR PRO MET GLU SEQRES 9 A 145 GLU ALA PRO LYS GLY MET LEU ALA ARG GLY SER TYR ASN SEQRES 10 A 145 ILE LYS SER ARG PHE THR ASP ASP ASP ARG THR ASP HIS SEQRES 11 A 145 LEU SER TRP GLU TRP ASN LEU THR ILE LYS LYS GLU TRP SEQRES 12 A 145 LYS ASP HELIX 1 1 GLU A 95 LYS A 99 3 5 SHEET 1 A 3 SER A 101 VAL A 103 0 SHEET 2 A 3 ASP A 188 THR A 197 1 N ASN A 195 O PHE A 102 SHEET 3 A 3 ASN A 176 THR A 182 -1 N PHE A 181 O HIS A 189 SHEET 1 B 3 GLU A 155 GLU A 157 0 SHEET 2 B 3 ARG A 111 VAL A 118 -1 N PHE A 116 O TYR A 156 SHEET 3 B 3 VAL A 70 VAL A 78 -1 N VAL A 78 O ARG A 111 SHEET 1 C 2 MET A 126 THR A 132 0 SHEET 2 C 2 ASP A 140 GLY A 147 -1 N GLY A 147 O MET A 126 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 101 SER OG : rot -150:sc= 0.51 USER MOD Set 1.2: A 197 THR OG1 : rot 144:sc= 0.255 USER MOD Set 2.1: A 176 ASN : amide:sc= -0.957 K(o=-1.9,f=-4.7!) USER MOD Set 2.2: A 195 ASN : amide:sc= -0.958 K(o=-1.9,f=-0.2) USER MOD Set 3.1: A 80 SER OG : rot 180:sc= 0.0043 USER MOD Set 3.2: A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 ASN : amide:sc= -5.36! C(o=-5.4!,f=-9.9!) USER MOD Single : A 73 THR OG1 : rot -156:sc= -2.19 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -3:sc= -0.597 USER MOD Single : A 91 THR OG1 : rot -83:sc= 0.132 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 124 SER OG : rot 43:sc= 1.13 USER MOD Single : A 126 MET CE :methyl -157:sc= -13.4! (180deg=-18.8!) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc=-0.00528 X(o=-0.0053,f=-0.011) USER MOD Single : A 131 HIS : no HE2:sc= -5.79 K(o=-5.8,f=-8.3!) USER MOD Single : A 132 THR OG1 : rot 88:sc= 0.418 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ -163:sc= -1.8 (180deg=-1.89) USER MOD Single : A 142 THR OG1 : rot 180:sc= -0.0141 USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 148 SER OG : rot 180:sc= 0.00524 USER MOD Single : A 149 TYR OH : rot 120:sc= -0.924 USER MOD Single : A 156 TYR OH : rot 46:sc= 1.25 USER MOD Single : A 160 THR OG1 : rot 156:sc= -1.05 USER MOD Single : A 162 MET CE :methyl -127:sc= -0.0447 (180deg=-1.05) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 SER OG : rot 37:sc= 0.115 USER MOD Single : A 175 TYR OH : rot 180:sc= -1.25 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 179 SER OG : rot -140:sc= 0.0946 USER MOD Single : A 182 THR OG1 : rot 65:sc= 1.08 USER MOD Single : A 187 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A 189 HIS : no HE2:sc= -2.21 K(o=-2.2,f=-4.4!) USER MOD Single : A 191 SER OG : rot 180:sc= 0 USER MOD Single : A 199 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 60 29.697 5.397 22.601 1.00 11.17 N ATOM 2 CA ALA A 60 29.405 4.869 21.236 1.00 10.59 C ATOM 3 C ALA A 60 28.585 5.888 20.440 1.00 10.11 C ATOM 4 O ALA A 60 27.700 6.533 20.968 1.00 10.27 O ATOM 5 CB ALA A 60 28.595 3.595 21.470 1.00 11.12 C ATOM 0 HA ALA A 60 30.313 4.676 20.664 1.00 10.59 H new ATOM 0 HB1 ALA A 60 28.340 3.145 20.511 1.00 11.12 H new ATOM 0 HB2 ALA A 60 29.186 2.891 22.056 1.00 11.12 H new ATOM 0 HB3 ALA A 60 27.681 3.839 22.011 1.00 11.12 H new ATOM 13 N VAL A 61 28.876 6.034 19.172 1.00 9.77 N ATOM 14 CA VAL A 61 28.119 7.009 18.330 1.00 9.57 C ATOM 15 C VAL A 61 27.462 6.285 17.145 1.00 9.27 C ATOM 16 O VAL A 61 27.239 6.861 16.097 1.00 9.41 O ATOM 17 CB VAL A 61 29.172 8.021 17.857 1.00 9.84 C ATOM 18 CG1 VAL A 61 30.262 7.310 17.043 1.00 10.22 C ATOM 19 CG2 VAL A 61 28.502 9.095 16.996 1.00 9.92 C ATOM 0 H VAL A 61 29.607 5.518 18.683 1.00 9.77 H new ATOM 0 HA VAL A 61 27.312 7.499 18.874 1.00 9.57 H new ATOM 0 HB VAL A 61 29.631 8.488 18.728 1.00 9.84 H new ATOM 0 HG11 VAL A 61 31.003 8.038 16.713 1.00 10.22 H new ATOM 0 HG12 VAL A 61 30.746 6.556 17.664 1.00 10.22 H new ATOM 0 HG13 VAL A 61 29.812 6.831 16.174 1.00 10.22 H new ATOM 0 HG21 VAL A 61 29.251 9.813 16.661 1.00 9.92 H new ATOM 0 HG22 VAL A 61 28.035 8.627 16.129 1.00 9.92 H new ATOM 0 HG23 VAL A 61 27.743 9.611 17.584 1.00 9.92 H new ATOM 29 N SER A 62 27.150 5.024 17.311 1.00 9.06 N ATOM 30 CA SER A 62 26.507 4.253 16.205 1.00 8.97 C ATOM 31 C SER A 62 25.972 2.919 16.732 1.00 8.54 C ATOM 32 O SER A 62 26.524 2.340 17.649 1.00 8.74 O ATOM 33 CB SER A 62 27.622 4.019 15.186 1.00 9.04 C ATOM 34 OG SER A 62 27.162 3.121 14.185 1.00 9.16 O ATOM 0 H SER A 62 27.314 4.495 18.167 1.00 9.06 H new ATOM 0 HA SER A 62 25.661 4.784 15.769 1.00 8.97 H new ATOM 0 HB2 SER A 62 27.921 4.964 14.733 1.00 9.04 H new ATOM 0 HB3 SER A 62 28.503 3.610 15.681 1.00 9.04 H new ATOM 0 HG SER A 62 27.874 2.970 13.529 1.00 9.16 H new ATOM 40 N ALA A 63 24.902 2.430 16.158 1.00 8.20 N ATOM 41 CA ALA A 63 24.324 1.133 16.619 1.00 8.03 C ATOM 42 C ALA A 63 23.881 0.293 15.418 1.00 7.35 C ATOM 43 O ALA A 63 22.952 -0.487 15.504 1.00 7.54 O ATOM 44 CB ALA A 63 23.118 1.520 17.476 1.00 8.43 C ATOM 0 H ALA A 63 24.403 2.875 15.388 1.00 8.20 H new ATOM 0 HA ALA A 63 25.045 0.534 17.175 1.00 8.03 H new ATOM 0 HB1 ALA A 63 22.636 0.618 17.854 1.00 8.43 H new ATOM 0 HB2 ALA A 63 23.449 2.133 18.314 1.00 8.43 H new ATOM 0 HB3 ALA A 63 22.408 2.084 16.871 1.00 8.43 H new ATOM 50 N ASP A 64 24.542 0.449 14.295 1.00 6.79 N ATOM 51 CA ASP A 64 24.173 -0.335 13.069 1.00 6.25 C ATOM 52 C ASP A 64 22.673 -0.184 12.756 1.00 5.41 C ATOM 53 O ASP A 64 21.878 -1.003 13.172 1.00 5.40 O ATOM 54 CB ASP A 64 24.511 -1.792 13.400 1.00 6.73 C ATOM 55 CG ASP A 64 25.977 -2.066 13.063 1.00 7.54 C ATOM 56 OD1 ASP A 64 26.831 -1.589 13.792 1.00 7.79 O ATOM 57 OD2 ASP A 64 26.222 -2.748 12.082 1.00 8.15 O ATOM 0 H ASP A 64 25.326 1.089 14.173 1.00 6.79 H new ATOM 0 HA ASP A 64 24.712 0.016 12.189 1.00 6.25 H new ATOM 0 HB2 ASP A 64 24.327 -1.988 14.456 1.00 6.73 H new ATOM 0 HB3 ASP A 64 23.865 -2.464 12.834 1.00 6.73 H new ATOM 62 N PRO A 65 22.329 0.861 12.032 1.00 5.12 N ATOM 63 CA PRO A 65 20.905 1.092 11.679 1.00 4.72 C ATOM 64 C PRO A 65 20.425 0.099 10.607 1.00 4.13 C ATOM 65 O PRO A 65 19.258 0.072 10.266 1.00 4.11 O ATOM 66 CB PRO A 65 20.895 2.518 11.134 1.00 5.16 C ATOM 67 CG PRO A 65 22.287 2.758 10.644 1.00 5.52 C ATOM 68 CD PRO A 65 23.207 1.909 11.482 1.00 5.63 C ATOM 0 HA PRO A 65 20.238 0.953 12.530 1.00 4.72 H new ATOM 0 HB2 PRO A 65 20.169 2.627 10.328 1.00 5.16 H new ATOM 0 HB3 PRO A 65 20.621 3.234 11.909 1.00 5.16 H new ATOM 0 HG2 PRO A 65 22.374 2.495 9.590 1.00 5.52 H new ATOM 0 HG3 PRO A 65 22.550 3.812 10.732 1.00 5.52 H new ATOM 0 HD2 PRO A 65 24.011 1.481 10.883 1.00 5.63 H new ATOM 0 HD3 PRO A 65 23.676 2.492 12.274 1.00 5.63 H new ATOM 76 N ASN A 66 21.309 -0.715 10.068 1.00 4.05 N ATOM 77 CA ASN A 66 20.900 -1.704 9.014 1.00 3.77 C ATOM 78 C ASN A 66 20.174 -0.995 7.863 1.00 3.32 C ATOM 79 O ASN A 66 18.981 -1.149 7.681 1.00 3.55 O ATOM 80 CB ASN A 66 19.963 -2.692 9.719 1.00 4.14 C ATOM 81 CG ASN A 66 20.716 -3.390 10.853 1.00 4.54 C ATOM 82 OD1 ASN A 66 20.338 -3.285 12.003 1.00 4.85 O ATOM 83 ND2 ASN A 66 21.772 -4.104 10.575 1.00 5.01 N ATOM 0 H ASN A 66 22.299 -0.736 10.314 1.00 4.05 H new ATOM 0 HA ASN A 66 21.762 -2.209 8.577 1.00 3.77 H new ATOM 0 HB2 ASN A 66 19.094 -2.166 10.115 1.00 4.14 H new ATOM 0 HB3 ASN A 66 19.592 -3.429 9.007 1.00 4.14 H new ATOM 0 HD21 ASN A 66 22.281 -4.575 11.323 1.00 5.01 H new ATOM 0 HD22 ASN A 66 22.089 -4.192 9.609 1.00 5.01 H new ATOM 90 N VAL A 67 20.891 -0.220 7.090 1.00 3.08 N ATOM 91 CA VAL A 67 20.255 0.508 5.947 1.00 2.85 C ATOM 92 C VAL A 67 19.614 -0.492 4.962 1.00 2.15 C ATOM 93 O VAL A 67 20.316 -1.224 4.292 1.00 2.12 O ATOM 94 CB VAL A 67 21.396 1.282 5.270 1.00 3.52 C ATOM 95 CG1 VAL A 67 21.985 2.285 6.263 1.00 4.06 C ATOM 96 CG2 VAL A 67 22.496 0.315 4.813 1.00 3.93 C ATOM 0 H VAL A 67 21.892 -0.059 7.200 1.00 3.08 H new ATOM 0 HA VAL A 67 19.460 1.175 6.281 1.00 2.85 H new ATOM 0 HB VAL A 67 21.002 1.807 4.400 1.00 3.52 H new ATOM 0 HG11 VAL A 67 22.795 2.836 5.786 1.00 4.06 H new ATOM 0 HG12 VAL A 67 21.209 2.982 6.580 1.00 4.06 H new ATOM 0 HG13 VAL A 67 22.371 1.753 7.132 1.00 4.06 H new ATOM 0 HG21 VAL A 67 23.299 0.877 4.335 1.00 3.93 H new ATOM 0 HG22 VAL A 67 22.892 -0.220 5.676 1.00 3.93 H new ATOM 0 HG23 VAL A 67 22.080 -0.400 4.103 1.00 3.93 H new ATOM 106 N PRO A 68 18.295 -0.502 4.895 1.00 1.87 N ATOM 107 CA PRO A 68 17.603 -1.435 3.971 1.00 1.42 C ATOM 108 C PRO A 68 17.740 -0.947 2.525 1.00 1.06 C ATOM 109 O PRO A 68 18.093 0.191 2.278 1.00 1.30 O ATOM 110 CB PRO A 68 16.147 -1.382 4.423 1.00 1.76 C ATOM 111 CG PRO A 68 15.993 -0.052 5.089 1.00 2.20 C ATOM 112 CD PRO A 68 17.339 0.326 5.652 1.00 2.32 C ATOM 0 HA PRO A 68 18.013 -2.445 3.997 1.00 1.42 H new ATOM 0 HB2 PRO A 68 15.468 -1.480 3.576 1.00 1.76 H new ATOM 0 HB3 PRO A 68 15.918 -2.196 5.111 1.00 1.76 H new ATOM 0 HG2 PRO A 68 15.651 0.698 4.376 1.00 2.20 H new ATOM 0 HG3 PRO A 68 15.246 -0.103 5.881 1.00 2.20 H new ATOM 0 HD2 PRO A 68 17.541 1.389 5.520 1.00 2.32 H new ATOM 0 HD3 PRO A 68 17.395 0.121 6.721 1.00 2.32 H new ATOM 120 N ASN A 69 17.460 -1.799 1.572 1.00 0.85 N ATOM 121 CA ASN A 69 17.569 -1.390 0.139 1.00 0.72 C ATOM 122 C ASN A 69 16.263 -0.740 -0.323 1.00 0.56 C ATOM 123 O ASN A 69 16.222 0.437 -0.633 1.00 0.60 O ATOM 124 CB ASN A 69 17.825 -2.690 -0.632 1.00 0.99 C ATOM 125 CG ASN A 69 17.973 -2.393 -2.131 1.00 0.79 C ATOM 126 OD1 ASN A 69 17.698 -1.297 -2.581 1.00 1.62 O ATOM 127 ND2 ASN A 69 18.401 -3.331 -2.929 1.00 0.93 N ATOM 0 H ASN A 69 17.160 -2.762 1.725 1.00 0.85 H new ATOM 0 HA ASN A 69 18.363 -0.661 -0.022 1.00 0.72 H new ATOM 0 HB2 ASN A 69 18.728 -3.172 -0.258 1.00 0.99 H new ATOM 0 HB3 ASN A 69 17.002 -3.386 -0.471 1.00 0.99 H new ATOM 0 HD21 ASN A 69 18.504 -3.144 -3.926 1.00 0.93 H new ATOM 0 HD22 ASN A 69 18.633 -4.252 -2.556 1.00 0.93 H new ATOM 134 N VAL A 70 15.202 -1.502 -0.377 1.00 0.53 N ATOM 135 CA VAL A 70 13.894 -0.942 -0.825 1.00 0.46 C ATOM 136 C VAL A 70 12.788 -1.320 0.164 1.00 0.49 C ATOM 137 O VAL A 70 12.534 -2.483 0.415 1.00 0.93 O ATOM 138 CB VAL A 70 13.647 -1.576 -2.198 1.00 0.53 C ATOM 139 CG1 VAL A 70 12.289 -1.133 -2.748 1.00 0.60 C ATOM 140 CG2 VAL A 70 14.747 -1.127 -3.159 1.00 0.62 C ATOM 0 H VAL A 70 15.186 -2.491 -0.129 1.00 0.53 H new ATOM 0 HA VAL A 70 13.901 0.147 -0.878 1.00 0.46 H new ATOM 0 HB VAL A 70 13.654 -2.661 -2.098 1.00 0.53 H new ATOM 0 HG11 VAL A 70 12.125 -1.590 -3.724 1.00 0.60 H new ATOM 0 HG12 VAL A 70 11.500 -1.445 -2.064 1.00 0.60 H new ATOM 0 HG13 VAL A 70 12.274 -0.048 -2.848 1.00 0.60 H new ATOM 0 HG21 VAL A 70 14.579 -1.574 -4.139 1.00 0.62 H new ATOM 0 HG22 VAL A 70 14.731 -0.041 -3.248 1.00 0.62 H new ATOM 0 HG23 VAL A 70 15.717 -1.446 -2.777 1.00 0.62 H new ATOM 150 N VAL A 71 12.131 -0.338 0.718 1.00 0.39 N ATOM 151 CA VAL A 71 11.030 -0.615 1.690 1.00 0.37 C ATOM 152 C VAL A 71 9.910 0.413 1.512 1.00 0.33 C ATOM 153 O VAL A 71 10.160 1.569 1.220 1.00 0.34 O ATOM 154 CB VAL A 71 11.669 -0.483 3.077 1.00 0.40 C ATOM 155 CG1 VAL A 71 10.618 -0.751 4.160 1.00 0.45 C ATOM 156 CG2 VAL A 71 12.805 -1.501 3.215 1.00 0.47 C ATOM 0 H VAL A 71 12.309 0.650 0.539 1.00 0.39 H new ATOM 0 HA VAL A 71 10.589 -1.601 1.545 1.00 0.37 H new ATOM 0 HB VAL A 71 12.063 0.527 3.195 1.00 0.40 H new ATOM 0 HG11 VAL A 71 11.077 -0.656 5.144 1.00 0.45 H new ATOM 0 HG12 VAL A 71 9.807 -0.029 4.067 1.00 0.45 H new ATOM 0 HG13 VAL A 71 10.221 -1.759 4.041 1.00 0.45 H new ATOM 0 HG21 VAL A 71 13.260 -1.407 4.201 1.00 0.47 H new ATOM 0 HG22 VAL A 71 12.407 -2.509 3.093 1.00 0.47 H new ATOM 0 HG23 VAL A 71 13.557 -1.313 2.449 1.00 0.47 H new ATOM 166 N VAL A 72 8.680 0.001 1.687 1.00 0.33 N ATOM 167 CA VAL A 72 7.539 0.954 1.532 1.00 0.33 C ATOM 168 C VAL A 72 7.648 2.062 2.580 1.00 0.33 C ATOM 169 O VAL A 72 7.385 1.850 3.748 1.00 0.40 O ATOM 170 CB VAL A 72 6.270 0.126 1.759 1.00 0.37 C ATOM 171 CG1 VAL A 72 5.041 1.015 1.567 1.00 0.41 C ATOM 172 CG2 VAL A 72 6.216 -1.027 0.755 1.00 0.43 C ATOM 0 H VAL A 72 8.416 -0.954 1.930 1.00 0.33 H new ATOM 0 HA VAL A 72 7.532 1.429 0.551 1.00 0.33 H new ATOM 0 HB VAL A 72 6.282 -0.275 2.772 1.00 0.37 H new ATOM 0 HG11 VAL A 72 4.138 0.427 1.728 1.00 0.41 H new ATOM 0 HG12 VAL A 72 5.071 1.837 2.282 1.00 0.41 H new ATOM 0 HG13 VAL A 72 5.037 1.416 0.553 1.00 0.41 H new ATOM 0 HG21 VAL A 72 5.312 -1.612 0.921 1.00 0.43 H new ATOM 0 HG22 VAL A 72 6.208 -0.627 -0.259 1.00 0.43 H new ATOM 0 HG23 VAL A 72 7.090 -1.665 0.886 1.00 0.43 H new ATOM 182 N THR A 73 8.035 3.240 2.167 1.00 0.32 N ATOM 183 CA THR A 73 8.164 4.370 3.139 1.00 0.36 C ATOM 184 C THR A 73 6.779 4.852 3.571 1.00 0.36 C ATOM 185 O THR A 73 6.500 4.984 4.748 1.00 0.46 O ATOM 186 CB THR A 73 8.903 5.479 2.387 1.00 0.40 C ATOM 187 OG1 THR A 73 8.204 5.788 1.191 1.00 0.40 O ATOM 188 CG2 THR A 73 10.319 5.014 2.049 1.00 0.44 C ATOM 0 H THR A 73 8.267 3.470 1.201 1.00 0.32 H new ATOM 0 HA THR A 73 8.699 4.071 4.041 1.00 0.36 H new ATOM 0 HB THR A 73 8.957 6.369 3.015 1.00 0.40 H new ATOM 0 HG1 THR A 73 8.823 6.185 0.544 1.00 0.40 H new ATOM 0 HG21 THR A 73 10.844 5.805 1.513 1.00 0.44 H new ATOM 0 HG22 THR A 73 10.855 4.782 2.969 1.00 0.44 H new ATOM 0 HG23 THR A 73 10.270 4.123 1.423 1.00 0.44 H new ATOM 196 N ARG A 74 5.913 5.115 2.627 1.00 0.35 N ATOM 197 CA ARG A 74 4.542 5.590 2.976 1.00 0.38 C ATOM 198 C ARG A 74 3.532 5.119 1.926 1.00 0.37 C ATOM 199 O ARG A 74 3.898 4.620 0.879 1.00 0.41 O ATOM 200 CB ARG A 74 4.640 7.115 2.979 1.00 0.42 C ATOM 201 CG ARG A 74 4.918 7.607 4.400 1.00 0.80 C ATOM 202 CD ARG A 74 4.377 9.029 4.564 1.00 1.28 C ATOM 203 NE ARG A 74 4.704 9.405 5.967 1.00 1.59 N ATOM 204 CZ ARG A 74 4.972 10.648 6.265 1.00 1.93 C ATOM 205 NH1 ARG A 74 4.107 11.585 5.991 1.00 2.46 N ATOM 206 NH2 ARG A 74 6.105 10.952 6.836 1.00 2.35 N ATOM 0 H ARG A 74 6.097 5.021 1.628 1.00 0.35 H new ATOM 0 HA ARG A 74 4.204 5.201 3.936 1.00 0.38 H new ATOM 0 HB2 ARG A 74 5.436 7.440 2.308 1.00 0.42 H new ATOM 0 HB3 ARG A 74 3.712 7.550 2.607 1.00 0.42 H new ATOM 0 HG2 ARG A 74 4.448 6.942 5.125 1.00 0.80 H new ATOM 0 HG3 ARG A 74 5.990 7.589 4.599 1.00 0.80 H new ATOM 0 HD2 ARG A 74 4.842 9.713 3.853 1.00 1.28 H new ATOM 0 HD3 ARG A 74 3.302 9.066 4.386 1.00 1.28 H new ATOM 0 HE ARG A 74 4.719 8.691 6.696 1.00 1.59 H new ATOM 0 HH11 ARG A 74 3.222 11.347 5.544 1.00 2.46 H new ATOM 0 HH12 ARG A 74 4.316 12.556 6.224 1.00 2.46 H new ATOM 0 HH21 ARG A 74 6.781 10.219 7.050 1.00 2.35 H new ATOM 0 HH22 ARG A 74 6.314 11.923 7.069 1.00 2.35 H new ATOM 220 N LEU A 75 2.264 5.278 2.204 1.00 0.42 N ATOM 221 CA LEU A 75 1.213 4.847 1.235 1.00 0.41 C ATOM 222 C LEU A 75 0.137 5.930 1.125 1.00 0.40 C ATOM 223 O LEU A 75 -0.477 6.303 2.106 1.00 0.54 O ATOM 224 CB LEU A 75 0.634 3.563 1.833 1.00 0.44 C ATOM 225 CG LEU A 75 -0.455 3.003 0.916 1.00 0.46 C ATOM 226 CD1 LEU A 75 -0.563 1.492 1.124 1.00 0.55 C ATOM 227 CD2 LEU A 75 -1.798 3.656 1.256 1.00 0.56 C ATOM 0 H LEU A 75 1.909 5.691 3.067 1.00 0.42 H new ATOM 0 HA LEU A 75 1.605 4.684 0.231 1.00 0.41 H new ATOM 0 HB2 LEU A 75 1.425 2.825 1.965 1.00 0.44 H new ATOM 0 HB3 LEU A 75 0.220 3.767 2.821 1.00 0.44 H new ATOM 0 HG LEU A 75 -0.199 3.215 -0.122 1.00 0.46 H new ATOM 0 HD11 LEU A 75 -1.338 1.089 0.472 1.00 0.55 H new ATOM 0 HD12 LEU A 75 0.391 1.023 0.885 1.00 0.55 H new ATOM 0 HD13 LEU A 75 -0.819 1.285 2.163 1.00 0.55 H new ATOM 0 HD21 LEU A 75 -2.573 3.256 0.602 1.00 0.56 H new ATOM 0 HD22 LEU A 75 -2.054 3.443 2.294 1.00 0.56 H new ATOM 0 HD23 LEU A 75 -1.725 4.734 1.114 1.00 0.56 H new ATOM 239 N THR A 76 -0.093 6.438 -0.060 1.00 0.39 N ATOM 240 CA THR A 76 -1.129 7.505 -0.231 1.00 0.38 C ATOM 241 C THR A 76 -2.342 6.963 -0.994 1.00 0.37 C ATOM 242 O THR A 76 -2.270 5.934 -1.639 1.00 0.41 O ATOM 243 CB THR A 76 -0.436 8.605 -1.036 1.00 0.42 C ATOM 244 OG1 THR A 76 0.835 8.879 -0.462 1.00 0.51 O ATOM 245 CG2 THR A 76 -1.293 9.871 -1.014 1.00 0.44 C ATOM 0 H THR A 76 0.390 6.162 -0.915 1.00 0.39 H new ATOM 0 HA THR A 76 -1.501 7.870 0.726 1.00 0.38 H new ATOM 0 HB THR A 76 -0.306 8.276 -2.067 1.00 0.42 H new ATOM 0 HG1 THR A 76 1.282 9.583 -0.977 1.00 0.51 H new ATOM 0 HG21 THR A 76 -0.799 10.655 -1.588 1.00 0.44 H new ATOM 0 HG22 THR A 76 -2.267 9.659 -1.454 1.00 0.44 H new ATOM 0 HG23 THR A 76 -1.425 10.203 0.016 1.00 0.44 H new ATOM 253 N LEU A 77 -3.456 7.652 -0.923 1.00 0.35 N ATOM 254 CA LEU A 77 -4.680 7.185 -1.642 1.00 0.38 C ATOM 255 C LEU A 77 -5.494 8.387 -2.128 1.00 0.40 C ATOM 256 O LEU A 77 -6.209 9.010 -1.366 1.00 0.46 O ATOM 257 CB LEU A 77 -5.470 6.388 -0.602 1.00 0.41 C ATOM 258 CG LEU A 77 -5.137 4.900 -0.735 1.00 0.56 C ATOM 259 CD1 LEU A 77 -5.162 4.246 0.648 1.00 0.64 C ATOM 260 CD2 LEU A 77 -6.173 4.223 -1.635 1.00 0.66 C ATOM 0 H LEU A 77 -3.569 8.519 -0.397 1.00 0.35 H new ATOM 0 HA LEU A 77 -4.442 6.585 -2.520 1.00 0.38 H new ATOM 0 HB2 LEU A 77 -5.226 6.737 0.401 1.00 0.41 H new ATOM 0 HB3 LEU A 77 -6.539 6.546 -0.743 1.00 0.41 H new ATOM 0 HG LEU A 77 -4.145 