USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) 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 Single : A 1 GLY N :NH3+ -127:sc= 0.143 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -90:sc= 1.24 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -5.85! C(o=-5.8!,f=-7!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl -150:sc= -0.21 (180deg=-1.54!) USER MOD Single : A 16 HIS :FLIP no HD1:sc= -0.523 F(o=-1.9,f=-0.52) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0.00482 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.0556 K(o=-0.056,f=-1.5!) USER MOD Single : A 28 MET CE :methyl -124:sc= -0.686 (180deg=-3.6!) USER MOD Single : A 30 GLN : amide:sc= -0.0682 X(o=-0.068,f=-0.51) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 129:sc= -0.606 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 90:sc= -2.9! USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 171:sc= 0.609 USER MOD Single : A 51 ASN : amide:sc= -0.534 X(o=-0.53,f=-0.52) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -49:sc= -0.709 USER MOD Single : A 65 MET CE :methyl 154:sc= 0 (180deg=-0.813) USER MOD Single : A 67 MET CE :methyl -169:sc= -0.2 (180deg=-0.61) USER MOD Single : A 70 ASN : amide:sc= -0.0321 X(o=-0.032,f=-0.21) USER MOD Single : A 79 SER OG : rot -173:sc= 1.19 USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot -50:sc= 0.552 USER MOD Single : A 91 GLN : amide:sc= -2.98 K(o=-3,f=-4.6!) USER MOD Single : A 96 SER OG : rot 180:sc= -0.113 USER MOD Single : A 97 THR OG1 : rot -170:sc= 0.081 USER MOD Single : A 100 TYR OH : rot -92:sc= -0.63! USER MOD Single : A 101 THR OG1 : rot 89:sc= 0.636 USER MOD Single : A 105 SER OG : rot 60:sc= 0.786 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : 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=-0.00747 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.263 11.943 6.711 1.00 0.00 N ATOM 2 CA GLY A 1 -9.613 11.767 7.217 1.00 0.00 C ATOM 3 C GLY A 1 -9.803 10.364 7.797 1.00 0.00 C ATOM 4 O GLY A 1 -8.861 9.575 7.843 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.843 12.796 7.132 1.00 0.00 H new ATOM 0 H2 GLY A 1 -7.687 11.114 6.962 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.291 12.045 5.676 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.817 12.513 7.985 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.331 11.932 6.414 1.00 0.00 H new ATOM 8 N SER A 2 -11.028 10.096 8.225 1.00 0.00 N ATOM 9 CA SER A 2 -11.354 8.802 8.799 1.00 0.00 C ATOM 10 C SER A 2 -12.867 8.576 8.755 1.00 0.00 C ATOM 11 O SER A 2 -13.621 9.269 9.435 1.00 0.00 O ATOM 12 CB SER A 2 -10.842 8.693 10.237 1.00 0.00 C ATOM 13 OG SER A 2 -11.150 7.429 10.818 1.00 0.00 O ATOM 0 H SER A 2 -11.807 10.753 8.186 1.00 0.00 H new ATOM 0 HA SER A 2 -10.861 8.031 8.207 1.00 0.00 H new ATOM 0 HB2 SER A 2 -9.763 8.845 10.250 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.283 9.487 10.840 1.00 0.00 H new ATOM 0 HG SER A 2 -10.806 7.398 11.735 1.00 0.00 H new ATOM 19 N SER A 3 -13.264 7.603 7.949 1.00 0.00 N ATOM 20 CA SER A 3 -14.673 7.276 7.807 1.00 0.00 C ATOM 21 C SER A 3 -14.843 5.769 7.605 1.00 0.00 C ATOM 22 O SER A 3 -14.387 5.218 6.605 1.00 0.00 O ATOM 23 CB SER A 3 -15.302 8.043 6.642 1.00 0.00 C ATOM 24 OG SER A 3 -16.721 8.113 6.753 1.00 0.00 O ATOM 0 H SER A 3 -12.635 7.030 7.387 1.00 0.00 H new ATOM 0 HA SER A 3 -15.187 7.573 8.721 1.00 0.00 H new ATOM 0 HB2 SER A 3 -14.891 9.052 6.608 1.00 0.00 H new ATOM 0 HB3 SER A 3 -15.035 7.558 5.703 1.00 0.00 H new ATOM 0 HG SER A 3 -17.084 8.612 5.992 1.00 0.00 H new ATOM 30 N GLY A 4 -15.502 5.146 8.571 1.00 0.00 N ATOM 31 CA GLY A 4 -15.738 3.713 8.511 1.00 0.00 C ATOM 32 C GLY A 4 -14.525 2.981 7.934 1.00 0.00 C ATOM 33 O GLY A 4 -14.635 2.292 6.921 1.00 0.00 O ATOM 0 H GLY A 4 -15.880 5.607 9.399 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.954 3.334 9.510 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.615 3.511 7.897 1.00 0.00 H new ATOM 37 N SER A 5 -13.395 3.155 8.605 1.00 0.00 N ATOM 38 CA SER A 5 -12.163 2.519 8.172 1.00 0.00 C ATOM 39 C SER A 5 -11.053 2.779 9.192 1.00 0.00 C ATOM 40 O SER A 5 -10.121 3.535 8.922 1.00 0.00 O ATOM 41 CB SER A 5 -11.740 3.021 6.789 1.00 0.00 C ATOM 42 OG SER A 5 -11.993 4.413 6.626 1.00 0.00 O ATOM 0 H SER A 5 -13.308 3.727 9.445 1.00 0.00 H new ATOM 0 HA SER A 5 -12.339 1.446 8.101 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.678 2.826 6.642 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.276 2.463 6.021 1.00 0.00 H new ATOM 0 HG SER A 5 -12.893 4.541 6.260 1.00 0.00 H new ATOM 48 N SER A 6 -11.191 2.139 10.344 1.00 0.00 N ATOM 49 CA SER A 6 -10.211 2.292 11.407 1.00 0.00 C ATOM 50 C SER A 6 -9.279 1.079 11.438 1.00 0.00 C ATOM 51 O SER A 6 -8.080 1.219 11.671 1.00 0.00 O ATOM 52 CB SER A 6 -10.895 2.471 12.764 1.00 0.00 C ATOM 53 OG SER A 6 -10.824 3.818 13.224 1.00 0.00 O ATOM 0 H SER A 6 -11.966 1.514 10.565 1.00 0.00 H new ATOM 0 HA SER A 6 -9.624 3.188 11.205 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.939 2.169 12.686 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.427 1.813 13.496 1.00 0.00 H new ATOM 0 HG SER A 6 -11.273 3.891 14.092 1.00 0.00 H new ATOM 59 N GLY A 7 -9.866 -0.084 11.199 1.00 0.00 N ATOM 60 CA GLY A 7 -9.103 -1.321 11.197 1.00 0.00 C ATOM 61 C GLY A 7 -7.922 -1.235 10.229 1.00 0.00 C ATOM 62 O GLY A 7 -6.807 -1.629 10.566 1.00 0.00 O ATOM 0 H GLY A 7 -10.861 -0.196 11.005 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.739 -1.529 12.203 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.750 -2.151 10.914 1.00 0.00 H new ATOM 66 N LEU A 8 -8.207 -0.716 9.043 1.00 0.00 N ATOM 67 CA LEU A 8 -7.182 -0.573 8.023 1.00 0.00 C ATOM 68 C LEU A 8 -5.897 -0.048 8.667 1.00 0.00 C ATOM 69 O LEU A 8 -4.800 -0.318 8.181 1.00 0.00 O ATOM 70 CB LEU A 8 -7.691 0.296 6.871 1.00 0.00 C ATOM 71 CG LEU A 8 -8.747 -0.342 5.966 1.00 0.00 C ATOM 72 CD1 LEU A 8 -9.288 0.671 4.956 1.00 0.00 C ATOM 73 CD2 LEU A 8 -8.198 -1.596 5.282 1.00 0.00 C ATOM 0 H LEU A 8 -9.133 -0.390 8.766 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.946 -1.541 7.582 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.106 1.213 7.290 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.839 0.584 6.255 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.585 -0.655 6.588 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.037 0.192 4.325 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.743 1.507 5.487 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.471 1.037 4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -8.969 -2.030 4.645 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.333 -1.330 4.675 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.901 -2.323 6.038 