4.789 -1.173 1.00 0.56 H new ATOM 0 HD11 LEU A 77 -4.925 3.186 0.554 1.00 0.64 H new ATOM 0 HD12 LEU A 77 -4.425 4.727 1.291 1.00 0.64 H new ATOM 0 HD13 LEU A 77 -6.154 4.358 1.086 1.00 0.64 H new ATOM 0 HD21 LEU A 77 -5.936 3.163 -1.730 1.00 0.66 H new ATOM 0 HD22 LEU A 77 -7.165 4.335 -1.197 1.00 0.66 H new ATOM 0 HD23 LEU A 77 -6.158 4.688 -2.621 1.00 0.66 H new ATOM 272 N VAL A 78 -5.385 8.716 -3.391 1.00 0.49 N ATOM 273 CA VAL A 78 -6.146 9.882 -3.937 1.00 0.57 C ATOM 274 C VAL A 78 -7.424 9.404 -4.635 1.00 0.50 C ATOM 275 O VAL A 78 -7.592 8.229 -4.905 1.00 0.46 O ATOM 276 CB VAL A 78 -5.196 10.544 -4.945 1.00 0.63 C ATOM 277 CG1 VAL A 78 -5.871 11.775 -5.557 1.00 0.72 C ATOM 278 CG2 VAL A 78 -3.908 10.974 -4.234 1.00 0.80 C ATOM 0 H VAL A 78 -4.801 8.227 -4.069 1.00 0.49 H new ATOM 0 HA VAL A 78 -6.454 10.574 -3.154 1.00 0.57 H new ATOM 0 HB VAL A 78 -4.956 9.830 -5.733 1.00 0.63 H new ATOM 0 HG11 VAL A 78 -5.195 12.243 -6.272 1.00 0.72 H new ATOM 0 HG12 VAL A 78 -6.786 11.473 -6.067 1.00 0.72 H new ATOM 0 HG13 VAL A 78 -6.114 12.487 -4.768 1.00 0.72 H new ATOM 0 HG21 VAL A 78 -3.235 11.444 -4.952 1.00 0.80 H new ATOM 0 HG22 VAL A 78 -4.149 11.685 -3.444 1.00 0.80 H new ATOM 0 HG23 VAL A 78 -3.423 10.100 -3.800 1.00 0.80 H new ATOM 288 N CYS A 79 -8.320 10.311 -4.928 1.00 0.70 N ATOM 289 CA CYS A 79 -9.592 9.928 -5.611 1.00 0.75 C ATOM 290 C CYS A 79 -10.224 11.159 -6.269 1.00 0.83 C ATOM 291 O CYS A 79 -9.592 12.189 -6.409 1.00 1.51 O ATOM 292 CB CYS A 79 -10.494 9.393 -4.496 1.00 0.89 C ATOM 293 SG CYS A 79 -11.474 8.002 -5.116 1.00 1.56 S ATOM 0 H CYS A 79 -8.225 11.306 -4.722 1.00 0.70 H new ATOM 0 HA CYS A 79 -9.436 9.189 -6.397 1.00 0.75 H new ATOM 0 HB2 CYS A 79 -9.889 9.074 -3.647 1.00 0.89 H new ATOM 0 HB3 CYS A 79 -11.153 10.184 -4.138 1.00 0.89 H new ATOM 0 HG CYS A 79 -11.221 7.821 -6.378 1.00 1.56 H new ATOM 299 N SER A 80 -11.465 11.057 -6.670 1.00 0.91 N ATOM 300 CA SER A 80 -12.147 12.218 -7.318 1.00 0.96 C ATOM 301 C SER A 80 -13.071 12.915 -6.316 1.00 0.74 C ATOM 302 O SER A 80 -13.305 14.106 -6.399 1.00 0.84 O ATOM 303 CB SER A 80 -12.957 11.611 -8.462 1.00 1.24 C ATOM 304 OG SER A 80 -13.914 10.705 -7.929 1.00 1.82 O ATOM 0 H SER A 80 -12.037 10.218 -6.576 1.00 0.91 H new ATOM 0 HA SER A 80 -11.440 12.968 -7.672 1.00 0.96 H new ATOM 0 HB2 SER A 80 -13.458 12.398 -9.026 1.00 1.24 H new ATOM 0 HB3 SER A 80 -12.296 11.093 -9.157 1.00 1.24 H new ATOM 0 HG SER A 80 -14.437 10.314 -8.660 1.00 1.82 H new ATOM 310 N THR A 81 -13.596 12.177 -5.372 1.00 0.78 N ATOM 311 CA THR A 81 -14.508 12.783 -4.356 1.00 0.66 C ATOM 312 C THR A 81 -14.110 12.327 -2.950 1.00 0.64 C ATOM 313 O THR A 81 -14.948 12.147 -2.087 1.00 0.83 O ATOM 314 CB THR A 81 -15.903 12.265 -4.714 1.00 0.84 C ATOM 315 OG1 THR A 81 -15.821 10.891 -5.071 1.00 1.02 O ATOM 316 CG2 THR A 81 -16.462 13.067 -5.890 1.00 0.98 C ATOM 0 H THR A 81 -13.431 11.177 -5.261 1.00 0.78 H new ATOM 0 HA THR A 81 -14.465 13.872 -4.361 1.00 0.66 H new ATOM 0 HB THR A 81 -16.563 12.378 -3.854 1.00 0.84 H new ATOM 0 HG1 THR A 81 -16.714 10.558 -5.299 1.00 1.02 H new ATOM 0 HG21 THR A 81 -17.455 12.697 -6.143 1.00 0.98 H new ATOM 0 HG22 THR A 81 -16.526 14.120 -5.615 1.00 0.98 H new ATOM 0 HG23 THR A 81 -15.803 12.957 -6.751 1.00 0.98 H new ATOM 324 N ALA A 82 -12.836 12.136 -2.719 1.00 0.56 N ATOM 325 CA ALA A 82 -12.370 11.688 -1.374 1.00 0.59 C ATOM 326 C ALA A 82 -12.061 12.899 -0.482 1.00 0.53 C ATOM 327 O ALA A 82 -11.916 14.000 -0.975 1.00 0.57 O ATOM 328 CB ALA A 82 -11.097 10.888 -1.649 1.00 0.70 C ATOM 0 H ALA A 82 -12.096 12.272 -3.408 1.00 0.56 H new ATOM 0 HA ALA A 82 -13.123 11.098 -0.852 1.00 0.59 H new ATOM 0 HB1 ALA A 82 -10.688 10.520 -0.708 1.00 0.70 H new ATOM 0 HB2 ALA A 82 -11.331 10.044 -2.297 1.00 0.70 H new ATOM 0 HB3 ALA A 82 -10.363 11.529 -2.138 1.00 0.70 H new ATOM 334 N PRO A 83 -11.963 12.664 0.809 1.00 0.51 N ATOM 335 CA PRO A 83 -11.660 13.771 1.749 1.00 0.53 C ATOM 336 C PRO A 83 -10.212 14.236 1.572 1.00 0.49 C ATOM 337 O PRO A 83 -9.882 15.374 1.847 1.00 0.55 O ATOM 338 CB PRO A 83 -11.873 13.147 3.127 1.00 0.62 C ATOM 339 CG PRO A 83 -11.675 11.681 2.920 1.00 0.60 C ATOM 340 CD PRO A 83 -12.118 11.377 1.513 1.00 0.55 C ATOM 0 HA PRO A 83 -12.283 14.651 1.591 1.00 0.53 H new ATOM 0 HB2 PRO A 83 -11.164 13.543 3.854 1.00 0.62 H new ATOM 0 HB3 PRO A 83 -12.872 13.361 3.507 1.00 0.62 H new ATOM 0 HG2 PRO A 83 -10.630 11.408 3.064 1.00 0.60 H new ATOM 0 HG3 PRO A 83 -12.257 11.107 3.641 1.00 0.60 H new ATOM 0 HD2 PRO A 83 -11.505 10.597 1.060 1.00 0.55 H new ATOM 0 HD3 PRO A 83 -13.150 11.028 1.485 1.00 0.55 H new ATOM 348 N GLY A 84 -9.347 13.364 1.111 1.00 0.46 N ATOM 349 CA GLY A 84 -7.920 13.758 0.911 1.00 0.51 C ATOM 350 C GLY A 84 -7.048 12.505 0.731 1.00 0.46 C ATOM 351 O GLY A 84 -7.521 11.400 0.903 1.00 0.45 O ATOM 0 H GLY A 84 -9.569 12.399 0.866 1.00 0.46 H new ATOM 0 HA2 GLY A 84 -7.831 14.401 0.036 1.00 0.51 H new ATOM 0 HA3 GLY A 84 -7.570 14.335 1.767 1.00 0.51 H new ATOM 355 N PRO A 85 -5.791 12.714 0.390 1.00 0.47 N ATOM 356 CA PRO A 85 -4.862 11.571 0.193 1.00 0.46 C ATOM 357 C PRO A 85 -4.499 10.942 1.540 1.00 0.47 C ATOM 358 O PRO A 85 -3.645 11.436 2.253 1.00 0.51 O ATOM 359 CB PRO A 85 -3.634 12.209 -0.453 1.00 0.51 C ATOM 360 CG PRO A 85 -3.672 13.641 -0.028 1.00 0.55 C ATOM 361 CD PRO A 85 -5.121 14.007 0.159 1.00 0.52 C ATOM 0 HA PRO A 85 -5.290 10.773 -0.414 1.00 0.46 H new ATOM 0 HB2 PRO A 85 -2.716 11.723 -0.121 1.00 0.51 H new ATOM 0 HB3 PRO A 85 -3.668 12.119 -1.539 1.00 0.51 H new ATOM 0 HG2 PRO A 85 -3.116 13.783 0.899 1.00 0.55 H new ATOM 0 HG3 PRO A 85 -3.207 14.279 -0.780 1.00 0.55 H new ATOM 0 HD2 PRO A 85 -5.256 14.682 1.004 1.00 0.52 H new ATOM 0 HD3 PRO A 85 -5.521 14.512 -0.720 1.00 0.52 H new ATOM 369 N LEU A 86 -5.139 9.855 1.888 1.00 0.48 N ATOM 370 CA LEU A 86 -4.830 9.189 3.190 1.00 0.52 C ATOM 371 C LEU A 86 -3.393 8.664 3.173 1.00 0.53 C ATOM 372 O LEU A 86 -3.019 7.886 2.315 1.00 0.56 O ATOM 373 CB LEU A 86 -5.826 8.034 3.302 1.00 0.57 C ATOM 374 CG LEU A 86 -7.236 8.594 3.498 1.00 0.62 C ATOM 375 CD1 LEU A 86 -8.258 7.636 2.883 1.00 0.74 C ATOM 376 CD2 LEU A 86 -7.519 8.747 4.994 1.00 0.70 C ATOM 0 H LEU A 86 -5.861 9.400 1.329 1.00 0.48 H new ATOM 0 HA LEU A 86 -4.915 9.871 4.036 1.00 0.52 H new ATOM 0 HB2 LEU A 86 -5.789 7.419 2.403 1.00 0.57 H new ATOM 0 HB3 LEU A 86 -5.559 7.390 4.140 1.00 0.57 H new ATOM 0 HG LEU A 86 -7.311 9.566 3.010 1.00 0.62 H new ATOM 0 HD11 LEU A 86 -9.262 8.036 3.023 1.00 0.74 H new ATOM 0 HD12 LEU A 86 -8.057 7.525 1.817 1.00 0.74 H new ATOM 0 HD13 LEU A 86 -8.184 6.663 3.369 1.00 0.74 H new ATOM 0 HD21 LEU A 86 -8.523 9.146 5.135 1.00 0.70 H new ATOM 0 HD22 LEU A 86 -7.443 7.774 5.480 1.00 0.70 H new ATOM 0 HD23 LEU A 86 -6.792 9.430 5.434 1.00 0.70 H new ATOM 388 N GLU A 87 -2.584 9.093 4.109 1.00 0.54 N ATOM 389 CA GLU A 87 -1.164 8.633 4.148 1.00 0.56 C ATOM 390 C GLU A 87 -0.955 7.616 5.273 1.00 0.55 C ATOM 391 O GLU A 87 -1.224 7.891 6.428 1.00 0.80 O ATOM 392 CB GLU A 87 -0.347 9.898 4.414 1.00 0.62 C ATOM 393 CG GLU A 87 -0.138 10.657 3.103 1.00 0.93 C ATOM 394 CD GLU A 87 0.530 12.003 3.392 1.00 1.18 C ATOM 395 OE1 GLU A 87 0.072 12.687 4.292 1.00 1.81 O ATOM 396 OE2 GLU A 87 1.488 12.325 2.710 1.00 1.57 O ATOM 0 H GLU A 87 -2.847 9.744 4.849 1.00 0.54 H new ATOM 0 HA GLU A 87 -0.870 8.139 3.222 1.00 0.56 H new ATOM 0 HB2 GLU A 87 -0.863 10.532 5.135 1.00 0.62 H new ATOM 0 HB3 GLU A 87 0.616 9.636 4.852 1.00 0.62 H new ATOM 0 HG2 GLU A 87 0.482 10.070 2.426 1.00 0.93 H new ATOM 0 HG3 GLU A 87 -1.095 10.814 2.605 1.00 0.93 H new ATOM 403 N LEU A 88 -0.467 6.447 4.942 1.00 0.43 N ATOM 404 CA LEU A 88 -0.224 5.406 5.985 1.00 0.44 C ATOM 405 C LEU A 88 1.280 5.273 6.242 1.00 0.45 C ATOM 406 O LEU A 88 2.084 5.395 5.337 1.00 0.67 O ATOM 407 CB LEU A 88 -0.793 4.109 5.399 1.00 0.48 C ATOM 408 CG LEU A 88 -2.122 3.773 6.082 1.00 0.61 C ATOM 409 CD1 LEU A 88 -2.876 2.734 5.250 1.00 0.61 C ATOM 410 CD2 LEU A 88 -1.852 3.211 7.481 1.00 1.05 C ATOM 0 H LEU A 88 -0.226 6.169 3.991 1.00 0.43 H new ATOM 0 HA LEU A 88 -0.692 5.652 6.938 1.00 0.44 H new ATOM 0 HB2 LEU A 88 -0.943 4.219 4.325 1.00 0.48 H new ATOM 0 HB3 LEU A 88 -0.084 3.293 5.540 1.00 0.48 H new ATOM 0 HG LEU A 88 -2.725 4.677 6.166 1.00 0.61 H new ATOM 0 HD11 LEU A 88 -3.822 2.495 5.736 1.00 0.61 H new ATOM 0 HD12 LEU A 88 -3.071 3.136 4.256 1.00 0.61 H new ATOM 0 HD13 LEU A 88 -2.274 1.830 5.164 1.00 0.61 H new ATOM 0 HD21 LEU A 88 -2.798 2.972 7.966 1.00 1.05 H new ATOM 0 HD22 LEU A 88 -1.248 2.307 7.400 1.00 1.05 H new ATOM 0 HD23 LEU A 88 -1.317 3.953 8.074 1.00 1.05 H new ATOM 422 N ASP A 89 1.662 5.035 7.470 1.00 0.40 N ATOM 423 CA ASP A 89 3.115 4.905 7.798 1.00 0.41 C ATOM 424 C ASP A 89 3.588 3.462 7.599 1.00 0.38 C ATOM 425 O ASP A 89 2.990 2.528 8.096 1.00 0.40 O ATOM 426 CB ASP A 89 3.224 5.305 9.270 1.00 0.48 C ATOM 427 CG ASP A 89 4.571 5.988 9.514 1.00 0.60 C ATOM 428 OD1 ASP A 89 4.803 7.026 8.918 1.00 1.33 O ATOM 429 OD2 ASP A 89 5.347 5.460 10.294 1.00 1.17 O ATOM 0 H ASP A 89 1.029 4.925 8.262 1.00 0.40 H new ATOM 0 HA ASP A 89 3.736 5.528 7.154 1.00 0.41 H new ATOM 0 HB2 ASP A 89 2.409 5.978 9.536 1.00 0.48 H new ATOM 0 HB3 ASP A 89 3.130 4.424 9.905 1.00 0.48 H new ATOM 434 N LEU A 90 4.663 3.278 6.875 1.00 0.35 N ATOM 435 CA LEU A 90 5.189 1.900 6.639 1.00 0.34 C ATOM 436 C LEU A 90 6.683 1.843 6.965 1.00 0.35 C ATOM 437 O LEU A 90 7.481 1.366 6.181 1.00 0.38 O ATOM 438 CB LEU A 90 4.944 1.637 5.151 1.00 0.37 C ATOM 439 CG LEU A 90 3.488 1.188 4.941 1.00 0.35 C ATOM 440 CD1 LEU A 90 2.863 1.975 3.784 1.00 0.55 C ATOM 441 CD2 LEU A 90 3.453 -0.310 4.617 1.00 0.65 C ATOM 0 H LEU A 90 5.200 4.026 6.436 1.00 0.35 H new ATOM 0 HA LEU A 90 4.703 1.154 7.268 1.00 0.34 H new ATOM 0 HB2 LEU A 90 5.144 2.540 4.574 1.00 0.37 H new ATOM 0 HB3 LEU A 90 5.628 0.869 4.789 1.00 0.37 H new ATOM 0 HG LEU A 90 2.921 1.377 5.853 1.00 0.35 H new ATOM 0 HD11 LEU A 90 1.832 1.653 3.640 1.00 0.55 H new ATOM 0 HD12 LEU A 90 2.881 3.040 4.016 1.00 0.55 H new ATOM 0 HD13 LEU A 90 3.431 1.793 2.872 1.00 0.55 H new ATOM 0 HD21 LEU A 90 2.420 -0.626 4.469 1.00 0.65 H new ATOM 0 HD22 LEU A 90 4.025 -0.499 3.708 1.00 0.65 H new ATOM 0 HD23 LEU A 90 3.889 -0.871 5.443 1.00 0.65 H new ATOM 453 N THR A 91 7.062 2.326 8.121 1.00 0.34 N ATOM 454 CA THR A 91 8.504 2.305 8.512 1.00 0.37 C ATOM 455 C THR A 91 8.700 1.458 9.772 1.00 0.47 C ATOM 456 O THR A 91 9.339 0.422 9.739 1.00 0.97 O ATOM 457 CB THR A 91 8.860 3.767 8.787 1.00 0.53 C ATOM 458 OG1 THR A 91 7.896 4.330 9.666 1.00 0.64 O ATOM 459 CG2 THR A 91 8.871 4.547 7.471 1.00 0.73 C ATOM 0 H THR A 91 6.433 2.735 8.812 1.00 0.34 H new ATOM 0 HA THR A 91 9.135 1.870 7.737 1.00 0.37 H new ATOM 0 HB THR A 91 9.847 3.821 9.247 1.00 0.53 H new ATOM 0 HG1 THR A 91 7.113 4.617 9.152 1.00 0.64 H new ATOM 0 HG21 THR A 91 9.125 5.589 7.668 1.00 0.73 H new ATOM 0 HG22 THR A 91 9.611 4.114 6.798 1.00 0.73 H new ATOM 0 HG23 THR A 91 7.885 4.495 7.009 1.00 0.73 H new ATOM 467 N GLY A 92 8.157 1.892 10.881 1.00 0.73 N ATOM 468 CA GLY A 92 8.309 1.118 12.149 1.00 0.91 C ATOM 469 C GLY A 92 6.955 1.016 12.855 1.00 0.71 C ATOM 470 O GLY A 92 6.496 -0.064 13.179 1.00 0.80 O ATOM 0 H GLY A 92 7.614 2.751 10.963 1.00 0.73 H new ATOM 0 HA2 GLY A 92 8.694 0.121 11.934 1.00 0.91 H new ATOM 0 HA3 GLY A 92 9.034 1.606 12.800 1.00 0.91 H new ATOM 474 N ASP A 93 6.315 2.132 13.095 1.00 0.74 N ATOM 475 CA ASP A 93 4.987 2.107 13.784 1.00 0.81 C ATOM 476 C ASP A 93 3.919 1.525 12.851 1.00 0.62 C ATOM 477 O ASP A 93 3.045 2.226 12.376 1.00 0.59 O ATOM 478 CB ASP A 93 4.676 3.570 14.113 1.00 1.14 C ATOM 479 CG ASP A 93 5.303 3.935 15.460 1.00 1.93 C ATOM 480 OD1 ASP A 93 6.433 3.537 15.692 1.00 2.52 O ATOM 481 OD2 ASP A 93 4.643 4.605 16.236 1.00 2.58 O ATOM 0 H ASP A 93 6.654 3.061 12.844 1.00 0.74 H new ATOM 0 HA ASP A 93 5.000 1.486 14.680 1.00 0.81 H new ATOM 0 HB2 ASP A 93 5.066 4.221 13.330 1.00 1.14 H new ATOM 0 HB3 ASP A 93 3.598 3.725 14.148 1.00 1.14 H new ATOM 486 N LEU A 94 3.988 0.245 12.588 1.00 0.59 N ATOM 487 CA LEU A 94 2.985 -0.398 11.686 1.00 0.50 C ATOM 488 C LEU A 94 1.844 -1.023 12.502 1.00 0.53 C ATOM 489 O LEU A 94 0.761 -1.241 11.994 1.00 0.46 O ATOM 490 CB LEU A 94 3.764 -1.484 10.942 1.00 0.59 C ATOM 491 CG LEU A 94 4.219 -0.950 9.582 1.00 0.67 C ATOM 492 CD1 LEU A 94 5.122 -1.981 8.904 1.00 1.17 C ATOM 493 CD2 LEU A 94 2.994 -0.689 8.702 1.00 0.98 C ATOM 0 H LEU A 94 4.699 -0.385 12.961 1.00 0.59 H new ATOM 0 HA LEU A 94 2.527 0.321 11.007 1.00 0.50 H new ATOM 0 HB2 LEU A 94 4.628 -1.793 11.530 1.00 0.59 H new ATOM 0 HB3 LEU A 94 3.138 -2.366 10.807 1.00 0.59 H new ATOM 0 HG LEU A 94 4.771 -0.021 9.723 1.00 0.67 H new ATOM 0 HD11 LEU A 94 5.446 -1.600 7.935 1.00 1.17 H new ATOM 0 HD12 LEU A 94 5.994 -2.168 9.530 1.00 1.17 H new ATOM 0 HD13 LEU A 94 4.571 -2.911 8.762 1.00 1.17 H new ATOM 0 HD21 LEU A 94 3.317 -0.309 7.733 1.00 0.98 H new ATOM 0 HD22 LEU A 94 2.442 -1.618 8.562 1.00 0.98 H new ATOM 0 HD23 LEU A 94 2.350 0.046 9.184 1.00 0.98 H new ATOM 505 N GLU A 95 2.081 -1.318 13.758 1.00 0.72 N ATOM 506 CA GLU A 95 1.011 -1.938 14.608 1.00 0.79 C ATOM 507 C GLU A 95 -0.249 -1.062 14.624 1.00 0.63 C ATOM 508 O GLU A 95 -1.346 -1.547 14.826 1.00 0.64 O ATOM 509 CB GLU A 95 1.614 -2.029 16.012 1.00 1.06 C ATOM 510 CG GLU A 95 2.225 -3.416 16.218 1.00 1.85 C ATOM 511 CD GLU A 95 3.121 -3.401 17.458 1.00 2.36 C ATOM 512 OE1 GLU A 95 2.595 -3.570 18.546 1.00 3.06 O ATOM 513 OE2 GLU A 95 4.317 -3.219 17.299 1.00 2.63 O ATOM 0 H GLU A 95 2.969 -1.157 14.233 1.00 0.72 H new ATOM 0 HA GLU A 95 0.709 -2.914 14.227 1.00 0.79 H new ATOM 0 HB2 GLU A 95 2.377 -1.261 16.142 1.00 1.06 H new ATOM 0 HB3 GLU A 95 0.845 -1.844 16.762 1.00 1.06 H new ATOM 0 HG2 GLU A 95 1.436 -4.159 16.336 1.00 1.85 H new ATOM 0 HG3 GLU A 95 2.805 -3.703 15.341 1.00 1.85 H new ATOM 520 N SER A 96 -0.097 0.221 14.415 1.00 0.59 N ATOM 521 CA SER A 96 -1.287 1.131 14.418 1.00 0.56 C ATOM 522 C SER A 96 -2.234 0.793 13.257 1.00 0.43 C ATOM 523 O SER A 96 -3.388 1.178 13.262 1.00 0.54 O ATOM 524 CB SER A 96 -0.716 2.539 14.247 1.00 0.71 C ATOM 525 OG SER A 96 -1.631 3.485 14.784 1.00 1.48 O ATOM 0 H SER A 96 0.798 0.679 14.242 1.00 0.59 H new ATOM 0 HA SER A 96 -1.868 1.033 15.335 1.00 0.56 H new ATOM 0 HB2 SER A 96 0.246 2.618 14.754 1.00 0.71 H new ATOM 0 HB3 SER A 96 -0.538 2.746 13.192 1.00 0.71 H new ATOM 0 HG SER A 96 -1.267 4.389 14.677 1.00 1.48 H new ATOM 531 N PHE A 97 -1.756 0.083 12.263 1.00 0.37 N ATOM 532 CA PHE A 97 -2.629 -0.274 11.098 1.00 0.45 C ATOM 533 C PHE A 97 -3.851 -1.071 11.566 1.00 0.47 C ATOM 534 O PHE A 97 -4.978 -0.735 11.254 1.00 0.57 O ATOM 535 CB PHE A 97 -1.749 -1.136 10.187 1.00 0.63 C ATOM 536 CG PHE A 97 -0.957 -0.254 9.246 1.00 0.65 C ATOM 537 CD1 PHE A 97 -0.215 0.826 9.745 1.00 1.32 C ATOM 538 CD2 PHE A 97 -0.964 -0.519 7.872 1.00 1.45 C ATOM 539 CE1 PHE A 97 0.517 1.636 8.871 1.00 1.47 C ATOM 540 CE2 PHE A 97 -0.230 0.292 6.997 1.00 1.68 C ATOM 541 CZ PHE A 97 0.510 1.370 7.497 1.00 1.24 C ATOM 0 H PHE A 97 -0.799 -0.265 12.207 1.00 0.37 H new ATOM 0 HA PHE A 97 -3.006 0.612 10.586 1.00 0.45 H new ATOM 0 HB2 PHE A 97 -1.071 -1.741 10.789 1.00 0.63 H new ATOM 0 HB3 PHE A 97 -2.369 -1.826 9.616 1.00 0.63 H new ATOM 0 HD1 PHE A 97 -0.209 1.032 10.805 1.00 1.32 H new ATOM 0 HD2 PHE A 97 -1.536 -1.350 7.486 1.00 1.45 H new ATOM 0 HE1 PHE A 97 1.088 2.468 9.257 1.00 1.47 H new ATOM 0 HE2 PHE A 97 -0.235 0.086 5.937 1.00 1.68 H new ATOM 0 HZ PHE A 97 1.075 1.996 6.823 1.00 1.24 H new ATOM 551 N LYS A 98 -3.632 -2.126 12.309 1.00 0.54 N ATOM 552 CA LYS A 98 -4.778 -2.956 12.800 1.00 0.66 C ATOM 553 C LYS A 98 -5.656 -2.162 13.780 1.00 0.65 C ATOM 554 O LYS A 98 -6.755 -2.574 14.102 1.00 0.79 O ATOM 555 CB LYS A 98 -4.140 -4.161 13.504 1.00 0.78 C ATOM 556 CG LYS A 98 -3.216 -3.683 14.629 1.00 1.09 C ATOM 557 CD LYS A 98 -3.159 -4.746 15.729 1.00 1.52 C ATOM 558 CE LYS A 98 -2.126 -5.812 15.357 1.00 1.88 C ATOM 559 NZ LYS A 98 -2.353 -6.921 16.325 1.00 2.21 N ATOM 0 H LYS A 98 -2.709 -2.450 12.598 1.00 0.54 H new ATOM 0 HA LYS A 98 -5.428 -3.261 11.980 1.00 0.66 H new ATOM 0 HB2 LYS A 98 -4.917 -4.808 13.911 1.00 0.78 H new ATOM 0 HB3 LYS A 98 -3.575 -4.755 12.786 1.00 0.78 H new ATOM 0 HG2 LYS A 98 -2.216 -3.495 14.238 1.00 1.09 H new ATOM 0 HG3 LYS A 98 -3.580 -2.741 15.038 1.00 1.09 H new ATOM 0 HD2 LYS A 98 -2.895 -4.285 16.681 1.00 1.52 H new ATOM 0 HD3 LYS A 98 -4.140 -5.204 15.858 1.00 1.52 H new ATOM 0 HE2 LYS A 98 -2.260 -6.151 14.330 1.00 1.88 H new ATOM 0 HE3 LYS A 98 -1.111 -5.422 15.434 1.00 1.88 H new ATOM 0 HZ1 LYS A 98 -1.681 -7.692 16.134 1.00 2.21 H new ATOM 0 HZ2 LYS A 98 -2.212 -6.571 17.294 1.00 2.21 H new ATOM 0 HZ3 LYS A 98 -3.325 -7.276 16.224 1.00 2.21 H new ATOM 573 N LYS A 99 -5.186 -1.034 14.259 1.00 0.59 N ATOM 574 CA LYS A 99 -6.000 -0.226 15.217 1.00 0.72 C ATOM 575 C LYS A 99 -6.941 0.719 14.462 1.00 0.74 C ATOM 576 O LYS A 99 -7.972 1.115 14.973 1.00 1.12 O ATOM 577 CB LYS A 99 -4.979 0.571 16.029 1.00 0.79 C ATOM 578 CG LYS A 99 -5.574 0.921 17.395 1.00 1.23 C ATOM 579 CD LYS A 99 -4.447 1.252 18.376 1.00 1.63 C ATOM 580 CE LYS A 99 -5.003 1.280 19.801 1.00 2.21 C ATOM 581 NZ LYS A 99 -3.811 1.470 20.675 1.00 2.68 N ATOM 0 H LYS A 99 -4.274 -0.640 14.027 1.00 0.59 H new ATOM 0 HA LYS A 99 -6.628 -0.853 15.850 1.00 0.72 H new ATOM 0 HB2 LYS A 99 -4.066 -0.011 16.156 1.00 0.79 H new ATOM 0 HB3 LYS A 99 -4.705 1.481 15.496 1.00 0.79 H new ATOM 0 HG2 LYS A 99 -6.250 1.771 17.302 1.00 1.23 H new ATOM 0 HG3 LYS A 99 -6.163 0.085 17.771 1.00 1.23 H new ATOM 0 HD2 LYS A 99 -3.653 0.509 18.299 1.00 1.63 H new ATOM 0 HD3 LYS A 99 -4.006 2.217 18.127 1.00 1.63 H new ATOM 0 HE2 LYS A 99 -5.720 2.091 19.929 1.00 2.21 H new ATOM 0 HE3 LYS A 99 -5.524 0.353 20.040 1.00 2.21 H new ATOM 0 HZ1 LYS A 99 -4.111 1.499 21.670 1.00 2.68 H new ATOM 0 HZ2 LYS A 99 -3.149 0.680 20.536 1.00 2.68 H new ATOM 0 HZ3 LYS A 99 -3.339 2.364 20.429 1.00 2.68 H new ATOM 595 N GLN A 100 -6.595 1.083 13.252 1.00 0.64 N ATOM 596 CA GLN A 100 -7.469 2.006 12.463 1.00 0.68 C ATOM 597 C GLN A 100 -7.699 1.453 11.052 1.00 0.63 C ATOM 598 O GLN A 100 -6.943 0.633 10.566 1.00 0.97 O ATOM 599 CB GLN A 100 -6.707 3.336 12.406 1.00 0.84 C ATOM 600 CG GLN A 100 -5.325 3.128 11.775 1.00 1.30 C ATOM 601 CD GLN A 100 -4.917 4.390 11.012 1.00 1.63 C ATOM 602 OE1 GLN A 100 -5.388 4.632 9.918 1.00 2.46 O ATOM 603 NE2 GLN A 100 -4.055 5.211 11.547 1.00 1.66 N ATOM 0 H GLN A 100 -5.745 0.781 12.776 1.00 0.64 H new ATOM 0 HA GLN A 100 -8.453 2.123 12.918 1.00 0.68 H new ATOM 0 HB2 GLN A 100 -7.274 4.064 11.826 1.00 0.84 H new ATOM 0 HB3 GLN A 100 -6.598 3.745 13.411 1.00 0.84 H new ATOM 0 HG2 GLN A 100 -4.590 2.904 12.548 1.00 1.30 H new ATOM 0 HG3 GLN A 100 -5.347 2.273 11.099 1.00 1.30 H new ATOM 0 HE21 GLN A 100 -3.660 5.008 12.465 1.00 1.66 H new ATOM 0 HE22 GLN A 100 -3.777 6.055 11.047 1.00 1.66 H new ATOM 612 N SER A 101 -8.740 1.901 10.395 1.00 0.41 N ATOM 613 CA SER A 101 -9.031 1.411 9.013 1.00 0.42 C ATOM 614 C SER A 101 -9.133 2.591 8.044 1.00 0.52 C ATOM 615 O SER A 101 -8.840 3.719 8.392 1.00 0.87 O ATOM 616 CB SER A 101 -10.376 0.692 9.118 1.00 0.41 C ATOM 617 OG SER A 101 -11.253 1.452 9.941 1.00 0.66 O ATOM 0 H SER A 101 -9.402 2.587 10.758 1.00 0.41 H new ATOM 0 HA SER A 101 -8.246 0.755 8.637 1.00 0.42 H new ATOM 0 HB2 SER A 101 -10.810 0.562 8.127 1.00 0.41 H new ATOM 0 HB3 SER A 101 -10.237 -0.304 9.538 1.00 0.41 H new ATOM 0 HG SER A 101 -11.878 0.850 10.397 1.00 0.66 H new ATOM 623 N PHE A 102 -9.552 2.334 6.831 1.00 0.49 N ATOM 624 CA PHE A 102 -9.683 3.431 5.827 1.00 0.59 C ATOM 625 C PHE A 102 -11.150 3.585 5.413 1.00 0.51 C ATOM 626 O PHE A 102 -11.721 2.712 4.787 1.00 0.58 O ATOM 627 CB PHE A 102 -8.830 2.981 4.638 1.00 0.77 C ATOM 628 CG PHE A 102 -7.477 3.653 4.695 1.00 0.73 C ATOM 629 CD1 PHE A 102 -6.697 3.566 5.856 1.00 1.31 C ATOM 630 CD2 PHE A 102 -7.001 4.362 3.586 1.00 0.82 C ATOM 631 CE1 PHE A 102 -5.444 4.188 5.906 1.00 1.27 C ATOM 632 CE2 PHE A 102 -5.748 4.984 3.636 1.00 1.00 C ATOM 633 CZ PHE A 102 -4.970 4.897 4.796 1.00 0.88 C ATOM 0 H PHE A 102 -9.810 1.407 6.492 1.00 0.49 H new ATOM 0 HA PHE A 102 -9.358 4.396 6.216 1.00 0.59 H new ATOM 0 HB2 PHE A 102 -8.709 1.898 4.655 1.00 0.77 H new ATOM 0 HB3 PHE A 102 -9.332 3.232 3.703 1.00 0.77 H new ATOM 0 HD1 PHE A 102 -7.063 3.019 6.712 1.00 1.31 H new ATOM 0 HD2 PHE A 102 -7.601 4.429 2.691 1.00 0.82 H new ATOM 0 HE1 PHE A 102 -4.843 4.121 6.801 1.00 1.27 H new ATOM 0 HE2 PHE A 102 -5.382 5.531 2.780 1.00 1.00 H new ATOM 0 HZ PHE A 102 -4.003 5.377 4.835 1.00 0.88 H new ATOM 643 N VAL A 103 -11.762 4.686 5.767 1.00 0.55 N ATOM 644 CA VAL A 103 -13.199 4.903 5.407 1.00 0.52 C ATOM 645 C VAL A 103 -13.330 5.225 3.914 1.00 0.50 C ATOM 646 O VAL A 103 -12.572 6.004 3.368 1.00 0.75 O ATOM 647 CB VAL A 103 -13.656 6.093 6.260 1.00 0.68 C ATOM 648 CG1 VAL A 103 -15.132 6.392 5.982 1.00 0.75 C ATOM 649 CG2 VAL A 103 -13.484 5.757 7.745 1.00 0.75 C ATOM 0 H VAL A 103 -11.329 5.447 6.291 1.00 0.55 H new ATOM 0 HA VAL A 103 -13.806 4.017 5.594 1.00 0.52 H new ATOM 0 HB VAL A 103 -13.053 6.965 6.008 1.00 0.68 H new ATOM 0 HG11 VAL A 103 -15.453 7.238 6.590 1.00 0.75 H new ATOM 0 HG12 VAL A 103 -15.262 6.633 4.927 1.00 0.75 H new ATOM 0 HG13 VAL A 103 -15.733 5.518 6.231 1.00 0.75 H new ATOM 0 HG21 VAL A 103 -13.809 6.604 8.350 1.00 0.75 H new ATOM 0 HG22 VAL A 103 -14.086 4.882 7.992 1.00 0.75 H new ATOM 0 HG23 VAL A 103 -12.435 5.546 7.951 1.00 0.75 H new ATOM 659 N LEU A 104 -14.294 4.631 3.257 1.00 0.47 N ATOM 660 CA LEU A 104 -14.495 4.893 1.800 1.00 0.45 C ATOM 661 C LEU A 104 -15.983 4.804 1.452 1.00 0.47 C ATOM 662 O LEU A 104 -16.815 4.581 2.310 1.00 0.71 O ATOM 663 CB LEU A 104 -13.719 3.786 1.084 1.00 0.50 C ATOM 664 CG LEU A 104 -12.277 4.234 0.842 1.00 0.72 C ATOM 665 CD1 LEU A 104 -11.454 3.043 0.349 1.00 0.65 C ATOM 666 CD2 LEU A 104 -12.251 5.340 -0.217 1.00 1.49 C ATOM 0 H LEU A 104 -14.954 3.972 3.670 1.00 0.47 H new ATOM 0 HA LEU A 104 -14.152 5.886 1.510 1.00 0.45 H new ATOM 0 HB2 LEU A 104 -13.730 2.876 1.683 1.00 0.50 H new ATOM 0 HB3 LEU A 104 -14.199 3.549 0.135 1.00 0.50 H new ATOM 0 HG LEU A 104 -11.855 4.614 1.772 1.00 0.72 H new ATOM 0 HD11 LEU A 104 -10.425 3.359 0.175 1.00 0.65 H new ATOM 0 HD12 LEU A 104 -11.470 2.254 1.101 1.00 0.65 H new ATOM 0 HD13 LEU A 104 -11.880 2.666 -0.581 1.00 0.65 H new ATOM 0 HD21 LEU A 104 -11.222 5.657 -0.387 1.00 1.49 H new ATOM 0 HD22 LEU A 104 -12.673 4.962 -1.148 1.00 1.49 H new ATOM 0 HD23 LEU A 104 -12.840 6.189 0.129 1.00 1.49 H new ATOM 678 N LYS A 105 -16.318 4.962 0.196 1.00 0.51 N ATOM 679 CA LYS A 105 -17.750 4.870 -0.219 1.00 0.51 C ATOM 680 C LYS A 105 -17.958 3.602 -1.051 1.00 0.43 C ATOM 681 O LYS A 105 -17.012 2.959 -1.472 1.00 0.45 O ATOM 682 CB LYS A 105 -18.021 6.122 -1.063 1.00 0.65 C ATOM 683 CG LYS A 105 -19.304 6.804 -0.583 1.00 0.97 C ATOM 684 CD LYS A 105 -19.589 8.027 -1.458 1.00 0.97 C ATOM 685 CE LYS A 105 -20.133 7.571 -2.813 1.00 1.50 C ATOM 686 NZ LYS A 105 -19.651 8.592 -3.785 1.00 1.96 N ATOM 0 H LYS A 105 -15.660 5.151 -0.560 1.00 0.51 H new ATOM 0 HA LYS A 105 -18.426 4.818 0.635 1.00 0.51 H new ATOM 0 HB2 LYS A 105 -17.181 6.812 -0.986 1.00 0.65 H new ATOM 0 HB3 LYS A 105 -18.115 5.850 -2.114 1.00 0.65 H new ATOM 0 HG2 LYS A 105 -20.140 6.106 -0.632 1.00 0.97 H new ATOM 0 HG3 LYS A 105 -19.200 7.105 0.459 1.00 0.97 H new ATOM 0 HD2 LYS A 105 -20.310 8.679 -0.966 1.00 0.97 H new ATOM 0 HD3 LYS A 105 -18.677 8.608 -1.597 1.00 0.97 H new ATOM 0 HE2 LYS A 105 -19.767 6.577 -3.071 1.00 1.50 H new ATOM 0 HE3 LYS A 105 -21.222 7.518 -2.804 1.00 1.50 H new ATOM 0 HZ1 LYS A 105 -19.985 8.348 -4.739 1.00 1.96 H new ATOM 0 HZ2 LYS A 105 -20.020 9.527 -3.518 1.00 1.96 H new ATOM 0 HZ3 LYS A 105 -18.611 8.615 -3.777 1.00 1.96 H new ATOM 700 N GLU A 106 -19.191 3.234 -1.281 1.00 0.45 N ATOM 701 CA GLU A 106 -19.483 1.998 -2.076 1.00 0.49 C ATOM 702 C GLU A 106 -18.707 1.972 -3.401 1.00 0.72 C ATOM 703 O GLU A 106 -19.039 2.653 -4.351 1.00 1.76 O ATOM 704 CB GLU A 106 -20.982 2.036 -2.353 1.00 0.69 C ATOM 705 CG GLU A 106 -21.747 1.630 -1.092 1.00 0.77 C ATOM 706 CD GLU A 106 -23.159 1.180 -1.472 1.00 1.19 C ATOM 707 OE1 GLU A 106 -23.286 0.453 -2.443 1.00 1.68 O ATOM 708 OE2 GLU A 106 -24.088 1.570 -0.785 1.00 1.93 O ATOM 0 H GLU A 106 -20.015 3.737 -0.952 1.00 0.45 H new ATOM 0 HA GLU A 106 -19.180 1.107 -1.526 1.00 0.49 H new ATOM 0 HB2 GLU A 106 -21.279 3.037 -2.664 1.00 0.69 H new ATOM 0 HB3 GLU A 106 -21.228 1.361 -3.173 1.00 0.69 H new ATOM 0 HG2 GLU A 106 -21.223 0.823 -0.580 1.00 0.77 H new ATOM 0 HG3 GLU A 106 -21.796 2.469 -0.398 1.00 0.77 H new ATOM 715 N GLY A 107 -17.696 1.155 -3.461 1.00 0.74 N ATOM 716 CA GLY A 107 -16.879 1.006 -4.705 1.00 0.80 C ATOM 717 C GLY A 107 -16.431 2.356 -5.282 1.00 0.66 C ATOM 718 O GLY A 107 -16.839 2.731 -6.366 1.00 0.80 O ATOM 0 H GLY A 107 -17.391 0.569 -2.684 1.00 0.74 H new ATOM 0 HA2 GLY A 107 -16.001 0.398 -4.488 1.00 0.80 H new ATOM 0 HA3 GLY A 107 -17.460 0.469 -5.455 1.00 0.80 H new ATOM 722 N VAL A 108 -15.573 3.070 -4.593 1.00 0.56 N ATOM 723 CA VAL A 108 -15.079 4.373 -5.143 1.00 0.55 C ATOM 724 C VAL A 108 -13.858 4.132 -6.035 1.00 0.54 C ATOM 725 O VAL A 108 -13.035 3.281 -5.753 1.00 0.81 O ATOM 726 CB VAL A 108 -14.678 5.227 -3.936 1.00 0.62 C ATOM 727 CG1 VAL A 108 -15.912 5.536 -3.097 1.00 0.64 C ATOM 728 CG2 VAL A 108 -13.632 4.494 -3.079 1.00 0.72 C ATOM 0 H VAL A 108 -15.196 2.810 -3.682 1.00 0.56 H new ATOM 0 HA VAL A 108 -15.844 4.866 -5.743 1.00 0.55 H new ATOM 0 HB VAL A 108 -14.239 6.158 -4.294 1.00 0.62 H new ATOM 0 HG11 VAL A 108 -15.626 6.144 -2.239 1.00 0.64 H new ATOM 0 HG12 VAL A 108 -16.636 6.081 -3.702 1.00 0.64 H new ATOM 0 HG13 VAL A 108 -16.358 4.604 -2.749 1.00 0.64 H new ATOM 0 HG21 VAL A 108 -13.359 5.116 -2.226 1.00 0.72 H new ATOM 0 HG22 VAL A 108 -14.049 3.552 -2.722 1.00 0.72 H new ATOM 0 HG23 VAL A 108 -12.745 4.293 -3.680 1.00 0.72 H new ATOM 738 N GLU A 109 -13.728 4.882 -7.099 1.00 0.48 N ATOM 739 CA GLU A 109 -12.551 4.709 -8.002 1.00 0.48 C ATOM 740 C GLU A 109 -11.365 5.499 -7.441 1.00 0.49 C ATOM 741 O GLU A 109 -11.212 6.675 -7.711 1.00 0.70 O ATOM 742 CB GLU A 109 -12.995 5.282 -9.348 1.00 0.61 C ATOM 743 CG GLU A 109 -13.519 4.152 -10.236 1.00 1.27 C ATOM 744 CD GLU A 109 -13.951 4.722 -11.588 1.00 1.55 C ATOM 745 OE1 GLU A 109 -14.550 5.784 -11.597 1.00 2.07 O ATOM 746 OE2 GLU A 109 -13.675 4.085 -12.592 1.00 2.07 O ATOM 0 H GLU A 109 -14.387 5.607 -7.382 1.00 0.48 H new ATOM 0 HA GLU A 109 -12.237 3.669 -8.095 1.00 0.48 H new ATOM 0 HB2 GLU A 109 -13.773 6.031 -9.198 1.00 0.61 H new ATOM 0 HB3 GLU A 109 -12.159 5.784 -9.835 1.00 0.61 H new ATOM 0 HG2 GLU A 109 -12.744 3.398 -10.378 1.00 1.27 H new ATOM 0 HG3 GLU A 109 -14.361 3.656 -9.753 1.00 1.27 H new ATOM 753 N TYR A 110 -10.541 4.866 -6.642 1.00 0.47 N ATOM 754 CA TYR A 110 -9.379 5.588 -6.039 1.00 0.56 C ATOM 755 C TYR A 110 -8.044 5.047 -6.568 1.00 0.44 C ATOM 756 O TYR A 110 -7.926 3.890 -6.924 1.00 0.55 O ATOM 757 CB TYR A 110 -9.505 5.336 -4.529 1.00 0.85 C ATOM 758 CG TYR A 110 -9.399 3.853 -4.237 1.00 0.60 C ATOM 759 CD1 TYR A 110 -8.139 3.248 -4.150 1.00 0.89 C ATOM 760 CD2 TYR A 110 -10.556 3.085 -4.053 1.00 1.42 C ATOM 761 CE1 TYR A 110 -8.035 1.879 -3.880 1.00 0.91 C ATOM 762 CE2 TYR A 110 -10.452 1.715 -3.783 1.00 1.46 C ATOM 763 CZ TYR A 110 -9.192 1.112 -3.697 1.00 0.73 C ATOM 764 OH TYR A 110 -9.090 -0.238 -3.430 1.00 1.01 O ATOM 0 H TYR A 110 -10.623 3.883 -6.382 1.00 0.47 H new ATOM 0 HA TYR A 110 -9.390 6.649 -6.288 1.00 0.56 H new ATOM 0 HB2 TYR A 110 -8.723 5.876 -3.996 1.00 0.85 H new ATOM 0 HB3 TYR A 110 -10.459 5.718 -4.167 1.00 0.85 H new ATOM 0 HD1 TYR A 110 -7.246 3.839 -4.292 1.00 0.89 H new ATOM 0 HD2 TYR A 110 -11.529 3.550 -4.119 1.00 1.42 H new ATOM 0 HE1 TYR A 110 -7.063 1.414 -3.813 1.00 0.91 H new ATOM 0 HE2 TYR A 110 -11.344 1.123 -3.641 1.00 1.46 H new ATOM 0 HH TYR A 110 -9.987 -0.620 -3.329 1.00 1.01 H new ATOM 774 N ARG A 111 -7.036 5.882 -6.596 1.00 0.39 N ATOM 775 CA ARG A 111 -5.693 5.438 -7.071 1.00 0.43 C ATOM 776 C ARG A 111 -4.783 5.211 -5.862 1.00 0.43 C ATOM 777 O ARG A 111 -5.097 5.631 -4.763 1.00 0.55 O ATOM 778 CB ARG A 111 -5.168 6.595 -7.923 1.00 0.57 C ATOM 779 CG ARG A 111 -5.950 6.665 -9.235 1.00 1.11 C ATOM 780 CD ARG A 111 -5.072 7.299 -10.317 1.00 1.14 C ATOM 781 NE ARG A 111 -5.985 7.521 -11.472 1.00 1.43 N ATOM 782 CZ ARG A 111 -5.855 8.589 -12.211 1.00 1.58 C ATOM 783 NH1 ARG A 111 -4.776 8.761 -12.925 1.00 1.89 N ATOM 784 NH2 ARG A 111 -6.804 9.484 -12.236 1.00 2.28 N ATOM 0 H ARG A 111 -7.088 6.859 -6.308 1.00 0.39 H new ATOM 0 HA ARG A 111 -5.732 4.508 -7.638 1.00 0.43 H new ATOM 0 HB2 ARG A 111 -5.267 7.534 -7.379 1.00 0.57 H new ATOM 0 HB3 ARG A 111 -4.107 6.456 -8.128 1.00 0.57 H new ATOM 0 HG2 ARG A 111 -6.259 5.665 -9.541 1.00 1.11 H new ATOM 0 HG3 ARG A 111 -6.859 7.251 -9.099 1.00 1.11 H new ATOM 0 HD2 ARG A 111 -4.636 8.237 -9.972 1.00 1.14 H new ATOM 0 HD3 ARG A 111 -4.244 6.643 -10.588 1.00 1.14 H new ATOM 0 HE ARG A 111 -6.712 6.838 -11.686 1.00 1.43 H new ATOM 0 HH11 ARG A 111 -4.035 8.061 -12.905 1.00 1.89 H new ATOM 0 HH12 ARG A 111 -4.674 9.596 -13.503 1.00 1.89 H new ATOM 0 HH21 ARG A 111 -7.647 9.349 -11.678 1.00 2.28 H new ATOM 0 HH22 ARG A 111 -6.703 10.319 -12.813 1.00 2.28 H new ATOM 798 N ILE A 112 -3.663 4.556 -6.045 1.00 0.37 N ATOM 799 CA ILE A 112 -2.747 4.316 -4.883 1.00 0.42 C ATOM 800 C ILE A 112 -1.338 4.821 -5.200 1.00 0.39 C ATOM 801 O ILE A 112 -0.794 4.554 -6.255 1.00 0.49 O ATOM 802 CB ILE A 112 -2.741 2.800 -4.656 1.00 0.51 C ATOM 803 CG1 ILE A 112 -4.174 2.312 -4.413 1.00 0.58 C ATOM 804 CG2 ILE A 112 -1.880 2.473 -3.432 1.00 0.61 C ATOM 805 CD1 ILE A 112 -4.188 0.786 -4.298 1.00 0.65 C ATOM 0 H ILE A 112 -3.344 4.180 -6.938 1.00 0.37 H new ATOM 0 HA ILE A 112 -3.082 4.848 -3.993 1.00 0.42 H new ATOM 0 HB ILE A 112 -2.332 2.303 -5.536 1.00 0.51 H new ATOM 0 HG12 ILE A 112 -4.571 2.758 -3.501 1.00 0.58 H new ATOM 0 HG13 ILE A 112 -4.820 2.630 -5.231 1.00 0.58 H new ATOM 0 HG21 ILE A 112 -1.874 1.395 -3.269 1.00 0.61 H new ATOM 0 HG22 ILE A 112 -0.861 2.820 -3.601 1.00 0.61 H new ATOM 0 HG23 ILE A 112 -2.292 2.971 -2.554 1.00 0.61 H new ATOM 0 HD11 ILE A 112 -5.208 0.443 -4.125 1.00 0.65 H new ATOM 0 HD12 ILE A 112 -3.810 0.348 -5.222 1.00 0.65 H new ATOM 0 HD13 ILE A 112 -3.556 0.478 -3.465 1.00 0.65 H new ATOM 817 N LYS A 113 -0.747 5.547 -4.287 1.00 0.39 N ATOM 818 CA LYS A 113 0.630 6.077 -4.514 1.00 0.39 C ATOM 819 C LYS A 113 1.596 5.463 -3.496 1.00 0.38 C ATOM 820 O LYS A 113 1.612 5.843 -2.340 1.00 0.50 O ATOM 821 CB LYS A 113 0.514 7.595 -4.306 1.00 0.45 C ATOM 822 CG LYS A 113 1.058 8.331 -5.533 1.00 0.93 C ATOM 823 CD LYS A 113 1.370 9.782 -5.161 1.00 1.21 C ATOM 824 CE LYS A 113 0.095 10.621 -5.264 1.00 1.09 C ATOM 825 NZ LYS A 113 0.570 12.023 -5.427 1.00 1.77 N ATOM 0 H LYS A 113 -1.162 5.797 -3.389 1.00 0.39 H new ATOM 0 HA LYS A 113 1.013 5.835 -5.506 1.00 0.39 H new ATOM 0 HB2 LYS A 113 -0.527 7.870 -4.138 1.00 0.45 H new ATOM 0 HB3 LYS A 113 1.069 7.893 -3.417 1.00 0.45 H new ATOM 0 HG2 LYS A 113 1.958 7.836 -5.898 1.00 0.93 H new ATOM 0 HG3 LYS A 113 0.328 8.301 -6.342 1.00 0.93 H new ATOM 0 HD2 LYS A 113 1.769 9.831 -4.148 1.00 1.21 H new ATOM 0 HD3 LYS A 113 2.136 10.182 -5.825 1.00 1.21 H new ATOM 0 HE2 LYS A 113 -0.515 10.310 -6.112 1.00 1.09 H new ATOM 0 HE3 LYS A 113 -0.521 10.514 -4.371 1.00 1.09 H new ATOM 0 HZ1 LYS A 113 -0.248 12.660 -5.505 1.00 1.77 H new ATOM 0 HZ2 LYS A 113 1.142 12.294 -4.602 1.00 1.77 H new ATOM 0 HZ3 LYS A 113 1.148 12.096 -6.288 1.00 1.77 H new ATOM 839 N ILE A 114 2.396 4.516 -3.917 1.00 0.33 N ATOM 840 CA ILE A 114 3.359 3.872 -2.975 1.00 0.32 C ATOM 841 C ILE A 114 4.707 4.602 -3.016 1.00 0.32 C ATOM 842 O ILE A 114 5.205 4.952 -4.069 1.00 0.41 O ATOM 843 CB ILE A 114 3.508 2.425 -3.479 1.00 0.35 C ATOM 844 CG1 ILE A 114 2.171 1.683 -3.319 1.00 0.37 C ATOM 845 CG2 ILE A 114 4.607 1.688 -2.690 1.00 0.39 C ATOM 846 CD1 ILE A 114 1.765 1.616 -1.840 1.00 0.41 C ATOM 0 H ILE A 114 2.423 4.161 -4.873 1.00 0.33 H new ATOM 0 HA ILE A 114 3.012 3.906 -1.942 1.00 0.32 H new ATOM 0 HB ILE A 114 3.790 2.449 -4.532 1.00 0.35 H new ATOM 0 HG12 ILE A 114 1.396 2.191 -3.892 1.00 0.37 H new ATOM 0 HG13 ILE A 114 2.257 0.675 -3.724 1.00 0.37 H new ATOM 0 HG21 ILE A 114 4.698 0.667 -3.060 1.00 0.39 H new ATOM 0 HG22 ILE A 114 5.557 2.207 -2.819 1.00 0.39 H new ATOM 0 HG23 ILE A 114 4.345 1.668 -1.632 1.00 0.39 H new ATOM 0 HD11 ILE A 114 0.816 1.087 -1.747 1.00 0.41 H new ATOM 0 HD12 ILE A 114 2.533 1.086 -1.276 1.00 0.41 H new ATOM 0 HD13 ILE A 114 1.657 2.627 -1.446 1.00 0.41 H new ATOM 858 N SER A 115 5.301 4.807 -1.873 1.00 0.32 N ATOM 859 CA SER A 115 6.627 5.485 -1.816 1.00 0.33 C ATOM 860 C SER A 115 7.637 4.535 -1.171 1.00 0.31 C ATOM 861 O SER A 115 7.309 3.817 -0.246 1.00 0.34 O ATOM 862 CB SER A 115 6.409 6.720 -0.943 1.00 0.39 C ATOM 863 OG SER A 115 5.628 7.668 -1.658 1.00 1.13 O ATOM 0 H SER A 115 4.921 4.531 -0.968 1.00 0.32 H new ATOM 0 HA SER A 115 7.010 5.761 -2.799 1.00 0.33 H new ATOM 0 HB2 SER A 115 5.906 6.441 -0.017 1.00 0.39 H new ATOM 0 HB3 SER A 115 7.368 7.157 -0.665 1.00 0.39 H new ATOM 0 HG SER A 115 5.485 8.461 -1.100 1.00 1.13 H new ATOM 869 N PHE A 116 8.853 4.514 -1.653 1.00 0.31 N ATOM 870 CA PHE A 116 9.874 3.588 -1.061 1.00 0.32 C ATOM 871 C PHE A 116 11.290 4.105 -1.310 1.00 0.31 C ATOM 872 O PHE A 116 11.624 4.541 -2.392 