1.00 0.00 H new ATOM 85 N HIS A 9 -6.076 0.692 9.752 1.00 0.00 N ATOM 86 CA HIS A 9 -4.945 1.256 10.467 1.00 0.00 C ATOM 87 C HIS A 9 -4.001 0.134 10.903 1.00 0.00 C ATOM 88 O HIS A 9 -2.792 0.218 10.692 1.00 0.00 O ATOM 89 CB HIS A 9 -5.418 2.120 11.638 1.00 0.00 C ATOM 90 CG HIS A 9 -6.417 3.185 11.251 1.00 0.00 C ATOM 91 ND1 HIS A 9 -6.735 4.250 12.075 1.00 0.00 N ATOM 92 CD2 HIS A 9 -7.165 3.337 10.120 1.00 0.00 C ATOM 93 CE1 HIS A 9 -7.634 5.002 11.459 1.00 0.00 C ATOM 94 NE2 HIS A 9 -7.900 4.434 10.247 1.00 0.00 N ATOM 0 H HIS A 9 -6.988 0.914 10.153 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.386 1.917 9.805 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -5.865 1.475 12.395 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -4.552 2.598 12.097 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -7.160 2.676 9.266 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -8.079 5.906 11.848 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -8.556 4.794 9.553 1.00 0.00 H new ATOM 102 N ARG A 10 -4.589 -0.891 11.502 1.00 0.00 N ATOM 103 CA ARG A 10 -3.816 -2.029 11.969 1.00 0.00 C ATOM 104 C ARG A 10 -3.042 -2.658 10.808 1.00 0.00 C ATOM 105 O ARG A 10 -2.005 -3.285 11.016 1.00 0.00 O ATOM 106 CB ARG A 10 -4.721 -3.088 12.602 1.00 0.00 C ATOM 107 CG ARG A 10 -5.484 -3.869 11.530 1.00 0.00 C ATOM 108 CD ARG A 10 -4.907 -5.276 11.362 1.00 0.00 C ATOM 109 NE ARG A 10 -5.930 -6.287 11.712 1.00 0.00 N ATOM 110 CZ ARG A 10 -6.172 -6.710 12.960 1.00 0.00 C ATOM 111 NH1 ARG A 10 -5.467 -6.212 13.984 1.00 0.00 N ATOM 112 NH2 ARG A 10 -7.119 -7.631 13.183 1.00 0.00 N ATOM 0 H ARG A 10 -5.592 -0.957 11.675 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.117 -1.667 12.723 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -4.121 -3.775 13.199 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.427 -2.609 13.280 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.537 -3.934 11.803 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.433 -3.335 10.581 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.576 -5.422 10.334 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -4.031 -5.397 11.999 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.485 -6.687 10.956 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.746 -5.511 13.814 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.651 -6.534 14.934 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -7.656 -8.010 12.403 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.303 -7.953 14.133 1.00 0.00 H new ATOM 126 N ILE A 11 -3.577 -2.467 9.611 1.00 0.00 N ATOM 127 CA ILE A 11 -2.950 -3.008 8.417 1.00 0.00 C ATOM 128 C ILE A 11 -1.741 -2.145 8.046 1.00 0.00 C ATOM 129 O ILE A 11 -0.667 -2.668 7.753 1.00 0.00 O ATOM 130 CB ILE A 11 -3.975 -3.147 7.289 1.00 0.00 C ATOM 131 CG1 ILE A 11 -5.163 -4.003 7.732 1.00 0.00 C ATOM 132 CG2 ILE A 11 -3.320 -3.690 6.017 1.00 0.00 C ATOM 133 CD1 ILE A 11 -6.196 -4.129 6.610 1.00 0.00 C ATOM 0 H ILE A 11 -4.437 -1.945 9.442 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.579 -4.015 8.605 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.362 -2.155 7.054 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.814 -4.994 8.023 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.628 -3.558 8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.070 -3.779 5.231 