1.00 0.38 O ATOM 873 CB PHE A 116 9.649 2.231 -1.739 1.00 0.33 C ATOM 874 CG PHE A 116 9.660 2.380 -3.243 1.00 0.36 C ATOM 875 CD1 PHE A 116 8.511 2.815 -3.913 1.00 1.03 C ATOM 876 CD2 PHE A 116 10.814 2.071 -3.962 1.00 1.05 C ATOM 877 CE1 PHE A 116 8.522 2.942 -5.307 1.00 1.03 C ATOM 878 CE2 PHE A 116 10.826 2.194 -5.356 1.00 1.16 C ATOM 879 CZ PHE A 116 9.679 2.630 -6.028 1.00 0.59 C ATOM 0 H PHE A 116 9.185 5.092 -2.425 1.00 0.31 H new ATOM 0 HA PHE A 116 9.766 3.511 0.021 1.00 0.32 H new ATOM 0 HB2 PHE A 116 10.426 1.531 -1.432 1.00 0.33 H new ATOM 0 HB3 PHE A 116 8.696 1.811 -1.417 1.00 0.33 H new ATOM 0 HD1 PHE A 116 7.617 3.052 -3.355 1.00 1.03 H new ATOM 0 HD2 PHE A 116 11.700 1.736 -3.442 1.00 1.05 H new ATOM 0 HE1 PHE A 116 7.637 3.281 -5.826 1.00 1.03 H new ATOM 0 HE2 PHE A 116 11.720 1.953 -5.912 1.00 1.16 H new ATOM 0 HZ PHE A 116 9.687 2.726 -7.104 1.00 0.59 H new ATOM 889 N ARG A 117 12.116 4.063 -0.295 1.00 0.34 N ATOM 890 CA ARG A 117 13.519 4.563 -0.422 1.00 0.40 C ATOM 891 C ARG A 117 14.412 3.536 -1.116 1.00 0.33 C ATOM 892 O ARG A 117 14.283 2.345 -0.908 1.00 0.39 O ATOM 893 CB ARG A 117 13.989 4.772 1.018 1.00 0.55 C ATOM 894 CG ARG A 117 13.716 6.220 1.443 1.00 0.96 C ATOM 895 CD ARG A 117 14.929 6.774 2.184 1.00 1.07 C ATOM 896 NE ARG A 117 14.884 6.138 3.530 1.00 1.37 N ATOM 897 CZ ARG A 117 15.240 6.819 4.585 1.00 1.60 C ATOM 898 NH1 ARG A 117 14.626 7.931 4.882 1.00 2.23 N ATOM 899 NH2 ARG A 117 16.210 6.387 5.343 1.00 2.06 N ATOM 0 H ARG A 117 11.875 3.699 0.627 1.00 0.34 H new ATOM 0 HA ARG A 117 13.568 5.473 -1.020 1.00 0.40 H new ATOM 0 HB2 ARG A 117 13.470 4.083 1.684 1.00 0.55 H new ATOM 0 HB3 ARG A 117 15.054 4.553 1.099 1.00 0.55 H new ATOM 0 HG2 ARG A 117 13.502 6.832 0.567 1.00 0.96 H new ATOM 0 HG3 ARG A 117 12.836 6.261 2.084 1.00 0.96 H new ATOM 0 HD2 ARG A 117 15.855 6.530 1.663 1.00 1.07 H new ATOM 0 HD3 ARG A 117 14.883 7.860 2.259 1.00 1.07 H new ATOM 0 HE ARG A 117 14.575 5.171 3.627 1.00 1.37 H new ATOM 0 HH11 ARG A 117 13.867 8.269 4.290 1.00 2.23 H new ATOM 0 HH12 ARG A 117 14.905 8.463 5.707 1.00 2.23 H new ATOM 0 HH21 ARG A 117 16.690 5.517 5.111 1.00 2.06 H new ATOM 0 HH22 ARG A 117 16.489 6.919 6.168 1.00 2.06 H new ATOM 913 N VAL A 118 15.331 3.997 -1.926 1.00 0.38 N ATOM 914 CA VAL A 118 16.258 3.061 -2.625 1.00 0.43 C ATOM 915 C VAL A 118 17.697 3.555 -2.451 1.00 0.52 C ATOM 916 O VAL A 118 18.191 4.334 -3.242 1.00 0.61 O ATOM 917 CB VAL A 118 15.845 3.097 -4.100 1.00 0.55 C ATOM 918 CG1 VAL A 118 16.717 2.123 -4.895 1.00 0.65 C ATOM 919 CG2 VAL A 118 14.374 2.684 -4.237 1.00 0.53 C ATOM 0 H VAL A 118 15.478 4.985 -2.133 1.00 0.38 H new ATOM 0 HA VAL A 118 16.207 2.047 -2.229 1.00 0.43 H new ATOM 0 HB VAL A 118 15.975 4.108 -4.485 1.00 0.55 H new ATOM 0 HG11 VAL A 118 16.425 2.147 -5.945 1.00 0.65 H new ATOM 0 HG12 VAL A 118 17.764 2.413 -4.803 1.00 0.65 H new ATOM 0 HG13 VAL A 118 16.585 1.114 -4.504 1.00 0.65 H new ATOM 0 HG21 VAL A 118 14.085 2.711 -5.288 1.00 0.53 H new ATOM 0 HG22 VAL A 118 14.242 1.673 -3.850 1.00 0.53 H new ATOM 0 HG23 VAL A 118 13.748 3.374 -3.671 1.00 0.53 H new ATOM 929 N ASN A 119 18.364 3.122 -1.409 1.00 0.56 N ATOM 930 CA ASN A 119 19.767 3.585 -1.172 1.00 0.67 C ATOM 931 C ASN A 119 20.711 2.398 -0.944 1.00 0.68 C ATOM 932 O ASN A 119 21.490 2.391 -0.009 1.00 0.81 O ATOM 933 CB ASN A 119 19.691 4.463 0.076 1.00 0.81 C ATOM 934 CG ASN A 119 20.411 5.791 -0.175 1.00 1.96 C ATOM 935 OD1 ASN A 119 21.502 5.813 -0.711 1.00 2.78 O ATOM 936 ND2 ASN A 119 19.844 6.907 0.193 1.00 2.62 N ATOM 0 H ASN A 119 17.999 2.470 -0.714 1.00 0.56 H new ATOM 0 HA ASN A 119 20.163 4.127 -2.031 1.00 0.67 H new ATOM 0 HB2 ASN A 119 18.649 4.648 0.338 1.00 0.81 H new ATOM 0 HB3 ASN A 119 20.145 3.947 0.922 1.00 0.81 H new ATOM 0 HD21 ASN A 119 20.316 7.797 0.031 1.00 2.62 H new ATOM 0 HD22 ASN A 119 18.929 6.890 0.643 1.00 2.62 H new ATOM 943 N ARG A 120 20.656 1.403 -1.792 1.00 0.61 N ATOM 944 CA ARG A 120 21.558 0.226 -1.625 1.00 0.70 C ATOM 945 C ARG A 120 21.892 -0.392 -2.987 1.00 0.64 C ATOM 946 O ARG A 120 23.025 -0.355 -3.429 1.00 0.66 O ATOM 947 CB ARG A 120 20.774 -0.760 -0.759 1.00 0.82 C ATOM 948 CG ARG A 120 21.637 -1.992 -0.467 1.00 0.98 C ATOM 949 CD ARG A 120 22.301 -1.843 0.905 1.00 1.49 C ATOM 950 NE ARG A 120 23.685 -1.379 0.613 1.00 1.92 N ATOM 951 CZ ARG A 120 24.708 -2.092 0.999 1.00 2.34 C ATOM 952 NH1 ARG A 120 24.731 -2.602 2.200 1.00 2.94 N ATOM 953 NH2 ARG A 120 25.707 -2.296 0.184 1.00 2.82 N ATOM 0 H ARG A 120 20.025 1.356 -2.592 1.00 0.61 H new ATOM 0 HA ARG A 120 22.508 0.500 -1.166 1.00 0.70 H new ATOM 0 HB2 ARG A 120 20.477 -0.282 0.175 1.00 0.82 H new ATOM 0 HB3 ARG A 120 19.858 -1.058 -1.269 1.00 0.82 H new ATOM 0 HG2 ARG A 120 21.022 -2.892 -0.489 1.00 0.98 H new ATOM 0 HG3 ARG A 120 22.398 -2.107 -1.239 1.00 0.98 H new ATOM 0 HD2 ARG A 120 21.766 -1.125 1.527 1.00 1.49 H new ATOM 0 HD3 ARG A 120 22.308 -2.790 1.446 1.00 1.49 H new ATOM 0 HE ARG A 120 23.834 -0.504 0.111 1.00 1.92 H new ATOM 0 HH11 ARG A 120 23.950 -2.443 2.836 1.00 2.94 H new ATOM 0 HH12 ARG A 120 25.530 -3.159 2.502 1.00 2.94 H new ATOM 0 HH21 ARG A 120 25.689 -1.898 -0.755 1.00 2.82 H new ATOM 0 HH22 ARG A 120 26.506 -2.853 0.486 1.00 2.82 H new ATOM 967 N GLU A 121 20.917 -0.963 -3.650 1.00 0.62 N ATOM 968 CA GLU A 121 21.180 -1.588 -4.982 1.00 0.66 C ATOM 969 C GLU A 121 19.985 -1.387 -5.916 1.00 0.61 C ATOM 970 O GLU A 121 18.906 -1.022 -5.489 1.00 0.59 O ATOM 971 CB GLU A 121 21.385 -3.075 -4.687 1.00 0.81 C ATOM 972 CG GLU A 121 22.876 -3.359 -4.502 1.00 1.58 C ATOM 973 CD GLU A 121 23.153 -4.836 -4.786 1.00 1.78 C ATOM 974 OE1 GLU A 121 23.165 -5.203 -5.949 1.00 2.22 O ATOM 975 OE2 GLU A 121 23.349 -5.576 -3.835 1.00 2.23 O ATOM 0 H GLU A 121 19.952 -1.023 -3.326 1.00 0.62 H new ATOM 0 HA GLU A 121 22.043 -1.145 -5.479 1.00 0.66 H new ATOM 0 HB2 GLU A 121 20.836 -3.357 -3.788 1.00 0.81 H new ATOM 0 HB3 GLU A 121 20.988 -3.677 -5.505 1.00 0.81 H new ATOM 0 HG2 GLU A 121 23.463 -2.732 -5.174 1.00 1.58 H new ATOM 0 HG3 GLU A 121 23.181 -3.110 -3.486 1.00 1.58 H new ATOM 982 N ILE A 122 20.178 -1.622 -7.188 1.00 0.64 N ATOM 983 CA ILE A 122 19.063 -1.448 -8.167 1.00 0.64 C ATOM 984 C ILE A 122 18.140 -2.670 -8.140 1.00 0.65 C ATOM 985 O ILE A 122 18.532 -3.760 -8.513 1.00 0.86 O ATOM 986 CB ILE A 122 19.742 -1.316 -9.535 1.00 0.73 C ATOM 987 CG1 ILE A 122 20.699 -0.120 -9.522 1.00 0.75 C ATOM 988 CG2 ILE A 122 18.680 -1.099 -10.616 1.00 0.77 C ATOM 989 CD1 ILE A 122 21.493 -0.088 -10.829 1.00 1.01 C ATOM 0 H ILE A 122 21.063 -1.928 -7.592 1.00 0.64 H new ATOM 0 HA ILE A 122 18.447 -0.579 -7.937 1.00 0.64 H new ATOM 0 HB ILE A 122 20.300 -2.228 -9.747 1.00 0.73 H new ATOM 0 HG12 ILE A 122 20.138 0.807 -9.402 1.00 0.75 H new ATOM 0 HG13 ILE A 122 21.379 -0.194 -8.673 1.00 0.75 H new ATOM 0 HG21 ILE A 122 19.164 -1.005 -11.588 1.00 0.77 H new ATOM 0 HG22 ILE A 122 17.997 -1.949 -10.631 1.00 0.77 H new ATOM 0 HG23 ILE A 122 18.121 -0.188 -10.400 1.00 0.77 H new ATOM 0 HD11 ILE A 122 22.174 0.763 -10.820 1.00 1.01 H new ATOM 0 HD12 ILE A 122 22.066 -1.010 -10.930 1.00 1.01 H new ATOM 0 HD13 ILE A 122 20.806 0.006 -11.670 1.00 1.01 H new ATOM 1001 N VAL A 123 16.918 -2.491 -7.709 1.00 0.54 N ATOM 1002 CA VAL A 123 15.960 -3.636 -7.662 1.00 0.56 C ATOM 1003 C VAL A 123 15.127 -3.663 -8.947 1.00 0.51 C ATOM 1004 O VAL A 123 14.067 -3.070 -9.023 1.00 0.55 O ATOM 1005 CB VAL A 123 15.073 -3.368 -6.441 1.00 0.64 C ATOM 1006 CG1 VAL A 123 14.040 -4.489 -6.296 1.00 0.69 C ATOM 1007 CG2 VAL A 123 15.941 -3.318 -5.180 1.00 0.75 C ATOM 0 H VAL A 123 16.542 -1.599 -7.387 1.00 0.54 H new ATOM 0 HA VAL A 123 16.462 -4.600 -7.585 1.00 0.56 H new ATOM 0 HB VAL A 123 14.560 -2.415 -6.573 1.00 0.64 H new ATOM 0 HG11 VAL A 123 13.412 -4.295 -5.427 1.00 0.69 H new ATOM 0 HG12 VAL A 123 13.419 -4.530 -7.191 1.00 0.69 H new ATOM 0 HG13 VAL A 123 14.553 -5.442 -6.167 1.00 0.69 H new ATOM 0 HG21 VAL A 123 15.310 -3.127 -4.312 1.00 0.75 H new ATOM 0 HG22 VAL A 123 16.454 -4.271 -5.054 1.00 0.75 H new ATOM 0 HG23 VAL A 123 16.677 -2.520 -5.276 1.00 0.75 H new ATOM 1017 N SER A 124 15.605 -4.345 -9.957 1.00 0.55 N ATOM 1018 CA SER A 124 14.853 -4.414 -11.245 1.00 0.56 C ATOM 1019 C SER A 124 13.780 -5.503 -11.178 1.00 0.52 C ATOM 1020 O SER A 124 14.076 -6.681 -11.250 1.00 0.74 O ATOM 1021 CB SER A 124 15.903 -4.761 -12.299 1.00 0.67 C ATOM 1022 OG SER A 124 16.450 -6.041 -12.013 1.00 1.11 O ATOM 0 H SER A 124 16.486 -4.858 -9.944 1.00 0.55 H new ATOM 0 HA SER A 124 14.340 -3.479 -11.472 1.00 0.56 H new ATOM 0 HB2 SER A 124 15.453 -4.759 -13.292 1.00 0.67 H new ATOM 0 HB3 SER A 124 16.692 -4.009 -12.305 1.00 0.67 H new ATOM 0 HG SER A 124 15.729 -6.657 -11.764 1.00 1.11 H new ATOM 1028 N GLY A 125 12.537 -5.115 -11.044 1.00 0.40 N ATOM 1029 CA GLY A 125 11.437 -6.121 -10.976 1.00 0.40 C ATOM 1030 C GLY A 125 10.652 -5.942 -9.675 1.00 0.35 C ATOM 1031 O GLY A 125 10.323 -6.902 -9.005 1.00 0.44 O ATOM 0 H GLY A 125 12.237 -4.142 -10.979 1.00 0.40 H new ATOM 0 HA2 GLY A 125 10.772 -6.005 -11.832 1.00 0.40 H new ATOM 0 HA3 GLY A 125 11.849 -7.129 -11.027 1.00 0.40 H new ATOM 1035 N MET A 126 10.345 -4.720 -9.317 1.00 0.30 N ATOM 1036 CA MET A 126 9.574 -4.477 -8.060 1.00 0.31 C ATOM 1037 C MET A 126 8.099 -4.818 -8.281 1.00 0.30 C ATOM 1038 O MET A 126 7.559 -4.602 -9.350 1.00 0.43 O ATOM 1039 CB MET A 126 9.743 -2.987 -7.761 1.00 0.42 C ATOM 1040 CG MET A 126 9.532 -2.745 -6.265 1.00 0.68 C ATOM 1041 SD MET A 126 8.845 -1.090 -6.006 1.00 1.22 S ATOM 1042 CE MET A 126 9.797 -0.686 -4.522 1.00 0.43 C ATOM 0 H MET A 126 10.595 -3.881 -9.841 1.00 0.30 H new ATOM 0 HA MET A 126 9.927 -5.093 -7.233 1.00 0.31 H new ATOM 0 HB2 MET A 126 10.738 -2.655 -8.058 1.00 0.42 H new ATOM 0 HB3 MET A 126 9.026 -2.404 -8.340 1.00 0.42 H new ATOM 0 HG2 MET A 126 8.857 -3.497 -5.857 1.00 0.68 H new ATOM 0 HG3 MET A 126 10.479 -2.844 -5.734 1.00 0.68 H new ATOM 0 HE1 MET A 126 9.275 0.084 -3.953 1.00 0.43 H new ATOM 0 HE2 MET A 126 9.908 -1.579 -3.907 1.00 0.43 H new ATOM 0 HE3 MET A 126 10.782 -0.319 -4.810 1.00 0.43 H new ATOM 1052 N LYS A 127 7.447 -5.355 -7.280 1.00 0.29 N ATOM 1053 CA LYS A 127 6.006 -5.718 -7.434 1.00 0.35 C ATOM 1054 C LYS A 127 5.207 -5.320 -6.188 1.00 0.31 C ATOM 1055 O LYS A 127 5.712 -5.333 -5.082 1.00 0.43 O ATOM 1056 CB LYS A 127 6.000 -7.237 -7.609 1.00 0.51 C ATOM 1057 CG LYS A 127 6.198 -7.580 -9.087 1.00 0.97 C ATOM 1058 CD LYS A 127 6.540 -9.065 -9.225 1.00 1.24 C ATOM 1059 CE LYS A 127 5.316 -9.908 -8.862 1.00 1.20 C ATOM 1060 NZ LYS A 127 5.369 -11.077 -9.783 1.00 1.50 N ATOM 0 H LYS A 127 7.850 -5.557 -6.365 1.00 0.29 H new ATOM 0 HA LYS A 127 5.544 -5.202 -8.276 1.00 0.35 H new ATOM 0 HB2 LYS A 127 6.793 -7.686 -7.011 1.00 0.51 H new ATOM 0 HB3 LYS A 127 5.057 -7.651 -7.251 1.00 0.51 H new ATOM 0 HG2 LYS A 127 5.293 -7.351 -9.649 1.00 0.97 H new ATOM 0 HG3 LYS A 127 6.998 -6.971 -9.509 1.00 0.97 H new ATOM 0 HD2 LYS A 127 6.855 -9.283 -10.246 1.00 1.24 H new ATOM 0 HD3 LYS A 127 7.376 -9.319 -8.573 1.00 1.24 H new ATOM 0 HE2 LYS A 127 5.349 -10.225 -7.820 1.00 1.20 H new ATOM 0 HE3 LYS A 127 4.394 -9.343 -8.994 1.00 1.20 H new ATOM 0 HZ1 LYS A 127 4.560 -11.704 -9.596 1.00 1.50 H new ATOM 0 HZ2 LYS A 127 5.329 -10.745 -10.768 1.00 1.50 H new ATOM 0 HZ3 LYS A 127 6.255 -11.600 -9.630 1.00 1.50 H new ATOM 1074 N TYR A 128 3.960 -4.973 -6.371 1.00 0.36 N ATOM 1075 CA TYR A 128 3.100 -4.577 -5.216 1.00 0.35 C ATOM 1076 C TYR A 128 1.847 -5.461 -5.191 1.00 0.39 C ATOM 1077 O TYR A 128 0.930 -5.270 -5.965 1.00 0.56 O ATOM 1078 CB TYR A 128 2.742 -3.105 -5.485 1.00 0.42 C ATOM 1079 CG TYR A 128 1.717 -2.614 -4.483 1.00 0.49 C ATOM 1080 CD1 TYR A 128 1.929 -2.797 -3.110 1.00 0.50 C ATOM 1081 CD2 TYR A 128 0.551 -1.980 -4.933 1.00 0.63 C ATOM 1082 CE1 TYR A 128 0.976 -2.345 -2.188 1.00 0.59 C ATOM 1083 CE2 TYR A 128 -0.400 -1.528 -4.010 1.00 0.72 C ATOM 1084 CZ TYR A 128 -0.188 -1.711 -2.638 1.00 0.67 C ATOM 1085 OH TYR A 128 -1.127 -1.266 -1.730 1.00 0.78 O ATOM 0 H TYR A 128 3.496 -4.947 -7.279 1.00 0.36 H new ATOM 0 HA TYR A 128 3.591 -4.696 -4.250 1.00 0.35 H new ATOM 0 HB2 TYR A 128 3.640 -2.490 -5.426 1.00 0.42 H new ATOM 0 HB3 TYR A 128 2.349 -2.999 -6.496 1.00 0.42 H new ATOM 0 HD1 TYR A 128 2.827 -3.286 -2.763 1.00 0.50 H new ATOM 0 HD2 TYR A 128 0.386 -1.840 -5.991 1.00 0.63 H new ATOM 0 HE1 TYR A 128 1.139 -2.486 -1.130 1.00 0.59 H new ATOM 0 HE2 TYR A 128 -1.298 -1.038 -4.357 1.00 0.72 H new ATOM 0 HH TYR A 128 -1.873 -0.848 -2.209 1.00 0.78 H new ATOM 1095 N ILE A 129 1.807 -6.427 -4.311 1.00 0.39 N ATOM 1096 CA ILE A 129 0.617 -7.325 -4.241 1.00 0.45 C ATOM 1097 C ILE A 129 -0.349 -6.843 -3.155 1.00 0.41 C ATOM 1098 O ILE A 129 -0.011 -6.014 -2.331 1.00 0.61 O ATOM 1099 CB ILE A 129 1.182 -8.710 -3.910 1.00 0.58 C ATOM 1100 CG1 ILE A 129 2.129 -9.147 -5.035 1.00 0.71 C ATOM 1101 CG2 ILE A 129 0.034 -9.719 -3.789 1.00 0.68 C ATOM 1102 CD1 ILE A 129 2.764 -10.495 -4.688 1.00 0.98 C ATOM 0 H ILE A 129 2.546 -6.633 -3.639 1.00 0.39 H new ATOM 0 HA ILE A 129 0.050 -7.338 -5.172 1.00 0.45 H new ATOM 0 HB ILE A 129 1.725 -8.668 -2.966 1.00 0.58 H new ATOM 0 HG12 ILE A 129 1.581 -9.225 -5.974 1.00 0.71 H new ATOM 0 HG13 ILE A 129 2.906 -8.396 -5.180 1.00 0.71 H new ATOM 0 HG21 ILE A 129 0.438 -10.704 -3.554 1.00 0.68 H new ATOM 0 HG22 ILE A 129 -0.644 -9.406 -2.995 1.00 0.68 H new ATOM 0 HG23 ILE A 129 -0.510 -9.766 -4.732 1.00 0.68 H new ATOM 0 HD11 ILE A 129 3.435 -10.799 -5.491 1.00 0.98 H new ATOM 0 HD12 ILE A 129 3.328 -10.403 -3.760 1.00 0.98 H new ATOM 0 HD13 ILE A 129 1.982 -11.245 -4.565 1.00 0.98 H new ATOM 1114 N GLN A 130 -1.552 -7.356 -3.161 1.00 0.37 N ATOM 1115 CA GLN A 130 -2.562 -6.938 -2.145 1.00 0.33 C ATOM 1116 C GLN A 130 -3.693 -7.969 -2.083 1.00 0.34 C ATOM 1117 O GLN A 130 -4.374 -8.202 -3.061 1.00 0.39 O ATOM 1118 CB GLN A 130 -3.085 -5.592 -2.651 1.00 0.43 C ATOM 1119 CG GLN A 130 -4.107 -5.033 -1.662 1.00 0.77 C ATOM 1120 CD GLN A 130 -4.957 -3.966 -2.353 1.00 0.87 C ATOM 1121 OE1 GLN A 130 -5.746 -4.272 -3.225 1.00 1.71 O ATOM 1122 NE2 GLN A 130 -4.829 -2.716 -1.999 1.00 0.71 N ATOM 0 H GLN A 130 -1.880 -8.052 -3.831 1.00 0.37 H new ATOM 0 HA GLN A 130 -2.145 -6.862 -1.141 1.00 0.33 H new ATOM 0 HB2 GLN A 130 -2.259 -4.891 -2.770 1.00 0.43 H new ATOM 0 HB3 GLN A 130 -3.543 -5.714 -3.632 1.00 0.43 H new ATOM 0 HG2 GLN A 130 -4.744 -5.835 -1.289 1.00 0.77 H new ATOM 0 HG3 GLN A 130 -3.597 -4.604 -0.799 1.00 0.77 H new ATOM 0 HE21 GLN A 130 -4.167 -2.458 -1.267 1.00 0.71 H new ATOM 0 HE22 GLN A 130 -5.391 -1.997 -2.454 1.00 0.71 H new ATOM 1131 N HIS A 131 -3.898 -8.587 -0.944 1.00 0.33 N ATOM 1132 CA HIS A 131 -4.988 -9.606 -0.824 1.00 0.36 C ATOM 1133 C HIS A 131 -6.173 -9.018 -0.065 1.00 0.36 C ATOM 1134 O HIS A 131 -6.047 -8.609 1.073 1.00 0.58 O ATOM 1135 CB HIS A 131 -4.388 -10.770 -0.028 1.00 0.41 C ATOM 1136 CG HIS A 131 -3.185 -11.314 -0.745 1.00 0.45 C ATOM 1137 ND1 HIS A 131 -3.089 -12.640 -1.134 1.00 0.62 N ATOM 1138 CD2 HIS A 131 -2.018 -10.720 -1.145 1.00 0.40 C ATOM 1139 CE1 HIS A 131 -1.899 -12.799 -1.741 1.00 0.64 C ATOM 1140 NE2 HIS A 131 -1.205 -11.657 -1.775 1.00 0.51 N ATOM 0 H HIS A 131 -3.358 -8.430 -0.093 1.00 0.33 H new ATOM 0 HA HIS A 131 -5.346 -9.926 -1.802 1.00 0.36 H new ATOM 0 HB2 HIS A 131 -4.106 -10.433 0.969 1.00 0.41 H new ATOM 0 HB3 HIS A 131 -5.132 -11.556 0.100 1.00 0.41 H new ATOM 0 HD1 HIS A 131 -3.792 -13.364 -0.987 1.00 0.62 H new ATOM 0 HD2 HIS A 131 -1.766 -9.681 -0.994 1.00 0.40 H new ATOM 0 HE1 HIS A 131 -1.548 -13.734 -2.151 1.00 0.64 H new ATOM 1148 N THR A 132 -7.323 -8.977 -0.684 1.00 0.38 N ATOM 1149 CA THR A 132 -8.522 -8.418 0.006 1.00 0.38 C ATOM 1150 C THR A 132 -9.075 -9.441 1.004 1.00 0.39 C ATOM 1151 O THR A 132 -9.949 -10.222 0.683 1.00 0.55 O ATOM 1152 CB THR A 132 -9.537 -8.146 -1.107 1.00 0.43 C ATOM 1153 OG1 THR A 132 -8.886 -7.493 -2.188 1.00 0.49 O ATOM 1154 CG2 THR A 132 -10.659 -7.255 -0.571 1.00 0.46 C ATOM 0 H THR A 132 -7.484 -9.306 -1.636 1.00 0.38 H new ATOM 0 HA THR A 132 -8.291 -7.514 0.569 1.00 0.38 H new ATOM 0 HB THR A 132 -9.960 -9.089 -1.453 1.00 0.43 H new ATOM 0 HG1 THR A 132 -8.517 -8.163 -2.800 1.00 0.49 H new ATOM 0 HG21 THR A 132 -11.381 -7.062 -1.365 1.00 0.46 H new ATOM 0 HG22 THR A 132 -11.157 -7.757 0.259 1.00 0.46 H new ATOM 0 HG23 THR A 132 -10.240 -6.310 -0.225 1.00 0.46 H new ATOM 1162 N TYR A 133 -8.568 -9.441 2.211 1.00 0.36 N ATOM 1163 CA TYR A 133 -9.059 -10.412 3.237 1.00 0.40 C ATOM 1164 C TYR A 133 -10.358 -9.902 3.866 1.00 0.44 C ATOM 1165 O TYR A 133 -10.454 -8.759 4.271 1.00 0.59 O ATOM 1166 CB TYR A 133 -7.946 -10.483 4.287 1.00 0.48 C ATOM 1167 CG TYR A 133 -7.109 -11.721 4.066 1.00 0.52 C ATOM 1168 CD1 TYR A 133 -6.139 -11.740 3.056 1.00 0.53 C ATOM 1169 CD2 TYR A 133 -7.300 -12.848 4.874 1.00 0.76 C ATOM 1170 CE1 TYR A 133 -5.362 -12.887 2.855 1.00 0.61 C ATOM 1171 CE2 TYR A 133 -6.523 -13.994 4.672 1.00 0.87 C ATOM 1172 CZ TYR A 133 -5.553 -14.014 3.663 1.00 0.74 C ATOM 1173 OH TYR A 133 -4.787 -15.144 3.464 1.00 0.89 O ATOM 0 H TYR A 133 -7.834 -8.809 2.531 1.00 0.36 H new ATOM 0 HA TYR A 133 -9.275 -11.391 2.808 1.00 0.40 H new ATOM 0 HB2 TYR A 133 -7.319 -9.594 4.225 1.00 0.48 H new ATOM 0 HB3 TYR A 133 -8.378 -10.500 5.287 1.00 0.48 H new ATOM 0 HD1 TYR A 133 -5.991 -10.871 2.433 1.00 0.53 H new ATOM 0 HD2 TYR A 133 -8.047 -12.833 5.654 1.00 0.76 H new ATOM 0 HE1 TYR A 133 -4.614 -12.902 2.076 1.00 0.61 H new ATOM 0 HE2 TYR A 133 -6.672 -14.864 5.295 1.00 0.87 H new ATOM 0 HH TYR A 133 -5.047 -15.833 4.110 1.00 0.89 H new ATOM 1183 N ARG A 134 -11.356 -10.745 3.950 1.00 0.46 N ATOM 1184 CA ARG A 134 -12.655 -10.319 4.552 1.00 0.56 C ATOM 1185 C ARG A 134 -12.992 -11.203 5.756 1.00 0.71 C ATOM 1186 O ARG A 134 -13.182 -12.397 5.626 1.00 1.14 O ATOM 1187 CB ARG A 134 -13.689 -10.507 3.441 1.00 0.78 C ATOM 1188 CG ARG A 134 -14.714 -9.373 3.501 1.00 0.85 C ATOM 1189 CD ARG A 134 -15.845 -9.653 2.509 1.00 1.40 C ATOM 1190 NE ARG A 134 -16.826 -10.476 3.269 1.00 1.97 N ATOM 1191 CZ ARG A 134 -18.088 -10.456 2.939 1.00 2.40 C ATOM 1192 NH1 ARG A 134 -18.698 -9.315 2.764 1.00 3.11 N ATOM 1193 NH2 ARG A 134 -18.741 -11.575 2.786 1.00 2.76 N ATOM 0 H ARG A 134 -11.327 -11.712 3.627 1.00 0.46 H new ATOM 0 HA ARG A 134 -12.627 -9.290 4.910 1.00 0.56 H new ATOM 0 HB2 ARG A 134 -13.196 -10.515 2.469 1.00 0.78 H new ATOM 0 HB3 ARG A 134 -14.188 -11.469 3.553 1.00 0.78 H new ATOM 0 HG2 ARG A 134 -15.115 -9.285 4.511 1.00 0.85 H new ATOM 0 HG3 ARG A 134 -14.235 -8.423 3.264 1.00 0.85 H new ATOM 0 HD2 ARG A 134 -16.297 -8.727 2.154 1.00 1.40 H new ATOM 0 HD3 ARG A 134 -15.478 -10.186 1.632 1.00 1.40 H new ATOM 0 HE ARG A 134 -16.511 -11.055 4.047 1.00 1.97 H new ATOM 0 HH11 ARG A 134 -18.188 -8.440 2.885 1.00 3.11 H new ATOM 0 HH12 ARG A 134 -19.685 -9.299 2.506 1.00 3.11 H new ATOM 0 HH21 ARG A 134 -18.265 -12.466 2.924 1.00 2.76 H new ATOM 0 HH22 ARG A 134 -19.728 -11.559 2.528 1.00 2.76 H new ATOM 1207 N LYS A 135 -13.065 -10.623 6.931 1.00 0.95 N ATOM 1208 CA LYS A 135 -13.388 -11.416 8.164 1.00 1.21 C ATOM 1209 C LYS A 135 -12.443 -12.616 8.299 1.00 1.06 C ATOM 1210 O LYS A 135 -12.841 -13.686 8.719 1.00 1.25 O ATOM 1211 CB LYS A 135 -14.834 -11.886 7.980 1.00 1.58 C ATOM 1212 CG LYS A 135 -15.769 -10.675 7.977 1.00 2.01 C ATOM 1213 CD LYS A 135 -16.215 -10.371 9.408 1.00 2.49 C ATOM 1214 CE LYS A 135 -17.509 -11.130 9.712 1.00 3.12 C ATOM 1215 NZ LYS A 135 -17.404 -11.507 11.149 1.00 4.04 N ATOM 0 H LYS A 135 -12.914 -9.627 7.091 1.00 0.95 H new ATOM 0 HA LYS A 135 -13.268 -10.821 9.069 1.00 1.21 H new ATOM 0 HB2 LYS A 135 -14.932 -12.437 7.044 1.00 1.58 H new ATOM 0 HB3 LYS A 135 -15.110 -12.570 8.783 1.00 1.58 H new ATOM 0 HG2 LYS A 135 -15.260 -9.810 7.552 1.00 2.01 H new ATOM 0 HG3 LYS A 135 -16.637 -10.874 7.349 1.00 2.01 H new ATOM 0 HD2 LYS A 135 -15.436 -10.662 10.113 1.00 2.49 H new ATOM 0 HD3 LYS A 135 -16.372 -9.299 9.531 1.00 2.49 H new ATOM 0 HE2 LYS A 135 -18.385 -10.507 9.530 1.00 3.12 H new ATOM 0 HE3 LYS A 135 -17.608 -12.012 9.079 1.00 3.12 H new ATOM 0 HZ1 LYS A 135 -18.256 -12.032 11.433 1.00 4.04 H new ATOM 0 HZ2 LYS A 135 -16.565 -12.105 11.291 1.00 4.04 H new ATOM 0 HZ3 LYS A 135 -17.318 -10.647 11.728 1.00 4.04 H new ATOM 1229 N GLY A 136 -11.195 -12.440 7.945 1.00 0.99 N ATOM 1230 CA GLY A 136 -10.214 -13.560 8.049 1.00 1.14 C ATOM 1231 C GLY A 136 -10.419 -14.531 6.885 1.00 1.10 C ATOM 1232 O GLY A 136 -10.255 -15.728 7.030 1.00 1.42 O ATOM 0 H GLY A 136 -10.813 -11.565 7.587 1.00 0.99 H new ATOM 0 HA2 GLY A 136 -9.197 -13.168 8.034 1.00 1.14 H new ATOM 0 HA3 GLY A 136 -10.341 -14.082 8.998 1.00 1.14 H new ATOM 1236 N VAL A 137 -10.777 -14.024 5.732 1.00 0.94 N ATOM 1237 CA VAL A 137 -10.995 -14.913 4.551 1.00 1.02 C ATOM 1238 C VAL A 137 -10.601 -14.182 3.262 1.00 0.86 C ATOM 1239 O VAL A 137 -11.254 -13.243 2.848 1.00 0.92 O ATOM 1240 CB VAL A 137 -12.495 -15.230 4.556 1.00 1.18 C ATOM 1241 CG1 VAL A 137 -12.829 -16.161 3.387 1.00 1.72 C ATOM 1242 CG2 VAL A 137 -12.872 -15.920 5.870 1.00 1.58 C ATOM 0 H VAL A 137 -10.928 -13.030 5.558 1.00 0.94 H new ATOM 0 HA VAL A 137 -10.392 -15.820 4.600 1.00 1.02 H new ATOM 0 HB VAL A 137 -13.056 -14.301 4.456 1.00 1.18 H new ATOM 0 HG11 VAL A 137 -13.896 -16.385 3.393 1.00 1.72 H new ATOM 0 HG12 VAL A 137 -12.566 -15.675 2.448 1.00 1.72 H new ATOM 0 HG13 VAL A 137 -12.264 -17.088 3.487 1.00 1.72 H new ATOM 0 HG21 VAL A 137 -13.939 -16.144 5.870 1.00 1.58 H new ATOM 0 HG22 VAL A 137 -12.307 -16.847 5.970 1.00 1.58 H new ATOM 0 HG23 VAL A 137 -12.639 -15.261 6.707 1.00 1.58 H new ATOM 1252 N LYS A 138 -9.538 -14.609 2.629 1.00 0.86 N ATOM 1253 CA LYS A 138 -9.094 -13.944 1.363 1.00 0.78 C ATOM 1254 C LYS A 138 -10.158 -14.114 0.275 1.00 0.68 C ATOM 1255 O LYS A 138 -10.628 -15.207 0.021 1.00 0.74 O ATOM 1256 CB LYS A 138 -7.793 -14.650 0.960 1.00 0.94 C ATOM 1257 CG LYS A 138 -8.037 -16.160 0.802 1.00 1.61 C ATOM 1258 CD LYS A 138 -7.802 -16.577 -0.654 1.00 2.12 C ATOM 1259 CE LYS A 138 -7.180 -17.975 -0.692 1.00 2.28 C ATOM 1260 NZ LYS A 138 -8.326 -18.901 -0.913 1.00 2.82 N ATOM 0 H LYS A 138 -8.957 -15.390 2.933 1.00 0.86 H new ATOM 0 HA LYS A 138 -8.943 -12.873 1.498 1.00 0.78 H new ATOM 0 HB2 LYS A 138 -7.420 -14.234 0.024 1.00 0.94 H new ATOM 0 HB3 LYS A 138 -7.026 -14.475 1.715 1.00 0.94 H new ATOM 0 HG2 LYS A 138 -7.370 -16.716 1.461 1.00 1.61 H new ATOM 0 HG3 LYS A 138 -9.056 -16.406 1.100 1.00 1.61 H new ATOM 0 HD2 LYS A 138 -8.745 -16.572 -1.201 1.00 2.12 H new ATOM 0 HD3 LYS A 138 -7.144 -15.861 -1.146 1.00 2.12 H new ATOM 0 HE2 LYS A 138 -6.445 -18.058 -1.493 1.00 2.28 H new ATOM 0 HE3 LYS A 138 -6.663 -18.202 0.240 1.00 2.28 H new ATOM 0 HZ1 LYS A 138 -7.979 -19.881 -0.951 1.00 2.82 H new ATOM 0 HZ2 LYS A 138 -9.006 -18.805 -0.132 1.00 2.82 H new ATOM 0 HZ3 LYS A 138 -8.795 -18.665 -1.811 1.00 2.82 H new ATOM 1274 N ILE A 139 -10.540 -13.038 -0.368 1.00 0.61 N ATOM 1275 CA ILE A 139 -11.576 -13.131 -1.441 1.00 0.60 C ATOM 1276 C ILE A 139 -10.984 -12.740 -2.801 1.00 0.69 C ATOM 1277 O ILE A 139 -11.497 -13.124 -3.836 1.00 0.95 O ATOM 1278 CB ILE A 139 -12.684 -12.159 -1.023 1.00 0.66 C ATOM 1279 CG1 ILE A 139 -12.118 -10.732 -0.899 1.00 1.07 C ATOM 1280 CG2 ILE A 139 -13.265 -12.601 0.324 1.00 1.47 C ATOM 1281 CD1 ILE A 139 -12.946 -9.774 -1.758 1.00 1.25 C ATOM 0 H ILE A 139 -10.179 -12.100 -0.196 1.00 0.61 H new ATOM 0 HA ILE A 139 -11.956 -14.147 -1.552 1.00 0.60 H new ATOM 0 HB ILE A 139 -13.468 -12.163 -1.780 1.00 0.66 H new ATOM 0 HG12 ILE A 139 -12.138 -10.412 0.143 1.00 1.07 H new ATOM 0 HG13 ILE A 139 -11.076 -10.714 -1.218 1.00 1.07 H new ATOM 0 HG21 ILE A 139 -14.054 -11.911 0.624 1.00 1.47 H new ATOM 0 HG22 ILE A 139 -13.678 -13.605 0.230 1.00 1.47 H new ATOM 0 HG23 ILE A 139 -12.477 -12.601 1.077 1.00 1.47 H new ATOM 0 HD11 ILE A 139 -12.544 -8.765 -1.669 1.00 1.25 H new ATOM 0 HD12 ILE A 139 -12.904 -10.091 -2.800 1.00 1.25 H new ATOM 0 HD13 ILE A 139 -13.982 -9.783 -1.418 1.00 1.25 H new ATOM 1293 N ASP A 140 -9.910 -11.984 -2.812 1.00 0.59 N ATOM 1294 CA ASP A 140 -9.292 -11.576 -4.113 1.00 0.77 C ATOM 1295 C ASP A 140 -7.930 -10.914 -3.880 1.00 0.61 C ATOM 1296 O ASP A 140 -7.789 -10.044 -3.041 1.00 0.67 O ATOM 1297 CB ASP A 140 -10.272 -10.571 -4.723 1.00 1.04 C ATOM 1298 CG ASP A 140 -10.171 -10.622 -6.249 1.00 1.39 C ATOM 1299 OD1 ASP A 140 -9.202 -10.101 -6.776 1.00 2.00 O ATOM 1300 OD2 ASP A 140 -11.064 -11.181 -6.864 1.00 1.94 O ATOM 0 H ASP A 140 -9.437 -11.634 -1.979 1.00 0.59 H new ATOM 0 HA ASP A 140 -9.120 -12.432 -4.766 1.00 0.77 H new ATOM 0 HB2 ASP A 140 -11.289 -10.802 -4.407 1.00 1.04 H new ATOM 0 HB3 ASP A 140 -10.048 -9.566 -4.366 1.00 1.04 H new ATOM 1305 N LYS A 141 -6.931 -11.315 -4.627 1.00 0.53 N ATOM 1306 CA LYS A 141 -5.575 -10.707 -4.467 1.00 0.49 C ATOM 1307 C LYS A 141 -4.913 -10.537 -5.841 1.00 0.66 C ATOM 1308 O LYS A 141 -5.081 -11.360 -6.722 1.00 0.92 O ATOM 1309 CB LYS A 141 -4.786 -11.691 -3.588 1.00 0.55 C ATOM 1310 CG LYS A 141 -4.654 -13.043 -4.303 1.00 1.00 C ATOM 1311 CD LYS A 141 -4.641 -14.174 -3.272 1.00 1.25 C ATOM 1312 CE LYS A 141 -4.893 -15.511 -3.976 1.00 1.80 C ATOM 1313 NZ LYS A 141 -5.795 -16.265 -3.061 1.00 2.12 N ATOM 0 H LYS A 141 -6.997 -12.039 -5.342 1.00 0.53 H new ATOM 0 HA LYS A 141 -5.615 -9.717 -4.012 1.00 0.49 H new ATOM 0 HB2 LYS A 141 -3.797 -11.286 -3.372 1.00 0.55 H new ATOM 0 HB3 LYS A 141 -5.292 -11.824 -2.632 1.00 0.55 H new ATOM 0 HG2 LYS A 141 -5.483 -13.180 -4.997 1.00 1.00 H new ATOM 0 HG3 LYS A 141 -3.738 -13.065 -4.893 1.00 1.00 H new ATOM 0 HD2 LYS A 141 -3.682 -14.198 -2.755 1.00 1.25 H new ATOM 0 HD3 LYS A 141 -5.406 -13.999 -2.515 1.00 1.25 H new ATOM 0 HE2 LYS A 141 -5.355 -15.362 -4.952 1.00 1.80 H new ATOM 0 HE3 LYS A 141 -3.961 -16.050 -4.144 1.00 1.80 H new ATOM 0 HZ1 LYS A 141 -5.784 -17.273 -3.316 1.00 2.12 H new ATOM 0 HZ2 LYS A 141 -5.468 -16.153 -2.080 1.00 2.12 H new ATOM 0 HZ3 LYS A 141 -6.764 -15.896 -3.147 1.00 2.12 H new ATOM 1327 N THR A 142 -4.171 -9.475 -6.031 1.00 0.62 N ATOM 1328 CA THR A 142 -3.505 -9.250 -7.351 1.00 0.85 C ATOM 1329 C THR A 142 -2.082 -8.715 -7.156 1.00 0.68 C ATOM 1330 O THR A 142 -1.703 -8.314 -6.073 1.00 0.56 O ATOM 1331 CB THR A 142 -4.375 -8.210 -8.060 1.00 1.13 C ATOM 1332 OG1 THR A 142 -5.721 -8.663 -8.090 1.00 1.29 O ATOM 1333 CG2 THR A 142 -3.871 -8.007 -9.489 1.00 1.42 C ATOM 0 H THR A 142 -3.998 -8.755 -5.330 1.00 0.62 H new ATOM 0 HA THR A 142 -3.415 -10.172 -7.925 1.00 0.85 H new ATOM 0 HB THR A 142 -4.321 -7.264 -7.522 1.00 1.13 H new ATOM 0 HG1 THR A 142 -6.280 -7.997 -8.542 1.00 1.29 H new ATOM 0 HG21 THR A 142 -4.492 -7.266 -9.992 1.00 1.42 H new ATOM 0 HG22 THR A 142 -2.838 -7.659 -9.465 1.00 1.42 H new ATOM 0 HG23 THR A 142 -3.923 -8.951 -10.031 1.00 1.42 H new ATOM 1341 N ASP A 143 -1.298 -8.707 -8.205 1.00 0.75 N ATOM 1342 CA ASP A 143 0.105 -8.199 -8.102 1.00 0.64 C ATOM 1343 C ASP A 143 0.298 -6.990 -9.027 1.00 0.62 C ATOM 1344 O ASP A 143 0.178 -7.099 -10.233 1.00 0.82 O ATOM 1345 CB ASP A 143 0.991 -9.371 -8.547 1.00 0.70 C ATOM 1346 CG ASP A 143 0.623 -9.796 -9.974 1.00 1.53 C ATOM 1347 OD1 ASP A 143 -0.476 -10.292 -10.158 1.00 2.18 O ATOM 1348 OD2 ASP A 143 1.448 -9.617 -10.855 1.00 2.32 O ATOM 0 H ASP A 143 -1.571 -9.032 -9.133 1.00 0.75 H new ATOM 0 HA ASP A 143 0.352 -7.868 -7.093 1.00 0.64 H new ATOM 0 HB2 ASP A 143 2.041 -9.080 -8.505 1.00 0.70 H new ATOM 0 HB3 ASP A 143 0.865 -10.212 -7.865 1.00 0.70 H new ATOM 1353 N TYR A 144 0.593 -5.841 -8.470 1.00 0.57 N ATOM 1354 CA TYR A 144 0.791 -4.621 -9.313 1.00 0.56 C ATOM 1355 C TYR A 144 2.276 -4.422 -9.624 1.00 0.54 C ATOM 1356 O TYR A 144 3.048 -4.029 -8.769 1.00 0.65 O ATOM 1357 CB TYR A 144 0.268 -3.457 -8.465 1.00 0.63 C ATOM 1358 CG TYR A 144 -1.212 -3.255 -8.711 1.00 0.58 C ATOM 1359 CD1 TYR A 144 -2.093 -4.346 -8.670 1.00 1.52 C ATOM 1360 CD2 TYR A 144 -1.702 -1.972 -8.976 1.00 0.98 C ATOM 1361 CE1 TYR A 144 -3.460 -4.150 -8.897 1.00 1.52 C ATOM 1362 CE2 TYR A 144 -3.070 -1.777 -9.203 1.00 1.06 C ATOM 1363 CZ TYR A 144 -3.949 -2.865 -9.164 1.00 0.72 C ATOM 1364 OH TYR A 144 -5.297 -2.673 -9.387 1.00 0.86 O ATOM 0 H TYR A 144 0.705 -5.695 -7.467 1.00 0.57 H new ATOM 0 HA TYR A 144 0.272 -4.699 -10.268 1.00 0.56 H new ATOM 0 HB2 TYR A 144 0.444 -3.659 -7.409 1.00 0.63 H new ATOM 0 HB3 TYR A 144 0.813 -2.545 -8.710 1.00 0.63 H new ATOM 0 HD1 TYR A 144 -1.716 -5.337 -8.463 1.00 1.52 H new ATOM 0 HD2 TYR A 144 -1.025 -1.131 -9.006 1.00 0.98 H new ATOM 0 HE1 TYR A 144 -4.138 -4.990 -8.866 1.00 1.52 H new ATOM 0 HE2 TYR A 144 -3.447 -0.786 -9.408 1.00 1.06 H new ATOM 0 HH TYR A 144 -5.469 -1.723 -9.556 1.00 0.86 H new ATOM 1374 N MET A 145 2.678 -4.681 -10.842 1.00 0.59 N ATOM 1375 CA MET A 145 4.114 -4.495 -11.214 1.00 0.61 C ATOM 1376 C MET A 145 4.473 -3.009 -11.149 1.00 0.66 C ATOM 1377 O MET A 145 3.970 -2.208 -11.915 1.00 0.76 O ATOM 1378 CB MET A 145 4.234 -5.016 -12.648 1.00 0.69 C ATOM 1379 CG MET A 145 5.647 -5.553 -12.881 1.00 0.93 C ATOM 1380 SD MET A 145 5.696 -6.467 -14.442 1.00 1.78 S ATOM 1381 CE MET A 145 7.202 -5.710 -15.100 1.00 2.23 C ATOM 0 H MET A 145 2.075 -5.013 -11.595 1.00 0.59 H new ATOM 0 HA MET A 145 4.789 -5.023 -10.541 1.00 0.61 H new ATOM 0 HB2 MET A 145 3.501 -5.804 -12.822 1.00 0.69 H new ATOM 0 HB3 MET A 145 4.016 -4.216 -13.356 1.00 0.69 H new ATOM 0 HG2 MET A 145 6.361 -4.730 -12.907 1.00 0.93 H new ATOM 0 HG3 MET A 145 5.941 -6.203 -12.057 1.00 0.93 H new ATOM 0 HE1 MET A 145 7.425 -6.135 -16.079 1.00 2.23 H new ATOM 0 HE2 MET A 145 7.056 -4.634 -15.196 1.00 2.23 H new ATOM 0 HE3 MET A 145 8.033 -5.904 -14.422 1.00 2.23 H new ATOM 1391 N VAL A 146 5.332 -2.636 -10.235 1.00 0.64 N ATOM 1392 CA VAL A 146 5.720 -1.198 -10.108 1.00 0.73 C ATOM 1393 C VAL A 146 6.762 -0.839 -11.172 1.00 0.77 C ATOM 1394 O VAL A 146 6.497 -0.058 -12.067 1.00 0.93 O ATOM 1395 CB VAL A 146 6.310 -1.060 -8.699 1.00 0.69 C ATOM 1396 CG1 VAL A 146 6.695 0.399 -8.444 1.00 0.81 C ATOM 1397 CG2 VAL A 146 5.270 -1.491 -7.660 1.00 0.69 C ATOM 0 H VAL A 146 5.782 -3.265 -9.570 1.00 0.64 H new ATOM 0 HA VAL A 146 4.873 -0.527 -10.254 1.00 0.73 H new ATOM 0 HB VAL A 146 7.193 -1.693 -8.619 1.00 0.69 H new ATOM 0 HG11 VAL A 146 7.114 0.495 -7.442 1.00 0.81 H new ATOM 0 HG12 VAL A 146 7.436 0.714 -9.179 1.00 0.81 H new ATOM 0 HG13 VAL A 146 5.810 1.029 -8.529 1.00 0.81 H new ATOM 0 HG21 VAL A 146 5.692 -1.392 -6.660 1.00 0.69 H new ATOM 0 HG22 VAL A 146 4.387 -0.858 -7.745 1.00 0.69 H new ATOM 0 HG23 VAL A 146 4.990 -2.530 -7.834 1.00 0.69 H new ATOM 1407 N GLY A 147 7.939 -1.405 -11.084 1.00 0.70 N ATOM 1408 CA GLY A 147 8.996 -1.099 -12.094 1.00 0.78 C ATOM 1409 C GLY A 147 10.377 -1.179 -11.441 1.00 0.74 C ATOM 1410 O GLY A 147 10.498 -1.350 -10.242 1.00 0.80 O ATOM 0 H GLY A 147 8.213 -2.065 -10.357 1.00 0.70 H new ATOM 0 HA2 GLY A 147 8.934 -1.804 -12.923 1.00 0.78 H new ATOM 0 HA3 GLY A 147 8.837 -0.104 -12.509 1.00 0.78 H new ATOM 1414 N SER A 148 11.417 -1.055 -12.226 1.00 0.69 N ATOM 1415 CA SER A 148 12.800 -1.119 -11.665 1.00 0.67 C ATOM 1416 C SER A 148 13.207 0.250 -11.113 1.00 0.65 C ATOM 1417 O SER A 148 12.768 1.276 -11.597 1.00 0.74 O ATOM 1418 CB SER A 148 13.689 -1.506 -12.847 1.00 0.71 C ATOM 1419 OG SER A 148 13.597 -0.503 -13.851 1.00 1.36 O ATOM 0 H SER A 148 11.367 -0.912 -13.235 1.00 0.69 H new ATOM 0 HA SER A 148 12.882 -1.831 -10.844 1.00 0.67 H new ATOM 0 HB2 SER A 148 14.723 -1.615 -12.519 1.00 0.71 H new ATOM 0 HB3 SER A 148 13.379 -2.470 -13.250 1.00 0.71 H new ATOM 0 HG SER A 148 14.167 -0.747 -14.610 1.00 1.36 H new ATOM 1425 N TYR A 149 14.041 0.270 -10.105 1.00 0.63 N ATOM 1426 CA TYR A 149 14.478 1.571 -9.516 1.00 0.68 C ATOM 1427 C TYR A 149 15.913 1.463 -8.996 1.00 0.68 C ATOM 1428 O TYR A 149 16.233 0.593 -8.209 1.00 0.84 O ATOM 1429 CB TYR A 149 13.506 1.834 -8.365 1.00 0.76 C ATOM 1430 CG TYR A 149 12.107 1.974 -8.914 1.00 0.65 C ATOM 1431 CD1 TYR A 149 11.762 3.101 -9.670 1.00 1.15 C ATOM 1432 CD2 TYR A 149 11.156 0.975 -8.673 1.00 0.90 C ATOM 1433 CE1 TYR A 149 10.466 3.229 -10.184 1.00 1.26 C ATOM 1434 CE2 TYR A 149 9.861 1.103 -9.189 1.00 0.78 C ATOM 1435 CZ TYR A 149 9.516 2.230 -9.944 1.00 0.70 C ATOM 1436 OH TYR A 149 8.240 2.356 -10.452 1.00 0.84 O ATOM 0 H TYR A 149 14.438 -0.559 -9.664 1.00 0.63 H new ATOM 0 HA TYR A 149 14.468 2.378 -10.248 1.00 0.68 H new ATOM 0 HB2 TYR A 149 13.546 1.016 -7.646 1.00 0.76 H new ATOM 0 HB3 TYR A 149 13.792 2.741 -7.832 1.00 0.76 H new ATOM 0 HD1 TYR A 149 12.496 3.871 -9.857 1.00 1.15 H new ATOM 0 HD2 TYR A 149 11.421 0.106 -8.089 1.00 0.90 H new ATOM 0 HE1 TYR A 149 10.199 4.099 -10.766 1.00 1.26 H new ATOM 0 HE2 TYR A 149 9.128 0.332 -9.004 1.00 0.78 H new ATOM 0 HH TYR A 149 8.051 1.604 -11.051 1.00 0.84 H new ATOM 1446 N GLY A 150 16.777 2.344 -9.433 1.00 0.68 N ATOM 1447 CA GLY A 150 18.195 2.304 -8.971 1.00 0.70 C ATOM 1448 C GLY A 150 18.410 3.371 -7.890 1.00 0.67 C ATOM 1449 O GLY A 150 17.787 4.414 -7.930 1.00 0.71 O ATOM 0 H GLY A 150 16.559 3.091 -10.092 1.00 0.68 H new ATOM 0 HA2 GLY A 150 18.432 1.317 -8.575 1.00 0.70 H new ATOM 0 HA3 GLY A 150 18.867 2.481 -9.810 1.00 0.70 H new ATOM 1453 N PRO A 151 19.286 3.087 -6.949 1.00 0.68 N ATOM 1454 CA PRO A 151 19.557 4.061 -5.864 1.00 0.76 C ATOM 1455 C PRO A 151 20.355 5.248 -6.405 1.00 0.83 C ATOM 1456 O PRO A 151 21.238 5.087 -7.227 1.00 1.05 O ATOM 1457 CB PRO A 151 20.380 3.263 -4.856 1.00 0.81 C ATOM 1458 CG PRO A 151 21.023 2.176 -5.656 1.00 0.76 C ATOM 1459 CD PRO A 151 20.096 1.864 -6.801 1.00 0.71 C ATOM 0 HA PRO A 151 18.650 4.477 -5.425 1.00 0.76 H new ATOM 0 HB2 PRO A 151 21.127 3.891 -4.371 1.00 0.81 H new ATOM 0 HB3 PRO A 151 19.749 2.852 -4.068 1.00 0.81 H new ATOM 0 HG2 PRO A 151 21.998 2.494 -6.025 1.00 0.76 H new ATOM 0 HG3 PRO A 151 21.188 1.291 -5.041 1.00 0.76 H new ATOM 0 HD2 PRO A 151 20.650 1.639 -7.713 1.00 0.71 H new ATOM 0 HD3 PRO A 151 19.473 0.996 -6.585 1.00 0.71 H new ATOM 1467 N ARG A 152 20.047 6.437 -5.952 1.00 1.34 N ATOM 1468 CA ARG A 152 20.785 7.639 -6.443 1.00 1.51 C ATOM 1469 C ARG A 152 20.490 8.858 -5.564 1.00 1.33 C ATOM 1470 O ARG A 152 21.369 9.653 -5.287 1.00 1.65 O ATOM 1471 CB ARG A 152 20.261 7.867 -7.861 1.00 2.30 C ATOM 1472 CG ARG A 152 21.228 8.775 -8.623 1.00 2.83 C ATOM 1473 CD ARG A 152 21.174 8.440 -10.115 1.00 3.22 C ATOM 1474 NE ARG A 152 22.580 8.572 -10.588 1.00 3.80 N ATOM 1475 CZ ARG A 152 22.924 9.585 -11.336 1.00 4.16 C ATOM 1476 NH1 ARG A 152 23.345 10.690 -10.785 1.00 4.58 N ATOM 1477 NH2 ARG A 152 22.844 9.492 -12.635 1.00 4.47 N ATOM 0 H ARG A 152 19.318 6.627 -5.265 1.00 1.34 H new ATOM 0 HA ARG A 152 21.865 7.492 -6.417 1.00 1.51 H new ATOM 0 HB2 ARG A 152 20.156 6.914 -8.379 1.00 2.30 H new ATOM 0 HB3 ARG A 152 19.271 8.321 -7.825 1.00 2.30 H new ATOM 0 HG2 ARG A 152 20.963 9.820 -8.464 1.00 2.83 H new ATOM 0 HG3 ARG A 152 22.242 8.642 -8.246 1.00 2.83 H new ATOM 0 HD2 ARG A 152 20.795 7.432 -10.280 1.00 3.22 H new ATOM 0 HD3 ARG A 152 20.512 9.121 -10.649 1.00 3.22 H new ATOM 0 HE ARG A 152 23.274 7.871 -10.328 1.00 3.80 H new ATOM 0 HH11 ARG A 152 23.405 10.763 -9.769 1.00 4.58 H new ATOM 0 HH12 ARG A 152 23.614 11.481 -11.370 1.00 4.58 H new ATOM 0 HH21 ARG A 152 22.513 8.628 -13.065 1.00 4.47 H new ATOM 0 HH22 ARG A 152 23.113 10.283 -13.220 1.00 4.47 H new ATOM 1491 N ALA A 153 19.262 9.020 -5.134 1.00 1.55 N ATOM 1492 CA ALA A 153 18.920 10.202 -4.285 1.00 2.12 C ATOM 1493 C ALA A 153 18.026 9.802 -3.104 1.00 1.65 C ATOM 1494 O ALA A 153 18.472 9.747 -1.973 1.00 2.29 O ATOM 1495 CB ALA A 153 18.175 11.154 -5.222 1.00 3.07 C ATOM 0 H ALA A 153 18.486 8.388 -5.333 1.00 1.55 H new ATOM 0 HA ALA A 153 19.810 10.656 -3.850 1.00 2.12 H new ATOM 0 HB1 ALA A 153 17.887 12.052 -4.675 1.00 3.07 H new ATOM 0 HB2 ALA A 153 18.824 11.428 -6.053 1.00 3.07 H new ATOM 0 HB3 ALA A 153 17.282 10.661 -5.606 1.00 3.07 H new ATOM 1501 N GLU A 154 16.765 9.548 -3.354 1.00 1.12 N ATOM 1502 CA GLU A 154 15.836 9.180 -2.239 1.00 1.03 C ATOM 1503 C GLU A 154 14.820 8.121 -2.711 1.00 0.81 C ATOM 1504 O GLU A 154 15.147 7.246 -3.494 1.00 0.83 O ATOM 1505 CB GLU A 154 15.150 10.507 -1.865 1.00 1.54 C ATOM 1506 CG GLU A 154 16.204 11.541 -1.454 1.00 2.31 C ATOM 1507 CD GLU A 154 15.553 12.614 -0.578 1.00 2.89 C ATOM 1508 OE1 GLU A 154 15.333 12.343 0.591 1.00 3.69 O ATOM 1509 OE2 GLU A 154 15.283 13.687 -1.092 1.00 2.94 O ATOM 0 H GLU A 154 16.339 9.579 -4.280 1.00 1.12 H new ATOM 0 HA GLU A 154 16.347 8.736 -1.385 1.00 1.03 H new ATOM 0 HB2 GLU A 154 14.573 10.880 -2.712 1.00 1.54 H new ATOM 0 HB3 GLU A 154 14.448 10.346 -1.047 1.00 1.54 H new ATOM 0 HG2 GLU A 154 17.013 11.054 -0.910 1.00 2.31 H new ATOM 0 HG3 GLU A 154 16.645 11.998 -2.340 1.00 2.31 H new ATOM 1516 N GLU A 155 13.604 8.176 -2.224 1.00 0.75 N ATOM 1517 CA GLU A 155 12.577 7.168 -2.631 1.00 0.66 C ATOM 1518 C GLU A 155 11.917 7.559 -3.954 1.00 0.60 C ATOM 1519 O GLU A 155 12.284 8.531 -4.586 1.00 0.90 O ATOM 1520 CB GLU A 155 11.528 7.160 -1.508 1.00 0.78 C ATOM 1521 CG GLU A 155 10.942 8.568 -1.313 1.00 1.26 C ATOM 1522 CD GLU A 155 11.472 9.177 -0.011 1.00 1.79 C ATOM 1523 OE1 GLU A 155 12.620 9.591 0.002 1.00 2.53 O ATOM 1524 OE2 GLU A 155 10.722 9.217 0.950 1.00 2.19 O ATOM 0 H GLU A 155 13.278 8.878 -1.560 1.00 0.75 H new ATOM 0 HA GLU A 155 13.030 6.188 -2.777 1.00 0.66 H new ATOM 0 HB2 GLU A 155 10.731 6.458 -1.751 1.00 0.78 H new ATOM 0 HB3 GLU A 155 11.983 6.816 -0.579 1.00 0.78 H new ATOM 0 HG2 GLU A 155 11.210 9.203 -2.157 1.00 1.26 H new ATOM 0 HG3 GLU A 155 9.854 8.518 -1.285 1.00 1.26 H new ATOM 1531 N TYR A 156 10.931 6.803 -4.360 1.00 0.49 N ATOM 1532 CA TYR A 156 10.211 7.106 -5.629 1.00 0.44 C ATOM 1533 C TYR A 156 8.706 7.175 -5.356 1.00 0.43 C ATOM 1534 O TYR A 156 8.253 6.856 -4.271 1.00 0.53 O ATOM 1535 CB TYR A 156 10.538 5.940 -6.561 1.00 0.56 C ATOM 1536 CG TYR A 156 11.972 6.046 -7.020 1.00 0.57 C ATOM 1537 CD1 TYR A 156 13.012 5.686 -6.154 1.00 1.08 C ATOM 1538 CD2 TYR A 156 12.263 6.504 -8.310 1.00 1.49 C ATOM 1539 CE1 TYR A 156 14.342 5.784 -6.579 1.00 1.03 C ATOM 1540 CE2 TYR A 156 13.593 6.602 -8.736 1.00 1.64 C ATOM 1541 CZ TYR A 156 14.633 6.242 -7.870 1.00 0.84 C ATOM 1542 OH TYR A 156 15.944 6.338 -8.289 1.00 1.04 O ATOM 0 H TYR A 156 10.592 5.981 -3.861 1.00 0.49 H new ATOM 0 HA TYR A 156 10.507 8.061 -6.064 1.00 0.44 H new ATOM 0 HB2 TYR A 156 10.380 4.993 -6.045 1.00 0.56 H new ATOM 0 HB3 TYR A 156 9.869 5.950 -7.421 1.00 0.56 H new ATOM 0 HD1 TYR A 156 12.788 5.333 -5.158 1.00 1.08 H new ATOM 0 HD2 TYR A 156 11.461 6.782 -8.978 1.00 1.49 H new ATOM 0 HE1 TYR A 156 15.144 5.506 -5.911 1.00 1.03 H new ATOM 0 HE2 TYR A 156 13.817 6.955 -9.732 1.00 1.64 H new ATOM 0 HH TYR A 156 16.425 5.519 -8.048 1.00 1.04 H new ATOM 1552 N GLU A 157 7.933 7.593 -6.326 1.00 0.44 N ATOM 1553 CA GLU A 157 6.458 7.694 -6.122 1.00 0.52 C ATOM 1554 C GLU A 157 5.702 6.863 -7.165 1.00 0.49 C ATOM 1555 O GLU A 157 5.456 7.311 -8.269 1.00 0.57 O ATOM 1556 CB GLU A 157 6.139 9.179 -6.290 1.00 0.59 C ATOM 1557 CG GLU A 157 6.235 9.879 -4.933 1.00 1.34 C ATOM 1558 CD GLU A 157 5.719 11.314 -5.060 1.00 1.70 C ATOM 1559 OE1 GLU A 157 6.429 12.130 -5.623 1.00 2.28 O ATOM 1560 OE2 GLU A 157 4.621 11.571 -4.593 1.00 2.16 O ATOM 0 H GLU A 157 8.261 7.869 -7.252 1.00 0.44 H new ATOM 0 HA GLU A 157 6.157 7.313 -5.146 1.00 0.52 H new ATOM 0 HB2 GLU A 157 6.835 9.634 -6.995 1.00 0.59 H new ATOM 0 HB3 GLU A 157 5.138 9.302 -6.705 1.00 0.59 H new ATOM 0 HG2 GLU A 157 5.651 9.336 -4.190 1.00 1.34 H new ATOM 0 HG3 GLU A 157 7.268 9.882 -4.586 1.00 1.34 H new ATOM 1567 N PHE A 158 5.319 5.664 -6.810 1.00 0.43 N ATOM 1568 CA PHE A 158 4.557 4.797 -7.763 1.00 0.43 C ATOM 1569 C PHE A 158 3.101 5.280 -7.819 1.00 0.44 C ATOM 1570 O PHE A 158 2.655 6.001 -6.947 1.00 0.52 O ATOM 1571 CB PHE A 158 4.663 3.386 -7.164 1.00 0.48 C ATOM 1572 CG PHE A 158 3.794 2.407 -7.925 1.00 0.50 C ATOM 1573 CD1 PHE A 158 4.001 2.193 -9.293 1.00 1.04 C ATOM 1574 CD2 PHE A 158 2.784 1.709 -7.253 1.00 1.54 C ATOM 1575 CE1 PHE A 158 3.195 1.281 -9.988 1.00 0.97 C ATOM 1576 CE2 PHE A 158 1.980 0.798 -7.947 1.00 1.64 C ATOM 1577 CZ PHE A 158 2.185 0.584 -9.314 1.00 0.65 C ATOM 0 H PHE A 158 5.501 5.245 -5.898 1.00 0.43 H new ATOM 0 HA PHE A 158 4.939 4.822 -8.784 1.00 0.43 H new ATOM 0 HB2 PHE A 158 5.701 3.053 -7.190 1.00 0.48 H new ATOM 0 HB3 PHE A 158 4.361 3.408 -6.117 1.00 0.48 H new ATOM 0 HD1 PHE A 158 4.781 2.730 -9.812 1.00 1.04 H new ATOM 0 HD2 PHE A 158 2.625 1.874 -6.198 1.00 1.54 H new ATOM 0 HE1 PHE A 158 3.353 1.116 -11.044 1.00 0.97 H new ATOM 0 HE2 PHE A 158 1.201 0.260 -7.427 1.00 1.64 H new ATOM 0 HZ PHE A 158 1.564 -0.119 -9.850 1.00 0.65 H new ATOM 1587 N LEU A 159 2.365 4.903 -8.835 1.00 0.44 N ATOM 1588 CA LEU A 159 0.943 5.359 -8.938 1.00 0.48 C ATOM 1589 C LEU A 159 0.082 4.306 -9.643 1.00 0.46 C ATOM 1590 O LEU A 159 0.365 3.902 -10.755 1.00 0.54 O ATOM 1591 CB LEU A 159 1.000 6.646 -9.770 1.00 0.55 C ATOM 1592 CG LEU A 159 0.768 7.860 -8.867 1.00 0.87 C ATOM 1593 CD1 LEU A 159 1.258 9.124 -9.575 1.00 1.75 C ATOM 1594 CD2 LEU A 159 -0.727 7.992 -8.565 1.00 0.94 C ATOM 0 H LEU A 159 2.685 4.302 -9.595 1.00 0.44 H new ATOM 0 HA LEU A 159 0.496 5.519 -7.957 1.00 0.48 H new ATOM 0 HB2 LEU A 159 1.969 6.728 -10.263 1.00 0.55 H new ATOM 0 HB3 LEU A 159 0.244 6.616 -10.555 1.00 0.55 H new ATOM 0 HG LEU A 159 1.318 7.730 -7.935 1.00 0.87 H new ATOM 0 HD11 LEU A 159 1.093 9.988 -8.932 1.00 1.75 H new ATOM 0 HD12 LEU A 159 2.322 9.031 -9.791 1.00 1.75 H new ATOM 0 HD13 LEU A 159 0.709 9.255 -10.507 1.00 1.75 H new ATOM 0 HD21 LEU A 159 -0.893 8.856 -7.922 1.00 0.94 H new ATOM 0 HD22 LEU A 159 -1.276 8.122 -9.497 1.00 0.94 H new ATOM 0 HD23 LEU A 159 -1.077 7.092 -8.060 1.00 0.94 H new ATOM 1606 N THR A 160 -0.978 3.873 -9.005 1.00 0.47 N ATOM 1607 CA THR A 160 -1.879 2.859 -9.636 1.00 0.48 C ATOM 1608 C THR A 160 -3.134 3.559 -10.173 1.00 0.42 C ATOM 1609 O THR A 160 -3.525 4.587 -9.651 1.00 0.39 O ATOM 1610 CB THR A 160 -2.266 1.878 -8.523 1.00 0.55 C ATOM 1611 OG1 THR A 160 -3.084 2.547 -7.577 1.00 0.59 O ATOM 1612 CG2 THR A 160 -1.012 1.334 -7.830 1.00 0.61 C ATOM 0 H THR A 160 -1.258 4.179 -8.073 1.00 0.47 H new ATOM 0 HA THR A 160 -1.392 2.345 -10.465 1.00 0.48 H new ATOM 0 HB THR A 160 -2.812 1.041 -8.958 1.00 0.55 H new ATOM 0 HG1 THR A 160 -3.636 1.892 -7.101 1.00 0.59 H new ATOM 0 HG21 THR A 160 -1.304 0.639 -7.043 1.00 0.61 H new ATOM 0 HG22 THR A 160 -0.389 0.815 -8.559 1.00 0.61 H new ATOM 0 HG23 THR A 160 -0.450 2.160 -7.395 1.00 0.61 H new ATOM 1620 N PRO A 161 -3.735 2.987 -11.195 1.00 0.43 N ATOM 1621 CA PRO A 161 -4.955 3.594 -11.787 1.00 0.42 C ATOM 1622 C PRO A 161 -6.125 3.522 -10.803 1.00 0.41 C ATOM 1623 O PRO A 161 -6.051 2.862 -9.783 1.00 0.38 O ATOM 1624 CB PRO A 161 -5.221 2.740 -13.025 1.00 0.47 C ATOM 1625 CG PRO A 161 -4.564 1.431 -12.732 1.00 0.48 C ATOM 1626 CD PRO A 161 -3.359 1.741 -11.887 1.00 0.48 C ATOM 0 HA PRO A 161 -4.833 4.650 -12.027 1.00 0.42 H new ATOM 0 HB2 PRO A 161 -6.290 2.616 -13.198 1.00 0.47 H new ATOM 0 HB3 PRO A 161 -4.804 3.201 -13.921 1.00 0.47 H new ATOM 0 HG2 PRO A 161 -5.246 0.763 -12.206 1.00 0.48 H new ATOM 0 HG3 PRO A 161 -4.273 0.927 -13.654 1.00 0.48 H new ATOM 0 HD2 PRO A 161 -3.147 0.938 -11.181 1.00 0.48 H new ATOM 0 HD3 PRO A 161 -2.465 1.874 -12.496 1.00 0.48 H new ATOM 1634 N MET A 162 -7.200 4.206 -11.102 1.00 0.59 N ATOM 1635 CA MET A 162 -8.385 4.196 -10.187 1.00 0.65 C ATOM 1636 C MET A 162 -8.891 2.766 -9.967 1.00 0.58 C ATOM 1637 O MET A 162 -9.366 2.117 -10.880 1.00 0.91 O ATOM 1638 CB MET A 162 -9.452 5.046 -10.891 1.00 0.97 C ATOM 1639 CG MET A 162 -9.785 4.448 -12.263 1.00 1.60 C ATOM 1640 SD MET A 162 -10.302 5.768 -13.387 1.00 2.12 S ATOM 1641 CE MET A 162 -11.189 4.725 -14.570 1.00 2.79 C ATOM 0 H MET A 162 -7.310 4.773 -11.943 1.00 0.59 H new ATOM 0 HA MET A 162 -8.137 4.592 -9.202 1.00 0.65 H new ATOM 0 HB2 MET A 162 -10.352 5.093 -10.278 1.00 0.97 H new ATOM 0 HB3 MET A 162 -9.093 6.068 -11.009 1.00 0.97 H new ATOM 0 HG2 MET A 162 -8.914 3.932 -12.667 1.00 1.60 H new ATOM 0 HG3 MET A 162 -10.578 3.707 -12.166 1.00 1.60 H new ATOM 0 HE1 MET A 162 -10.816 4.918 -15.576 1.00 2.79 H new ATOM 0 HE2 MET A 162 -11.032 3.676 -14.320 1.00 2.79 H new ATOM 0 HE3 MET A 162 -12.254 4.952 -14.528 1.00 2.79 H new ATOM 1651 N GLU A 163 -8.797 2.279 -8.756 1.00 0.55 N ATOM 1652 CA GLU A 163 -9.275 0.898 -8.456 1.00 0.58 C ATOM 1653 C GLU A 163 -10.599 0.962 -7.691 1.00 0.59 C ATOM 1654 O GLU A 163 -10.642 1.361 -6.543 1.00 0.86 O ATOM 1655 CB GLU A 163 -8.181 0.279 -7.585 1.00 0.67 C ATOM 1656 CG GLU A 163 -8.161 -1.237 -7.789 1.00 1.14 C ATOM 1657 CD GLU A 163 -7.277 -1.885 -6.721 1.00 1.42 C ATOM 1658 OE1 GLU A 163 -6.168 -1.414 -6.533 1.00 2.00 O ATOM 1659 OE2 GLU A 163 -7.725 -2.841 -6.110 1.00 2.00 O ATOM 0 H GLU A 163 -8.407 2.782 -7.959 1.00 0.55 H new ATOM 0 HA GLU A 163 -9.452 0.313 -9.359 1.00 0.58 H new ATOM 0 HB2 GLU A 163 -7.211 0.704 -7.844 1.00 0.67 H new ATOM 0 HB3 GLU A 163 -8.361 0.513 -6.536 1.00 0.67 H new ATOM 0 HG2 GLU A 163 -9.174 -1.636 -7.729 1.00 1.14 H new ATOM 0 HG3 GLU A 163 -7.783 -1.476 -8.783 1.00 1.14 H new ATOM 1666 N GLU A 164 -11.678 0.578 -8.324 1.00 0.53 N ATOM 1667 CA GLU A 164 -13.008 0.621 -7.642 1.00 0.54 C ATOM 1668 C GLU A 164 -13.050 -0.381 -6.485 1.00 0.52 C ATOM 1669 O GLU A 164 -12.732 -1.544 -6.644 1.00 0.59 O ATOM 1670 CB GLU A 164 -14.034 0.251 -8.721 1.00 0.62 C ATOM 1671 CG GLU A 164 -13.720 -1.140 -9.290 1.00 1.42 C ATOM 1672 CD GLU A 164 -13.918 -1.133 -10.808 1.00 1.85 C ATOM 1673 OE1 GLU A 164 -15.034 -1.371 -11.241 1.00 2.47 O ATOM 1674 OE2 GLU A 164 -12.951 -0.890 -11.511 1.00 2.17 O ATOM 0 H GLU A 164 -11.696 0.236 -9.285 1.00 0.53 H new ATOM 0 HA GLU A 164 -13.213 1.602 -7.213 1.00 0.54 H new ATOM 0 HB2 GLU A 164 -15.039 0.262 -8.298 1.00 0.62 H new ATOM 0 HB3 GLU A 164 -14.017 0.992 -9.520 1.00 0.62 H new ATOM 0 HG2 GLU A 164 -12.694 -1.419 -9.049 1.00 1.42 H new ATOM 0 HG3 GLU A 164 -14.370 -1.886 -8.832 1.00 1.42 H new ATOM 1681 N ALA A 165 -13.444 0.072 -5.324 1.00 0.54 N ATOM 1682 CA ALA A 165 -13.519 -0.836 -4.139 1.00 0.56 C ATOM 1683 C ALA A 165 -14.778 -1.716 -4.234 1.00 0.54 C ATOM 1684 O ALA A 165 -15.500 -1.638 -5.208 1.00 0.53 O ATOM 1685 CB ALA A 165 -13.601 0.104 -2.934 1.00 0.61 C ATOM 0 H ALA A 165 -13.719 1.038 -5.144 1.00 0.54 H new ATOM 0 HA ALA A 165 -12.666 -1.511 -4.069 1.00 0.56 H new ATOM 0 HB1 ALA A 165 -13.659 -0.483 -2.018 1.00 0.61 H new ATOM 0 HB2 ALA A 165 -12.713 0.736 -2.904 1.00 0.61 H new ATOM 0 HB3 ALA A 165 -14.489 0.730 -3.021 1.00 0.61 H new ATOM 1691 N PRO A 166 -15.016 -2.528 -3.223 1.00 0.58 N ATOM 1692 CA PRO A 166 -16.214 -3.403 -3.239 1.00 0.61 C ATOM 1693 C PRO A 166 -17.473 -2.584 -2.935 1.00 0.60 C ATOM 1694 O PRO A 166 -17.544 -1.887 -1.940 1.00 0.84 O ATOM 1695 CB PRO A 166 -15.940 -4.415 -2.131 1.00 0.69 C ATOM 1696 CG PRO A 166 -14.993 -3.730 -1.196 1.00 0.70 C ATOM 1697 CD PRO A 166 -14.219 -2.713 -1.997 1.00 0.64 C ATOM 0 HA PRO A 166 -16.385 -3.879 -4.205 1.00 0.61 H new ATOM 0 HB2 PRO A 166 -16.861 -4.698 -1.621 1.00 0.69 H new ATOM 0 HB3 PRO A 166 -15.504 -5.330 -2.533 1.00 0.69 H new ATOM 0 HG2 PRO A 166 -15.538 -3.245 -0.386 1.00 0.70 H new ATOM 0 HG3 PRO A 166 -14.317 -4.452 -0.738 1.00 0.70 H new ATOM 0 HD2 PRO A 166 -14.109 -1.777 -1.450 1.00 0.64 H new ATOM 0 HD3 PRO A 166 -13.214 -3.069 -2.226 1.00 0.64 H new ATOM 1705 N LYS A 167 -18.463 -2.661 -3.789 1.00 0.67 N ATOM 1706 CA LYS A 167 -19.722 -1.885 -3.561 1.00 0.70 C ATOM 1707 C LYS A 167 -20.880 -2.831 -3.230 1.00 0.97 C ATOM 1708 O LYS A 167 -20.748 -4.038 -3.306 1.00 1.42 O ATOM 1709 CB LYS A 167 -19.989 -1.145 -4.878 1.00 1.32 C ATOM 1710 CG LYS A 167 -20.101 -2.147 -6.033 1.00 1.24 C ATOM 1711 CD LYS A 167 -20.871 -1.507 -7.190 1.00 1.79 C ATOM 1712 CE LYS A 167 -19.886 -0.857 -8.163 1.00 1.99 C ATOM 1713 NZ LYS A 167 -20.690 -0.553 -9.379 1.00 2.29 N ATOM 0 H LYS A 167 -18.454 -3.229 -4.636 1.00 0.67 H new ATOM 0 HA LYS A 167 -19.628 -1.195 -2.722 1.00 0.70 H new ATOM 0 HB2 LYS A 167 -20.909 -0.566 -4.798 1.00 1.32 H new ATOM 0 HB3 LYS A 167 -19.183 -0.438 -5.077 1.00 1.32 H new ATOM 0 HG2 LYS A 167 -19.107 -2.448 -6.365 1.00 1.24 H new ATOM 0 HG3 LYS A 167 -20.612 -3.050 -5.697 1.00 1.24 H new ATOM 0 HD2 LYS A 167 -21.464 -2.261 -7.707 1.00 1.79 H new ATOM 0 HD3 LYS A 167 -21.567 -0.760 -6.808 1.00 1.79 H new ATOM 0 HE2 LYS A 167 -19.453 0.049 -7.740 1.00 1.99 H new ATOM 0 HE3 LYS A 167 -19.059 -1.528 -8.394 1.00 1.99 H new ATOM 0 HZ1 LYS A 167 -20.082 -0.104 -10.094 1.00 2.29 H new ATOM 0 HZ2 LYS A 167 -21.084 -1.435 -9.764 1.00 2.29 H new ATOM 0 HZ3 LYS A 167 -21.466 0.093 -9.130 1.00 2.29 H new ATOM 1727 N GLY A 168 -22.012 -2.286 -2.862 1.00 1.04 N ATOM 1728 CA GLY A 168 -23.187 -3.142 -2.523 1.00 1.66 C ATOM 1729 C GLY A 168 -23.642 -2.839 -1.094 1.00 1.31 C ATOM 1730 O GLY A 168 -22.875 -2.361 -0.279 1.00 1.70 O ATOM 0 H GLY A 168 -22.172 -1.282 -2.782 1.00 1.04 H new ATOM 0 HA2 GLY A 168 -24.001 -2.955 -3.223 1.00 1.66 H new ATOM 0 HA3 GLY A 168 -22.922 -4.195 -2.616 1.00 1.66 H new ATOM 1734 N MET A 169 -24.884 -3.116 -0.786 1.00 1.03 N ATOM 1735 CA MET A 169 -25.398 -2.847 0.594 1.00 0.86 C ATOM 1736 C MET A 169 -24.596 -3.652 1.621 1.00 0.88 C ATOM 1737 O MET A 169 -24.281 -3.169 2.691 1.00 1.58 O ATOM 1738 CB MET A 169 -26.858 -3.303 0.577 1.00 1.02 C ATOM 1739 CG MET A 169 -27.518 -2.956 1.913 1.00 1.71 C ATOM 1740 SD MET A 169 -29.316 -3.089 1.749 1.00 2.37 S ATOM 1741 CE MET A 169 -29.728 -1.475 2.456 1.00 2.85 C ATOM 0 H MET A 169 -25.566 -3.517 -1.430 1.00 1.03 H new ATOM 0 HA MET A 169 -25.306 -1.796 0.869 1.00 0.86 H new ATOM 0 HB2 MET A 169 -27.392 -2.819 -0.241 1.00 1.02 H new ATOM 0 HB3 MET A 169 -26.912 -4.377 0.401 1.00 1.02 H new ATOM 0 HG2 MET A 169 -27.162 -3.630 2.693 1.00 1.71 H new ATOM 0 HG3 MET A 169 -27.243 -1.945 2.215 1.00 1.71 H new ATOM 0 HE1 MET A 169 -30.810 -1.342 2.454 1.00 2.85 H new ATOM 0 HE2 MET A 169 -29.358 -1.421 3.480 1.00 2.85 H new ATOM 0 HE3 MET A 169 -29.265 -0.688 1.861 1.00 2.85 H new ATOM 1751 N LEU A 170 -24.264 -4.875 1.295 1.00 0.72 N ATOM 1752 CA LEU A 170 -23.477 -5.721 2.241 1.00 0.78 C ATOM 1753 C LEU A 170 -21.983 -5.397 2.127 1.00 0.74 C ATOM 1754 O LEU A 170 -21.225 -5.598 3.057 1.00 0.99 O ATOM 1755 CB LEU A 170 -23.748 -7.162 1.804 1.00 0.95 C ATOM 1756 CG LEU A 170 -23.562 -8.102 2.996 1.00 1.60 C ATOM 1757 CD1 LEU A 170 -24.109 -9.487 2.645 1.00 2.09 C ATOM 1758 CD2 LEU A 170 -22.072 -8.213 3.331 1.00 2.55 C ATOM 0 H LEU A 170 -24.505 -5.325 0.412 1.00 0.72 H new ATOM 0 HA LEU A 170 -23.760 -5.550 3.280 1.00 0.78 H new ATOM 0 HB2 LEU A 170 -24.762 -7.250 1.413 1.00 0.95 H new ATOM 0 HB3 LEU A 170 -23.070 -7.442 0.998 1.00 0.95 H new ATOM 0 HG LEU A 170 -24.100 -7.706 3.857 1.00 1.60 H new ATOM 0 HD11 LEU A 170 -23.976 -10.157 3.495 1.00 2.09 H new ATOM 0 HD12 LEU A 170 -25.170 -9.409 2.406 1.00 2.09 H new ATOM 0 HD13 LEU A 170 -23.571 -9.883 1.784 1.00 2.09 H new ATOM 0 HD21 LEU A 170 -21.939 -8.883 4.181 1.00 2.55 H new ATOM 0 HD22 LEU A 170 -21.534 -8.608 2.469 1.00 2.55 H new ATOM 0 HD23 LEU A 170 -21.681 -7.227 3.582 1.00 2.55 H new ATOM 1770 N ALA A 171 -21.558 -4.897 0.992 1.00 0.68 N ATOM 1771 CA ALA A 171 -20.111 -4.558 0.810 1.00 0.70 C ATOM 1772 C ALA A 171 -19.658 -3.533 1.857 1.00 0.63 C ATOM 1773 O ALA A 171 -18.484 -3.426 2.156 1.00 0.72 O ATOM 1774 CB ALA A 171 -20.008 -3.963 -0.596 1.00 0.77 C ATOM 0 H ALA A 171 -22.151 -4.709 0.183 1.00 0.68 H new ATOM 0 HA ALA A 171 -19.474 -5.434 0.931 1.00 0.70 H new ATOM 0 HB1 ALA A 171 -18.973 -3.690 -0.801 1.00 0.77 H new ATOM 0 HB2 ALA A 171 -20.341 -4.699 -1.328 1.00 0.77 H new ATOM 0 HB3 ALA A 171 -20.637 -3.075 -0.662 1.00 0.77 H new ATOM 1780 N ARG A 172 -20.576 -2.781 2.415 1.00 0.64 N ATOM 1781 CA ARG A 172 -20.191 -1.764 3.444 1.00 0.60 C ATOM 1782 C ARG A 172 -19.629 -2.462 4.686 1.00 0.54 C ATOM 1783 O ARG A 172 -20.259 -3.336 5.252 1.00 0.67 O ATOM 1784 CB ARG A 172 -21.486 -1.025 3.789 1.00 0.64 C ATOM 1785 CG ARG A 172 -21.780 0.022 2.713 1.00 0.76 C ATOM 1786 CD ARG A 172 -23.261 0.403 2.765 1.00 0.78 C ATOM 1787 NE ARG A 172 -23.356 1.431 3.839 1.00 1.24 N ATOM 1788 CZ ARG A 172 -24.231 1.294 4.797 1.00 1.59 C ATOM 1789 NH1 ARG A 172 -25.483 1.063 4.510 1.00 2.06 N ATOM 1790 NH2 ARG A 172 -23.854 1.387 6.043 1.00 2.30 N ATOM 0 H ARG A 172 -21.573 -2.827 2.203 1.00 0.64 H new ATOM 0 HA ARG A 172 -19.422 -1.083 3.079 1.00 0.60 H new ATOM 0 HB2 ARG A 172 -22.313 -1.732 3.859 1.00 0.64 H new ATOM 0 HB3 ARG A 172 -21.394 -0.545 4.763 1.00 0.64 H new ATOM 0 HG2 ARG A 172 -21.160 0.905 2.870 1.00 0.76 H new ATOM 0 HG3 ARG A 172 -21.529 -0.372 1.728 1.00 0.76 H new ATOM 0 HD2 ARG A 172 -23.601 0.799 1.808 1.00 0.78 H new ATOM 0 HD3 ARG A 172 -23.884 -0.463 2.991 1.00 0.78 H new ATOM 0 HE ARG A 172 -22.737 2.242 3.825 1.00 1.24 H new ATOM 0 HH11 ARG A 172 -25.778 0.989 3.536 1.00 2.06 H new ATOM 0 HH12 ARG A 172 -26.167 0.956 5.259 1.00 2.06 H new ATOM 0 HH21 ARG A 172 -22.875 1.567 6.268 1.00 2.30 H new ATOM 0 HH22 ARG A 172 -24.538 1.280 6.792 1.00 2.30 H new ATOM 1804 N GLY A 173 -18.450 -2.083 5.111 1.00 0.47 N ATOM 1805 CA GLY A 173 -17.843 -2.724 6.316 1.00 0.47 C ATOM 1806 C GLY A 173 -16.317 -2.643 6.231 1.00 0.40 C ATOM 1807 O GLY A 173 -15.769 -2.091 5.296 1.00 0.37 O ATOM 0 H GLY A 173 -17.882 -1.357 4.675 1.00 0.47 H new ATOM 0 HA2 GLY A 173 -18.193 -2.226 7.220 1.00 0.47 H new ATOM 0 HA3 GLY A 173 -18.158 -3.765 6.383 1.00 0.47 H new ATOM 1811 N SER A 174 -15.631 -3.189 7.204 1.00 0.41 N ATOM 1812 CA SER A 174 -14.137 -3.149 7.194 1.00 0.36 C ATOM 1813 C SER A 174 -13.573 -4.309 6.368 1.00 0.34 C ATOM 1814 O SER A 174 -14.038 -5.429 6.458 1.00 0.42 O ATOM 1815 CB SER A 174 -13.731 -3.291 8.660 1.00 0.38 C ATOM 1816 OG SER A 174 -14.512 -4.312 9.266 1.00 0.48 O ATOM 0 H SER A 174 -16.044 -3.662 8.008 1.00 0.41 H new ATOM 0 HA SER A 174 -13.754 -2.231 6.747 1.00 0.36 H new ATOM 0 HB2 SER A 174 -12.671 -3.535 8.734 1.00 0.38 H new ATOM 0 HB3 SER A 174 -13.877 -2.346 9.183 1.00 0.38 H new ATOM 0 HG SER A 174 -14.658 -5.037 8.623 1.00 0.48 H new ATOM 1822 N TYR A 175 -12.572 -4.043 5.567 1.00 0.31 N ATOM 1823 CA TYR A 175 -11.966 -5.124 4.731 1.00 0.32 C ATOM 1824 C TYR A 175 -10.464 -5.230 5.002 1.00 0.29 C ATOM 1825 O TYR A 175 -9.688 -4.424 4.529 1.00 0.32 O ATOM 1826 CB TYR A 175 -12.205 -4.695 3.283 1.00 0.33 C ATOM 1827 CG TYR A 175 -13.616 -5.041 2.880 1.00 0.38 C ATOM 1828 CD1 TYR A 175 -14.692 -4.336 3.430 1.00 0.43 C ATOM 1829 CD2 TYR A 175 -13.849 -6.068 1.958 1.00 0.45 C ATOM 1830 CE1 TYR A 175 -16.001 -4.656 3.057 1.00 0.50 C ATOM 1831 CE2 TYR A 175 -15.158 -6.390 1.585 1.00 0.52 C ATOM 1832 CZ TYR A 175 -16.236 -5.684 2.135 1.00 0.52 C ATOM 1833 OH TYR A 175 -17.528 -6.000 1.767 1.00 0.60 O ATOM 0 H TYR A 175 -12.148 -3.122 5.456 1.00 0.31 H new ATOM 0 HA TYR A 175 -12.404 -6.098 4.951 1.00 0.32 H new ATOM 0 HB2 TYR A 175 -12.039 -3.623 3.178 1.00 0.33 H new ATOM 0 HB3 TYR A 175 -11.495 -5.194 2.623 1.00 0.33 H new ATOM 0 HD1 TYR A 175 -14.512 -3.545 4.143 1.00 0.43 H new ATOM 0 HD2 TYR A 175 -13.018 -6.612 1.534 1.00 0.45 H new ATOM 0 HE1 TYR A 175 -16.831 -4.110 3.480 1.00 0.50 H new ATOM 0 HE2 TYR A 175 -15.338 -7.182 0.873 1.00 0.52 H new ATOM 0 HH TYR A 175 -17.513 -6.735 1.119 1.00 0.60 H new ATOM 1843 N ASN A 176 -10.050 -6.225 5.747 1.00 0.32 N ATOM 1844 CA ASN A 176 -8.592 -6.390 6.034 1.00 0.35 C ATOM 1845 C ASN A 176 -7.856 -6.729 4.737 1.00 0.39 C ATOM 1846 O ASN A 176 -8.266 -7.605 4.001 1.00 0.56 O ATOM 1847 CB ASN A 176 -8.504 -7.555 7.023 1.00 0.49 C ATOM 1848 CG ASN A 176 -7.244 -7.406 7.879 1.00 0.60 C ATOM 1849 OD1 ASN A 176 -7.303 -6.907 8.985 1.00 1.52 O ATOM 1850 ND2 ASN A 176 -6.099 -7.821 7.410 1.00 1.18 N ATOM 0 H ASN A 176 -10.657 -6.928 6.168 1.00 0.32 H new ATOM 0 HA ASN A 176 -8.140 -5.486 6.442 1.00 0.35 H new ATOM 0 HB2 ASN A 176 -9.389 -7.573 7.660 1.00 0.49 H new ATOM 0 HB3 ASN A 176 -8.480 -8.502 6.484 1.00 0.49 H new ATOM 0 HD21 ASN A 176 -5.253 -7.726 7.972 1.00 1.18 H new ATOM 0 HD22 ASN A 176 -6.050 -8.240 6.481 1.00 1.18 H new ATOM 1857 N ILE A 177 -6.791 -6.030 4.437 1.00 0.38 N ATOM 1858 CA ILE A 177 -6.048 -6.306 3.168 1.00 0.48 C ATOM 1859 C ILE A 177 -4.611 -6.748 3.464 1.00 0.44 C ATOM 1860 O ILE A 177 -4.020 -6.355 4.452 1.00 0.65 O ATOM 1861 CB ILE A 177 -6.055 -4.982 2.391 1.00 0.61 C ATOM 1862 CG1 ILE A 177 -7.502 -4.466 2.271 1.00 0.68 C ATOM 1863 CG2 ILE A 177 -5.465 -5.224 0.999 1.00 0.80 C ATOM 1864 CD1 ILE A 177 -7.561 -3.204 1.402 1.00 0.52 C ATOM 0 H ILE A 177 -6.404 -5.282 5.013 1.00 0.38 H new ATOM 0 HA ILE A 177 -6.512 -7.112 2.599 1.00 0.48 H new ATOM 0 HB ILE A 177 -5.457 -4.236 2.914 1.00 0.61 H new ATOM 0 HG12 ILE A 177 -8.134 -5.241 1.838 1.00 0.68 H new ATOM 0 HG13 ILE A 177 -7.899 -4.249 3.263 1.00 0.68 H new ATOM 0 HG21 ILE A 177 -5.464 -4.290 0.437 1.00 0.80 H new ATOM 0 HG22 ILE A 177 -4.443 -5.590 1.096 1.00 0.80 H new ATOM 0 HG23 ILE A 177 -6.067 -5.964 0.472 1.00 0.80 H new ATOM 0 HD11 ILE A 177 -8.592 -2.858 1.332 1.00 0.52 H new ATOM 0 HD12 ILE A 177 -6.947 -2.424 1.851 1.00 0.52 H new ATOM 0 HD13 ILE A 177 -7.186 -3.431 0.404 1.00 0.52 H new ATOM 1876 N LYS A 178 -4.048 -7.563 2.605 1.00 0.32 N ATOM 1877 CA LYS A 178 -2.648 -8.041 2.817 1.00 0.32 C ATOM 1878 C LYS A 178 -1.758 -7.598 1.657 1.00 0.29 C ATOM 1879 O LYS A 178 -1.818 -8.151 0.579 1.00 0.36 O ATOM 1880 CB LYS A 178 -2.750 -9.568 2.868 1.00 0.38 C ATOM 1881 CG LYS A 178 -1.871 -10.106 4.000 1.00 0.50 C ATOM 1882 CD LYS A 178 -2.071 -11.617 4.129 1.00 1.23 C ATOM 1883 CE LYS A 178 -0.799 -12.255 4.691 1.00 1.90 C ATOM 1884 NZ LYS A 178 -1.272 -13.428 5.477 1.00 2.44 N ATOM 0 H LYS A 178 -4.501 -7.918 1.763 1.00 0.32 H new ATOM 0 HA LYS A 178 -2.207 -7.635 3.727 1.00 0.32 H new ATOM 0 HB2 LYS A 178 -3.786 -9.868 3.025 1.00 0.38 H new ATOM 0 HB3 LYS A 178 -2.435 -9.995 1.916 1.00 0.38 H new ATOM 0 HG2 LYS A 178 -0.823 -9.883 3.798 1.00 0.50 H new ATOM 0 HG3 LYS A 178 -2.126 -9.613 4.938 1.00 0.50 H new ATOM 0 HD2 LYS A 178 -2.916 -11.828 4.784 1.00 1.23 H new ATOM 0 HD3 LYS A 178 -2.307 -12.048 3.156 1.00 1.23 H new ATOM 0 HE2 LYS A 178 -0.125 -12.562 3.891 1.00 1.90 H new ATOM 0 HE3 LYS A 178 -0.250 -11.554 5.320 1.00 1.90 H new ATOM 0 HZ1 LYS A 178 -0.455 -13.918 5.895 1.00 2.44 H new ATOM 0 HZ2 LYS A 178 -1.907 -13.105 6.235 1.00 2.44 H new ATOM 0 HZ3 LYS A 178 -1.785 -14.081 4.851 1.00 2.44 H new ATOM 1898 N SER A 179 -0.933 -6.605 1.873 1.00 0.29 N ATOM 1899 CA SER A 179 -0.035 -6.124 0.780 1.00 0.33 C ATOM 1900 C SER A 179 1.397 -6.608 1.022 1.00 0.35 C ATOM 1901 O SER A 179 1.977 -6.361 2.063 1.00 0.48 O ATOM 1902 CB SER A 179 -0.105 -4.597 0.841 1.00 0.44 C ATOM 1903 OG SER A 179 -1.443 -4.194 1.105 1.00 1.35 O ATOM 0 H SER A 179 -0.843 -6.107 2.759 1.00 0.29 H new ATOM 0 HA SER A 179 -0.338 -6.502 -0.196 1.00 0.33 H new ATOM 0 HB2 SER A 179 0.559 -4.223 1.620 1.00 0.44 H new ATOM 0 HB3 SER A 179 0.236 -4.169 -0.102 1.00 0.44 H new ATOM 0 HG SER A 179 -1.659 -3.404 0.567 1.00 1.35 H new ATOM 1909 N ARG A 180 1.967 -7.294 0.065 1.00 0.34 N ATOM 1910 CA ARG A 180 3.363 -7.800 0.225 1.00 0.38 C ATOM 1911 C ARG A 180 4.291 -7.105 -0.770 1.00 0.37 C ATOM 1912 O ARG A 180 4.239 -7.353 -1.960 1.00 0.40 O ATOM 1913 CB ARG A 180 3.279 -9.298 -0.072 1.00 0.45 C ATOM 1914 CG ARG A 180 4.552 -9.989 0.420 1.00 0.99 C ATOM 1915 CD ARG A 180 4.710 -11.334 -0.293 1.00 1.13 C ATOM 1916 NE ARG A 180 3.628 -12.193 0.264 1.00 1.71 N ATOM 1917 CZ ARG A 180 3.896 -13.410 0.653 1.00 1.96 C ATOM 1918 NH1 ARG A 180 4.655 -14.177 -0.080 1.00 2.44 N ATOM 1919 NH2 ARG A 180 3.405 -13.858 1.776 1.00 2.46 N ATOM 0 H ARG A 180 1.524 -7.526 -0.824 1.00 0.34 H new ATOM 0 HA ARG A 180 3.762 -7.606 1.220 1.00 0.38 H new ATOM 0 HB2 ARG A 180 2.406 -9.728 0.419 1.00 0.45 H new ATOM 0 HB3 ARG A 180 3.155 -9.461 -1.143 1.00 0.45 H new ATOM 0 HG2 ARG A 180 5.419 -9.358 0.226 1.00 0.99 H new ATOM 0 HG3 ARG A 180 4.503 -10.140 1.498 1.00 0.99 H new ATOM 0 HD2 ARG A 180 4.610 -11.223 -1.373 1.00 1.13 H new ATOM 0 HD3 ARG A 180 5.693 -11.767 -0.107 1.00 1.13 H new ATOM 0 HE ARG A 180 2.678 -11.830 0.341 1.00 1.71 H new ATOM 0 HH11 ARG A 180 5.039 -13.826 -0.957 1.00 2.44 H new ATOM 0 HH12 ARG A 180 4.864 -15.128 0.224 1.00 2.44 H new ATOM 0 HH21 ARG A 180 2.812 -13.257 2.349 1.00 2.46 H new ATOM 0 HH22 ARG A 180 3.614 -14.809 2.081 1.00 2.46 H new ATOM 1933 N PHE A 181 5.139 -6.237 -0.286 1.00 0.46 N ATOM 1934 CA PHE A 181 6.082 -5.516 -1.190 1.00 0.50 C ATOM 1935 C PHE A 181 7.283 -6.407 -1.511 1.00 0.52 C ATOM 1936 O PHE A 181 8.162 -6.594 -0.692 1.00 0.87 O ATOM 1937 CB PHE A 181 6.524 -4.284 -0.396 1.00 0.65 C ATOM 1938 CG PHE A 181 6.730 -3.112 -1.328 1.00 0.71 C ATOM 1939 CD1 PHE A 181 5.723 -2.737 -2.228 1.00 1.47 C ATOM 1940 CD2 PHE A 181 7.930 -2.393 -1.284 1.00 1.23 C ATOM 1941 CE1 PHE A 181 5.918 -1.646 -3.083 1.00 1.58 C ATOM 1942 CE2 PHE A 181 8.124 -1.302 -2.137 1.00 1.26 C ATOM 1943 CZ PHE A 181 7.119 -0.927 -3.038 1.00 0.96 C ATOM 0 H PHE A 181 5.219 -5.995 0.702 1.00 0.46 H new ATOM 0 HA PHE A 181 5.623 -5.245 -2.141 1.00 0.50 H new ATOM 0 HB2 PHE A 181 5.772 -4.035 0.353 1.00 0.65 H new ATOM 0 HB3 PHE A 181 7.448 -4.499 0.140 1.00 0.65 H new ATOM 0 HD1 PHE A 181 4.796 -3.290 -2.262 1.00 1.47 H new ATOM 0 HD2 PHE A 181 8.707 -2.681 -0.591 1.00 1.23 H new ATOM 0 HE1 PHE A 181 5.142 -1.359 -3.777 1.00 1.58 H new ATOM 0 HE2 PHE A 181 9.050 -0.748 -2.101 1.00 1.26 H new ATOM 0 HZ PHE A 181 7.270 -0.085 -3.697 1.00 0.96 H new ATOM 1953 N THR A 182 7.322 -6.958 -2.696 1.00 0.37 N ATOM 1954 CA THR A 182 8.465 -7.840 -3.078 1.00 0.40 C ATOM 1955 C THR A 182 9.023 -7.427 -4.437 1.00 0.34 C ATOM 1956 O THR A 182 8.645 -6.414 -4.995 1.00 0.47 O ATOM 1957 CB THR A 182 7.889 -9.259 -3.147 1.00 0.52 C ATOM 1958 OG1 THR A 182 8.903 -10.156 -3.579 1.00 1.17 O ATOM 1959 CG2 THR A 182 6.715 -9.307 -4.132 1.00 1.02 C ATOM 0 H THR A 182 6.611 -6.835 -3.417 1.00 0.37 H new ATOM 0 HA THR A 182 9.283 -7.772 -2.361 1.00 0.40 H new ATOM 0 HB THR A 182 7.534 -9.548 -2.158 1.00 0.52 H new ATOM 0 HG1 THR A 182 9.614 -10.194 -2.906 1.00 1.17 H new ATOM 0 HG21 THR A 182 6.315 -10.320 -4.172 1.00 1.02 H new ATOM 0 HG22 THR A 182 5.935 -8.621 -3.802 1.00 1.02 H new ATOM 0 HG23 THR A 182 7.060 -9.014 -5.124 1.00 1.02 H new ATOM 1967 N ASP A 183 9.917 -8.213 -4.970 1.00 0.38 N ATOM 1968 CA ASP A 183 10.512 -7.890 -6.297 1.00 0.42 C ATOM 1969 C ASP A 183 10.243 -9.045 -7.272 1.00 0.77 C ATOM 1970 O ASP A 183 9.258 -9.748 -7.144 1.00 1.16 O ATOM 1971 CB ASP A 183 12.012 -7.714 -6.022 1.00 0.66 C ATOM 1972 CG ASP A 183 12.602 -9.015 -5.470 1.00 0.95 C ATOM 1973 OD1 ASP A 183 12.745 -9.951 -6.239 1.00 1.52 O ATOM 1974 OD2 ASP A 183 12.900 -9.053 -4.288 1.00 1.47 O ATOM 0 H ASP A 183 10.263 -9.071 -4.540 1.00 0.38 H new ATOM 0 HA ASP A 183 10.090 -6.994 -6.753 1.00 0.42 H new ATOM 0 HB2 ASP A 183 12.527 -7.433 -6.940 1.00 0.66 H new ATOM 0 HB3 ASP A 183 12.166 -6.904 -5.309 1.00 0.66 H new ATOM 1979 N ASP A 184 11.104 -9.249 -8.238 1.00 0.85 N ATOM 1980 CA ASP A 184 10.886 -10.364 -9.211 1.00 1.24 C ATOM 1981 C ASP A 184 10.878 -11.707 -8.483 1.00 1.92 C ATOM 1982 O ASP A 184 9.992 -12.522 -8.660 1.00 2.87 O ATOM 1983 CB ASP A 184 12.054 -10.289 -10.194 1.00 1.18 C ATOM 1984 CG ASP A 184 11.568 -9.753 -11.544 1.00 1.97 C ATOM 1985 OD1 ASP A 184 10.450 -10.070 -11.917 1.00 2.66 O ATOM 1986 OD2 ASP A 184 12.321 -9.034 -12.179 1.00 2.63 O ATOM 0 H ASP A 184 11.945 -8.694 -8.395 1.00 0.85 H new ATOM 0 HA ASP A 184 9.928 -10.274 -9.723 1.00 1.24 H new ATOM 0 HB2 ASP A 184 12.834 -9.641 -9.796 1.00 1.18 H new ATOM 0 HB3 ASP A 184 12.496 -11.277 -10.323 1.00 1.18 H new ATOM 1991 N ASP A 185 11.866 -11.932 -7.669 1.00 1.64 N ATOM 1992 CA ASP A 185 11.952 -13.224 -6.909 1.00 2.38 C ATOM 1993 C ASP A 185 13.069 -13.199 -5.850 1.00 1.79 C ATOM 1994 O ASP A 185 13.112 -14.049 -4.982 1.00 2.16 O ATOM 1995 CB ASP A 185 12.268 -14.282 -7.966 1.00 3.51 C ATOM 1996 CG ASP A 185 11.455 -15.549 -7.689 1.00 4.49 C ATOM 1997 OD1 ASP A 185 11.675 -16.155 -6.653 1.00 4.99 O ATOM 1998 OD2 ASP A 185 10.627 -15.891 -8.517 1.00 5.08 O ATOM 0 H ASP A 185 12.627 -11.277 -7.490 1.00 1.64 H new ATOM 0 HA ASP A 185 11.025 -13.419 -6.369 1.00 2.38 H new ATOM 0 HB2 ASP A 185 12.034 -13.898 -8.959 1.00 3.51 H new ATOM 0 HB3 ASP A 185 13.333 -14.513 -7.956 1.00 3.51 H new ATOM 2003 N ARG A 186 13.986 -12.257 -5.924 1.00 1.44 N ATOM 2004 CA ARG A 186 15.116 -12.201 -4.934 1.00 1.79 C ATOM 2005 C ARG A 186 14.618 -12.350 -3.492 1.00 1.42 C ATOM 2006 O ARG A 186 15.127 -13.154 -2.734 1.00 1.60 O ATOM 2007 CB ARG A 186 15.752 -10.821 -5.135 1.00 2.64 C ATOM 2008 CG ARG A 186 17.022 -10.954 -5.982 1.00 3.28 C ATOM 2009 CD ARG A 186 18.243 -11.054 -5.063 1.00 3.51 C ATOM 2010 NE ARG A 186 19.300 -10.247 -5.735 1.00 4.49 N ATOM 2011 CZ ARG A 186 20.556 -10.435 -5.433 1.00 5.17 C ATOM 2012 NH1 ARG A 186 20.934 -10.431 -4.184 1.00 5.77 N ATOM 2013 NH2 ARG A 186 21.433 -10.626 -6.379 1.00 5.58 N ATOM 0 H ARG A 186 14.000 -11.522 -6.631 1.00 1.44 H new ATOM 0 HA ARG A 186 15.821 -13.017 -5.095 1.00 1.79 H new ATOM 0 HB2 ARG A 186 15.045 -10.152 -5.626 1.00 2.64 H new ATOM 0 HB3 ARG A 186 15.993 -10.377 -4.169 1.00 2.64 H new ATOM 0 HG2 ARG A 186 16.958 -11.838 -6.616 1.00 3.28 H new ATOM 0 HG3 ARG A 186 17.122 -10.094 -6.644 1.00 3.28 H new ATOM 0 HD2 ARG A 186 18.022 -10.665 -4.069 1.00 3.51 H new ATOM 0 HD3 ARG A 186 18.558 -12.090 -4.937 1.00 3.51 H new ATOM 0 HE ARG A 186 19.042 -9.548 -6.431 1.00 4.49 H new ATOM 0 HH11 ARG A 186 20.248 -10.281 -3.444 1.00 5.77 H new ATOM 0 HH12 ARG A 186 21.915 -10.578 -3.948 1.00 5.77 H new ATOM 0 HH21 ARG A 186 21.138 -10.629 -7.355 1.00 5.58 H new ATOM 0 HH22 ARG A 186 22.414 -10.773 -6.143 1.00 5.58 H new ATOM 2027 N THR A 187 13.628 -11.585 -3.113 1.00 1.12 N ATOM 2028 CA THR A 187 13.088 -11.676 -1.714 1.00 0.96 C ATOM 2029 C THR A 187 11.872 -10.758 -1.540 1.00 0.81 C ATOM 2030 O THR A 187 11.313 -10.257 -2.496 1.00 0.92 O ATOM 2031 CB THR A 187 14.232 -11.214 -0.794 1.00 1.17 C ATOM 2032 OG1 THR A 187 13.800 -11.268 0.559 1.00 1.46 O ATOM 2033 CG2 THR A 187 14.641 -9.778 -1.142 1.00 1.35 C ATOM 0 H THR A 187 13.166 -10.898 -3.709 1.00 1.12 H new ATOM 0 HA THR A 187 12.761 -12.689 -1.482 1.00 0.96 H new ATOM 0 HB THR A 187 15.090 -11.872 -0.934 1.00 1.17 H new ATOM 0 HG1 THR A 187 14.528 -10.976 1.147 1.00 1.46 H new ATOM 0 HG21 THR A 187 15.451 -9.461 -0.485 1.00 1.35 H new ATOM 0 HG22 THR A 187 14.977 -9.736 -2.178 1.00 1.35 H new ATOM 0 HG23 THR A 187 13.786 -9.114 -1.010 1.00 1.35 H new ATOM 2041 N ASP A 188 11.477 -10.530 -0.313 1.00 0.91 N ATOM 2042 CA ASP A 188 10.314 -9.637 -0.040 1.00 0.80 C ATOM 2043 C ASP A 188 10.792 -8.399 0.723 1.00 0.63 C ATOM 2044 O ASP A 188 11.426 -8.507 1.757 1.00 0.80 O ATOM 2045 CB ASP A 188 9.365 -10.470 0.822 1.00 1.06 C ATOM 2046 CG ASP A 188 8.795 -11.620 -0.011 1.00 1.86 C ATOM 2047 OD1 ASP A 188 8.438 -11.379 -1.152 1.00 2.59 O ATOM 2048 OD2 ASP A 188 8.726 -12.723 0.507 1.00 2.48 O ATOM 0 H ASP A 188 11.915 -10.929 0.517 1.00 0.91 H new ATOM 0 HA ASP A 188 9.826 -9.290 -0.951 1.00 0.80 H new ATOM 0 HB2 ASP A 188 9.895 -10.863 1.689 1.00 1.06 H new ATOM 0 HB3 ASP A 188 8.556 -9.845 1.199 1.00 1.06 H new ATOM 2053 N HIS A 189 10.506 -7.228 0.216 1.00 0.45 N ATOM 2054 CA HIS A 189 10.957 -5.979 0.904 1.00 0.50 C ATOM 2055 C HIS A 189 10.196 -5.779 2.219 1.00 0.46 C ATOM 2056 O HIS A 189 10.793 -5.659 3.273 1.00 0.57 O ATOM 2057 CB HIS A 189 10.646 -4.843 -0.073 1.00 0.66 C ATOM 2058 CG HIS A 189 11.571 -4.934 -1.255 1.00 0.74 C ATOM 2059 ND1 HIS A 189 12.941 -5.086 -1.112 1.00 1.38 N ATOM 2060 CD2 HIS A 189 11.337 -4.897 -2.608 1.00 0.95 C ATOM 2061 CE1 HIS A 189 13.475 -5.134 -2.346 1.00 1.83 C ATOM 2062 NE2 HIS A 189 12.541 -5.024 -3.295 1.00 1.56 N ATOM 0 H HIS A 189 9.979 -7.081 -0.645 1.00 0.45 H new ATOM 0 HA HIS A 189 12.016 -6.019 1.158 1.00 0.50 H new ATOM 0 HB2 HIS A 189 9.609 -4.906 -0.403 1.00 0.66 H new ATOM 0 HB3 HIS A 189 10.765 -3.879 0.423 1.00 0.66 H new ATOM 0 HD1 HIS A 189 13.452 -5.150 -0.231 1.00 1.38 H new ATOM 0 HD2 HIS A 189 10.367 -4.786 -3.069 1.00 0.95 H new ATOM 0 HE1 HIS A 189 14.530 -5.248 -2.545 1.00 1.83 H new ATOM 2070 N LEU A 190 8.886 -5.737 2.167 1.00 0.39 N ATOM 2071 CA LEU A 190 8.092 -5.538 3.417 1.00 0.41 C ATOM 2072 C LEU A 190 6.608 -5.806 3.156 1.00 0.34 C ATOM 2073 O LEU A 190 6.131 -5.678 2.044 1.00 0.52 O ATOM 2074 CB LEU A 190 8.311 -4.072 3.795 1.00 0.57 C ATOM 2075 CG LEU A 190 7.799 -3.827 5.215 1.00 0.69 C ATOM 2076 CD1 LEU A 190 8.846 -4.301 6.224 1.00 1.31 C ATOM 2077 CD2 LEU A 190 7.543 -2.330 5.413 1.00 0.81 C ATOM 0 H LEU A 190 8.335 -5.832 1.314 1.00 0.39 H new ATOM 0 HA LEU A 190 8.400 -6.218 4.211 1.00 0.41 H new ATOM 0 HB2 LEU A 190 9.370 -3.824 3.732 1.00 0.57 H new ATOM 0 HB3 LEU A 190 7.789 -3.423 3.092 1.00 0.57 H new ATOM 0 HG LEU A 190 6.871 -4.379 5.367 1.00 0.69 H new ATOM 0 HD11 LEU A 190 8.481 -4.126 7.236 1.00 1.31 H new ATOM 0 HD12 LEU A 190 9.031 -5.366 6.084 1.00 1.31 H new ATOM 0 HD13 LEU A 190 9.774 -3.749 6.072 1.00 1.31 H new ATOM 0 HD21 LEU A 190 7.178 -2.154 6.425 1.00 0.81 H new ATOM 0 HD22 LEU A 190 8.471 -1.779 5.261 1.00 0.81 H new ATOM 0 HD23 LEU A 190 6.797 -1.990 4.694 1.00 0.81 H new ATOM 2089 N SER A 191 5.878 -6.173 4.177 1.00 0.33 N ATOM 2090 CA SER A 191 4.421 -6.449 4.005 1.00 0.31 C ATOM 2091 C SER A 191 3.659 -6.044 5.270 1.00 0.31 C ATOM 2092 O SER A 191 4.135 -6.229 6.374 1.00 0.35 O ATOM 2093 CB SER A 191 4.328 -7.958 3.783 1.00 0.37 C ATOM 2094 OG SER A 191 5.015 -8.631 4.830 1.00 1.30 O ATOM 0 H SER A 191 6.230 -6.294 5.127 1.00 0.33 H new ATOM 0 HA SER A 191 3.987 -5.889 3.177 1.00 0.31 H new ATOM 0 HB2 SER A 191 3.284 -8.270 3.759 1.00 0.37 H new ATOM 0 HB3 SER A 191 4.762 -8.223 2.819 1.00 0.37 H new ATOM 0 HG SER A 191 4.955 -9.599 4.691 1.00 1.30 H new ATOM 2100 N TRP A 192 2.480 -5.496 5.115 1.00 0.31 N ATOM 2101 CA TRP A 192 1.683 -5.079 6.306 1.00 0.33 C ATOM 2102 C TRP A 192 0.212 -5.472 6.121 1.00 0.31 C ATOM 2103 O TRP A 192 -0.119 -6.280 5.273 1.00 0.31 O ATOM 2104 CB TRP A 192 1.849 -3.554 6.389 1.00 0.36 C ATOM 2105 CG TRP A 192 1.292 -2.900 5.160 1.00 0.34 C ATOM 2106 CD1 TRP A 192 0.102 -2.259 5.099 1.00 0.35 C ATOM 2107 CD2 TRP A 192 1.874 -2.809 3.827 1.00 0.33 C ATOM 2108 NE1 TRP A 192 -0.083 -1.782 3.815 1.00 0.35 N ATOM 2109 CE2 TRP A 192 0.978 -2.096 2.994 1.00 0.34 C ATOM 2110 CE3 TRP A 192 3.076 -3.269 3.263 1.00 0.35 C ATOM 2111 CZ2 TRP A 192 1.263 -1.850 1.653 1.00 0.36 C ATOM 2112 CZ3 TRP A 192 3.368 -3.023 1.911 1.00 0.37 C ATOM 2113 CH2 TRP A 192 2.462 -2.315 1.108 1.00 0.38 C ATOM 0 H TRP A 192 2.036 -5.320 4.214 1.00 0.31 H new ATOM 0 HA TRP A 192 2.019 -5.564 7.223 1.00 0.33 H new ATOM 0 HB2 TRP A 192 1.339 -3.174 7.274 1.00 0.36 H new ATOM 0 HB3 TRP A 192 2.904 -3.302 6.496 1.00 0.36 H new ATOM 0 HD1 TRP A 192 -0.590 -2.140 5.919 1.00 0.35 H new ATOM 0 HE1 TRP A 192 -0.906 -1.261 3.512 1.00 0.35 H new ATOM 0 HE3 TRP A 192 3.780 -3.815 3.873 1.00 0.35 H new ATOM 0 HZ2 TRP A 192 0.562 -1.304 1.039 1.00 0.36 H new ATOM 0 HZ3 TRP A 192 4.295 -3.381 1.488 1.00 0.37 H new ATOM 0 HH2 TRP A 192 2.691 -2.129 0.069 1.00 0.38 H new ATOM 2124 N GLU A 193 -0.668 -4.905 6.907 1.00 0.30 N ATOM 2125 CA GLU A 193 -2.118 -5.245 6.779 1.00 0.30 C ATOM 2126 C GLU A 193 -2.988 -4.092 7.291 1.00 0.30 C ATOM 2127 O GLU A 193 -2.838 -3.637 8.409 1.00 0.35 O ATOM 2128 CB GLU A 193 -2.315 -6.498 7.642 1.00 0.35 C ATOM 2129 CG GLU A 193 -1.911 -6.207 9.092 1.00 1.36 C ATOM 2130 CD GLU A 193 -1.779 -7.524 9.859 1.00 1.69 C ATOM 2131 OE1 GLU A 193 -2.742 -8.273 9.883 1.00 1.83 O ATOM 2132 OE2 GLU A 193 -0.716 -7.762 10.409 1.00 2.49 O ATOM 0 H GLU A 193 -0.446 -4.222 7.631 1.00 0.30 H new ATOM 0 HA GLU A 193 -2.407 -5.417 5.742 1.00 0.30 H new ATOM 0 HB2 GLU A 193 -3.357 -6.816 7.603 1.00 0.35 H new ATOM 0 HB3 GLU A 193 -1.716 -7.319 7.247 1.00 0.35 H new ATOM 0 HG2 GLU A 193 -0.966 -5.664 9.115 1.00 1.36 H new ATOM 0 HG3 GLU A 193 -2.657 -5.570 9.568 1.00 1.36 H new ATOM 2139 N TRP A 194 -3.903 -3.629 6.479 1.00 0.29 N ATOM 2140 CA TRP A 194 -4.801 -2.512 6.906 1.00 0.30 C ATOM 2141 C TRP A 194 -6.237 -2.801 6.465 1.00 0.30 C ATOM 2142 O TRP A 194 -6.470 -3.408 5.437 1.00 0.33 O ATOM 2143 CB TRP A 194 -4.264 -1.231 6.242 1.00 0.32 C ATOM 2144 CG TRP A 194 -4.044 -1.420 4.767 1.00 0.30 C ATOM 2145 CD1 TRP A 194 -3.063 -2.172 4.216 1.00 0.32 C ATOM 2146 CD2 TRP A 194 -4.788 -0.843 3.654 1.00 0.31 C ATOM 2147 NE1 TRP A 194 -3.157 -2.095 2.838 1.00 0.32 N ATOM 2148 CE2 TRP A 194 -4.206 -1.290 2.443 1.00 0.32 C ATOM 2149 CE3 TRP A 194 -5.900 0.015 3.577 1.00 0.35 C ATOM 2150 CZ2 TRP A 194 -4.710 -0.900 1.201 1.00 0.35 C ATOM 2151 CZ3 TRP A 194 -6.409 0.410 2.328 1.00 0.40 C ATOM 2152 CH2 TRP A 194 -5.815 -0.047 1.143 1.00 0.39 C ATOM 0 H TRP A 194 -4.068 -3.977 5.535 1.00 0.29 H new ATOM 0 HA TRP A 194 -4.812 -2.400 7.990 1.00 0.30 H new ATOM 0 HB2 TRP A 194 -4.968 -0.415 6.403 1.00 0.32 H new ATOM 0 HB3 TRP A 194 -3.326 -0.941 6.716 1.00 0.32 H new ATOM 0 HD1 TRP A 194 -2.326 -2.740 4.764 1.00 0.32 H new ATOM 0 HE1 TRP A 194 -2.528 -2.574 2.193 1.00 0.32 H new ATOM 0 HE3 TRP A 194 -6.366 0.373 4.484 1.00 0.35 H new ATOM 0 HZ2 TRP A 194 -4.249 -1.255 0.291 1.00 0.35 H new ATOM 0 HZ3 TRP A 194 -7.263 1.070 2.281 1.00 0.40 H new ATOM 0 HH2 TRP A 194 -6.211 0.260 0.186 1.00 0.39 H new ATOM 2163 N ASN A 195 -7.197 -2.384 7.250 1.00 0.31 N ATOM 2164 CA ASN A 195 -8.625 -2.645 6.902 1.00 0.33 C ATOM 2165 C ASN A 195 -9.225 -1.473 6.121 1.00 0.32 C ATOM 2166 O ASN A 195 -8.926 -0.323 6.380 1.00 0.37 O ATOM 2167 CB ASN A 195 -9.334 -2.803 8.247 1.00 0.38 C ATOM 2168 CG ASN A 195 -9.045 -4.191 8.820 1.00 0.51 C ATOM 2169 OD1 ASN A 195 -7.919 -4.499 9.158 1.00 1.28 O ATOM 2170 ND2 ASN A 195 -10.021 -5.048 8.946 1.00 1.14 N ATOM 0 H ASN A 195 -7.052 -1.872 8.120 1.00 0.31 H new ATOM 0 HA ASN A 195 -8.731 -3.525 6.268 1.00 0.33 H new ATOM 0 HB2 ASN A 195 -8.994 -2.034 8.941 1.00 0.38 H new ATOM 0 HB3 ASN A 195 -10.408 -2.667 8.121 1.00 0.38 H new ATOM 0 HD21 ASN A 195 -9.839 -5.976 9.328 1.00 1.14 H new ATOM 0 HD22 ASN A 195 -10.966 -4.790 8.662 1.00 1.14 H new ATOM 2177 N LEU A 196 -10.082 -1.765 5.177 1.00 0.35 N ATOM 2178 CA LEU A 196 -10.729 -0.683 4.378 1.00 0.36 C ATOM 2179 C LEU A 196 -12.218 -0.614 4.725 1.00 0.33 C ATOM 2180 O LEU A 196 -12.996 -1.455 4.317 1.00 0.40 O ATOM 2181 CB LEU A 196 -10.533 -1.090 2.918 1.00 0.43 C ATOM 2182 CG LEU A 196 -10.849 0.101 2.012 1.00 0.46 C ATOM 2183 CD1 LEU A 196 -9.751 1.166 2.153 1.00 0.50 C ATOM 2184 CD2 LEU A 196 -10.925 -0.375 0.558 1.00 0.77 C ATOM 0 H LEU A 196 -10.363 -2.712 4.924 1.00 0.35 H new ATOM 0 HA LEU A 196 -10.302 0.300 4.579 1.00 0.36 H new ATOM 0 HB2 LEU A 196 -9.508 -1.422 2.756 1.00 0.43 H new ATOM 0 HB3 LEU A 196 -11.183 -1.930 2.673 1.00 0.43 H new ATOM 0 HG LEU A 196 -11.805 0.536 2.303 1.00 0.46 H new ATOM 0 HD11 LEU A 196 -9.980 2.013 1.506 1.00 0.50 H new ATOM 0 HD12 LEU A 196 -9.702 1.503 3.188 1.00 0.50 H new ATOM 0 HD13 LEU A 196 -8.791 0.739 1.865 1.00 0.50 H new ATOM 0 HD21 LEU A 196 -11.150 0.472 -0.091 1.00 0.77 H new ATOM 0 HD22 LEU A 196 -9.969 -0.811 0.267 1.00 0.77 H new ATOM 0 HD23 LEU A 196 -11.710 -1.125 0.461 1.00 0.77 H new ATOM 2196 N THR A 197 -12.613 0.374 5.486 1.00 0.31 N ATOM 2197 CA THR A 197 -14.049 0.494 5.878 1.00 0.31 C ATOM 2198 C THR A 197 -14.864 1.159 4.763 1.00 0.33 C ATOM 2199 O THR A 197 -14.771 2.351 4.540 1.00 0.53 O ATOM 2200 CB THR A 197 -14.040 1.361 7.142 1.00 0.35 C ATOM 2201 OG1 THR A 197 -13.251 0.728 8.139 1.00 0.37 O ATOM 2202 CG2 THR A 197 -15.470 1.538 7.660 1.00 0.39 C ATOM 0 H THR A 197 -12.002 1.104 5.853 1.00 0.31 H new ATOM 0 HA THR A 197 -14.510 -0.478 6.053 1.00 0.31 H new ATOM 0 HB THR A 197 -13.620 2.339 6.907 1.00 0.35 H new ATOM 0 HG1 THR A 197 -12.765 1.407 8.652 1.00 0.37 H new ATOM 0 HG21 THR A 197 -15.458 2.155 8.558 1.00 0.39 H new ATOM 0 HG22 THR A 197 -16.077 2.023 6.895 1.00 0.39 H new ATOM 0 HG23 THR A 197 -15.895 0.562 7.896 1.00 0.39 H new ATOM 2210 N ILE A 198 -15.672 0.393 4.073 1.00 0.31 N ATOM 2211 CA ILE A 198 -16.512 0.969 2.979 1.00 0.33 C ATOM 2212 C ILE A 198 -17.727 1.674 3.592 1.00 0.34 C ATOM 2213 O ILE A 198 -18.096 1.409 4.722 1.00 0.40 O ATOM 2214 CB ILE A 198 -16.944 -0.233 2.129 1.00 0.35 C ATOM 2215 CG1 ILE A 198 -15.702 -0.941 1.559 1.00 0.37 C ATOM 2216 CG2 ILE A 198 -17.842 0.239 0.980 1.00 0.40 C ATOM 2217 CD1 ILE A 198 -14.896 0.021 0.676 1.00 0.39 C ATOM 0 H ILE A 198 -15.786 -0.610 4.221 1.00 0.31 H new ATOM 0 HA ILE A 198 -15.979 1.706 2.378 1.00 0.33 H new ATOM 0 HB ILE A 198 -17.500 -0.931 2.755 1.00 0.35 H new ATOM 0 HG12 ILE A 198 -15.077 -1.306 2.374 1.00 0.37 H new ATOM 0 HG13 ILE A 198 -16.006 -1.811 0.977 1.00 0.37 H new ATOM 0 HG21 ILE A 198 -18.146 -0.619 0.380 1.00 0.40 H new ATOM 0 HG22 ILE A 198 -18.727 0.729 1.387 1.00 0.40 H new ATOM 0 HG23 ILE A 198 -17.293 0.943 0.355 1.00 0.40 H new ATOM 0 HD11 ILE A 198 -14.021 -0.495 0.281 1.00 0.39 H new ATOM 0 HD12 ILE A 198 -15.519 0.365 -0.150 1.00 0.39 H new ATOM 0 HD13 ILE A 198 -14.575 0.877 1.269 1.00 0.39 H new ATOM 2229 N LYS A 199 -18.347 2.572 2.863 1.00 0.36 N ATOM 2230 CA LYS A 199 -19.532 3.295 3.417 1.00 0.41 C ATOM 2231 C LYS A 199 -20.436 3.785 2.282 1.00 0.45 C ATOM 2232 O LYS A 199 -20.454 3.217 1.207 1.00 0.47 O ATOM 2233 CB LYS A 199 -18.941 4.476 4.194 1.00 0.45 C ATOM 2234 CG LYS A 199 -19.693 4.651 5.516 1.00 0.85 C ATOM 2235 CD LYS A 199 -18.991 5.709 6.368 1.00 1.11 C ATOM 2236 CE LYS A 199 -19.410 5.547 7.831 1.00 1.56 C ATOM 2237 NZ LYS A 199 -19.487 6.935 8.365 1.00 2.06 N ATOM 0 H LYS A 199 -18.084 2.833 1.913 1.00 0.36 H new ATOM 0 HA LYS A 199 -20.149 2.658 4.051 1.00 0.41 H new ATOM 0 HB2 LYS A 199 -17.882 4.304 4.387 1.00 0.45 H new ATOM 0 HB3 LYS A 199 -19.013 5.387 3.600 1.00 0.45 H new ATOM 0 HG2 LYS A 199 -20.723 4.950 5.323 1.00 0.85 H new ATOM 0 HG3 LYS A 199 -19.731 3.703 6.053 1.00 0.85 H new ATOM 0 HD2 LYS A 199 -17.910 5.607 6.275 1.00 1.11 H new ATOM 0 HD3 LYS A 199 -19.249 6.707 6.013 1.00 1.11 H new ATOM 0 HE2 LYS A 199 -20.371 5.039 7.913 1.00 1.56 H new ATOM 0 HE3 LYS A 199 -18.686 4.950 8.385 1.00 1.56 H new ATOM 0 HZ1 LYS A 199 -19.769 6.907 9.366 1.00 2.06 H new ATOM 0 HZ2 LYS A 199 -18.556 7.392 8.280 1.00 2.06 H new ATOM 0 HZ3 LYS A 199 -20.189 7.477 7.822 1.00 2.06 H new ATOM 2251 N LYS A 200 -21.193 4.830 2.518 1.00 0.50 N ATOM 2252 CA LYS A 200 -22.105 5.351 1.458 1.00 0.58 C ATOM 2253 C LYS A 200 -21.809 6.823 1.153 1.00 0.52 C ATOM 2254 O LYS A 200 -21.943 7.262 0.025 1.00 0.69 O ATOM 2255 CB LYS A 200 -23.511 5.199 2.043 1.00 0.79 C ATOM 2256 CG LYS A 200 -24.472 4.716 0.954 1.00 1.36 C ATOM 2257 CD LYS A 200 -25.887 4.612 1.529 1.00 1.85 C ATOM 2258 CE LYS A 200 -25.922 3.531 2.612 1.00 2.83 C ATOM 2259 NZ LYS A 200 -27.356 3.420 3.000 1.00 3.65 N ATOM 0 H LYS A 200 -21.217 5.343 3.400 1.00 0.50 H new ATOM 0 HA LYS A 200 -21.985 4.812 0.518 1.00 0.58 H new ATOM 0 HB2 LYS A 200 -23.497 4.489 2.870 1.00 0.79 H new ATOM 0 HB3 LYS A 200 -23.853 6.152 2.447 1.00 0.79 H new ATOM 0 HG2 LYS A 200 -24.461 5.408 0.112 1.00 1.36 H new ATOM 0 HG3 LYS A 200 -24.150 3.746 0.575 1.00 1.36 H new ATOM 0 HD2 LYS A 200 -26.192 5.571 1.948 1.00 1.85 H new ATOM 0 HD3 LYS A 200 -26.596 4.371 0.737 1.00 1.85 H new ATOM 0 HE2 LYS A 200 -25.541 2.582 2.235 1.00 2.83 H new ATOM 0 HE3 LYS A 200 -25.302 3.807 3.465 1.00 2.83 H new ATOM 0 HZ1 LYS A 200 -27.460 2.697 3.740 1.00 3.65 H new ATOM 0 HZ2 LYS A 200 -27.690 4.336 3.362 1.00 3.65 H new ATOM 0 HZ3 LYS A 200 -27.920 3.149 2.169 1.00 3.65 H new ATOM 2273 N GLU A 201 -21.423 7.593 2.143 1.00 0.50 N ATOM 2274 CA GLU A 201 -21.140 9.040 1.889 1.00 0.57 C ATOM 2275 C GLU A 201 -19.954 9.543 2.723 1.00 0.54 C ATOM 2276 O GLU A 201 -20.046 10.555 3.394 1.00 0.57 O ATOM 2277 CB GLU A 201 -22.425 9.766 2.292 1.00 0.77 C ATOM 2278 CG GLU A 201 -23.321 9.941 1.064 1.00 1.62 C ATOM 2279 CD GLU A 201 -24.754 10.230 1.514 1.00 1.98 C ATOM 2280 OE1 GLU A 201 -25.232 9.529 2.390 1.00 2.25 O ATOM 2281 OE2 GLU A 201 -25.349 11.149 0.975 1.00 2.62 O ATOM 0 H GLU A 201 -21.293 7.285 3.107 1.00 0.50 H new ATOM 0 HA GLU A 201 -20.867 9.216 0.848 1.00 0.57 H new ATOM 0 HB2 GLU A 201 -22.950 9.198 3.060 1.00 0.77 H new ATOM 0 HB3 GLU A 201 -22.186 10.739 2.722 1.00 0.77 H new ATOM 0 HG2 GLU A 201 -22.951 10.758 0.445 1.00 1.62 H new ATOM 0 HG3 GLU A 201 -23.296 9.040 0.451 1.00 1.62 H new ATOM 2288 N TRP A 202 -18.837 8.859 2.674 1.00 0.60 N ATOM 2289 CA TRP A 202 -17.637 9.310 3.450 1.00 0.63 C ATOM 2290 C TRP A 202 -17.265 10.762 3.096 1.00 0.68 C ATOM 2291 O TRP A 202 -16.610 11.443 3.862 1.00 0.82 O ATOM 2292 CB TRP A 202 -16.505 8.332 3.076 1.00 0.68 C ATOM 2293 CG TRP A 202 -16.045 8.505 1.649 1.00 0.66 C ATOM 2294 CD1 TRP A 202 -16.841 8.740 0.572 1.00 0.76 C ATOM 2295 CD2 TRP A 202 -14.680 8.440 1.132 1.00 0.59 C ATOM 2296 NE1 TRP A 202 -16.051 8.815 -0.561 1.00 0.72 N ATOM 2297 CE2 TRP A 202 -14.716 8.636 -0.269 1.00 0.62 C ATOM 2298 CE3 TRP A 202 -13.427 8.230 1.737 1.00 0.59 C ATOM 2299 CZ2 TRP A 202 -13.555 8.620 -1.041 1.00 0.63 C ATOM 2300 CZ3 TRP A 202 -12.256 8.214 0.963 1.00 0.66 C ATOM 2301 CH2 TRP A 202 -12.320 8.407 -0.424 1.00 0.67 C ATOM 0 H TRP A 202 -18.703 8.007 2.130 1.00 0.60 H new ATOM 0 HA TRP A 202 -17.827 9.302 4.523 1.00 0.63 H new ATOM 0 HB2 TRP A 202 -15.660 8.483 3.748 1.00 0.68 H new ATOM 0 HB3 TRP A 202 -16.849 7.308 3.223 1.00 0.68 H new ATOM 0 HD1 TRP A 202 -17.915 8.850 0.597 1.00 0.76 H new ATOM 0 HE1 TRP A 202 -16.413 8.983 -1.500 1.00 0.72 H new ATOM 0 HE3 TRP A 202 -13.366 8.080 2.805 1.00 0.59 H new ATOM 0 HZ2 TRP A 202 -13.610 8.771 -2.109 1.00 0.63 H new ATOM 0 HZ3 TRP A 202 -11.300 8.052 1.439 1.00 0.66 H new ATOM 0 HH2 TRP A 202 -11.416 8.391 -1.015 1.00 0.67 H new ATOM 2312 N LYS A 203 -17.683 11.235 1.947 1.00 0.71 N ATOM 2313 CA LYS A 203 -17.361 12.640 1.549 1.00 0.80 C ATOM 2314 C LYS A 203 -18.576 13.544 1.783 1.00 0.92 C ATOM 2315 O LYS A 203 -18.849 14.443 1.009 1.00 1.04 O ATOM 2316 CB LYS A 203 -17.016 12.569 0.055 1.00 0.88 C ATOM 2317 CG LYS A 203 -18.208 12.010 -0.742 1.00 1.84 C ATOM 2318 CD LYS A 203 -18.662 13.032 -1.788 1.00 2.44 C ATOM 2319 CE LYS A 203 -20.101 12.726 -2.209 1.00 3.30 C ATOM 2320 NZ LYS A 203 -20.569 13.958 -2.903 1.00 3.87 N ATOM 0 H LYS A 203 -18.233 10.709 1.268 1.00 0.71 H new ATOM 0 HA LYS A 203 -16.538 13.056 2.131 1.00 0.80 H new ATOM 0 HB2 LYS A 203 -16.757 13.562 -0.313 1.00 0.88 H new ATOM 0 HB3 LYS A 203 -16.141 11.936 -0.094 1.00 0.88 H new ATOM 0 HG2 LYS A 203 -17.924 11.078 -1.231 1.00 1.84 H new ATOM 0 HG3 LYS A 203 -19.031 11.778 -0.066 1.00 1.84 H new ATOM 0 HD2 LYS A 203 -18.598 14.040 -1.379 1.00 2.44 H new ATOM 0 HD3 LYS A 203 -18.003 12.998 -2.655 1.00 2.44 H new ATOM 0 HE2 LYS A 203 -20.143 11.860 -2.870 1.00 3.30 H new ATOM 0 HE3 LYS A 203 -20.725 12.498 -1.345 1.00 3.30 H new ATOM 0 HZ1 LYS A 203 -21.550 13.825 -3.222 1.00 3.87 H new ATOM 0 HZ2 LYS A 203 -20.524 14.764 -2.247 1.00 3.87 H new ATOM 0 HZ3 LYS A 203 -19.960 14.146 -3.725 1.00 3.87 H new ATOM 2334 N ASP A 204 -19.304 13.308 2.844 1.00 1.08 N ATOM 2335 CA ASP A 204 -20.505 14.145 3.137 1.00 1.43 C ATOM 2336 C ASP A 204 -20.523 14.544 4.615 1.00 1.92 C ATOM 2337 O ASP A 204 -20.276 13.684 5.444 1.00 2.53 O ATOM 2338 CB ASP A 204 -21.699 13.249 2.809 1.00 2.04 C ATOM 2339 CG ASP A 204 -22.823 14.094 2.208 1.00 3.08 C ATOM 2340 OD1 ASP A 204 -22.771 14.354 1.017 1.00 3.67 O ATOM 2341 OD2 ASP A 204 -23.718 14.467 2.949 1.00 3.74 O ATOM 2342 OXT ASP A 204 -20.785 15.704 4.892 1.00 2.33 O ATOM 0 H ASP A 204 -19.117 12.569 3.522 1.00 1.08 H new ATOM 0 HA ASP A 204 -20.517 15.069 2.559 1.00 1.43 H new ATOM 0 HB2 ASP A 204 -21.400 12.470 2.107 1.00 2.04 H new ATOM 0 HB3 ASP A 204 -22.049 12.748 3.711 1.00 2.04 H new TER 2347 ASP A 204 END