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.534 -3.008 5.693 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.889 -4.670 6.220 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.030 -4.742 6.951 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.561 -3.138 6.338 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.734 -4.596 5.741 1.00 0.00 H new ATOM 145 N VAL A 12 -1.958 -0.838 8.070 1.00 0.00 N ATOM 146 CA VAL A 12 -0.900 0.102 7.740 1.00 0.00 C ATOM 147 C VAL A 12 0.285 -0.119 8.682 1.00 0.00 C ATOM 148 O VAL A 12 1.424 -0.244 8.235 1.00 0.00 O ATOM 149 CB VAL A 12 -1.439 1.533 7.782 1.00 0.00 C ATOM 150 CG1 VAL A 12 -0.321 2.548 7.537 1.00 0.00 C ATOM 151 CG2 VAL A 12 -2.579 1.719 6.779 1.00 0.00 C ATOM 0 H VAL A 12 -2.850 -0.408 8.313 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.543 -0.066 6.724 1.00 0.00 H new ATOM 0 HB VAL A 12 -1.839 1.711 8.780 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -0.732 3.557 7.572 1.00 0.00 H new ATOM 0 HG12 VAL A 12 0.443 2.440 8.307 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.123 2.371 6.557 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -2.944 2.745 6.829 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.215 1.512 5.772 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.391 1.033 7.020 1.00 0.00 H new ATOM 161 N ASP A 13 -0.024 -0.160 9.970 1.00 0.00 N ATOM 162 CA ASP A 13 1.001 -0.364 10.979 1.00 0.00 C ATOM 163 C ASP A 13 1.853 -1.576 10.598 1.00 0.00 C ATOM 164 O ASP A 13 3.081 -1.519 10.656 1.00 0.00 O ATOM 165 CB ASP A 13 0.378 -0.637 12.350 1.00 0.00 C ATOM 166 CG ASP A 13 0.050 0.611 13.172 1.00 0.00 C ATOM 167 OD1 ASP A 13 -0.469 1.572 12.563 1.00 0.00 O ATOM 168 OD2 ASP A 13 0.326 0.577 14.390 1.00 0.00 O ATOM 0 H ASP A 13 -0.970 -0.055 10.338 1.00 0.00 H new ATOM 0 HA ASP A 13 1.607 0.541 11.031 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.538 -1.211 12.208 1.00 0.00 H new ATOM 0 HB3 ASP A 13 1.061 -1.263 12.924 1.00 0.00 H new ATOM 173 N LYS A 14 1.169 -2.643 10.215 1.00 0.00 N ATOM 174 CA LYS A 14 1.848 -3.867 9.823 1.00 0.00 C ATOM 175 C LYS A 14 2.748 -3.583 8.619 1.00 0.00 C ATOM 176 O LYS A 14 3.927 -3.934 8.625 1.00 0.00 O ATOM 177 CB LYS A 14 0.835 -4.988 9.583 1.00 0.00 C ATOM 178 CG LYS A 14 1.185 -6.229 10.407 1.00 0.00 C ATOM 179 CD LYS A 14 -0.055 -6.790 11.107 1.00 0.00 C ATOM 180 CE LYS A 14 0.335 -7.603 12.343 1.00 0.00 C ATOM 181 NZ LYS A 14 -0.872 -8.133 13.016 1.00 0.00 N ATOM 0 H LYS A 14 0.151 -2.686 10.167 1.00 0.00 H new ATOM 0 HA LYS A 14 2.494 -4.219 10.628 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.165 -4.642 9.846 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.815 -5.244 8.524 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.617 -6.991 9.758 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.942 -5.976 11.149 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.714 -5.972 11.398 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.615 -7.419 10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.988 -8.426 12.053 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.899 -6.977 13.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.590 -8.682 13.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.481 -7.343 13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.394 -8.747 12.359 1.00 0.00 H new ATOM 195 N MET A 15 2.158 -2.950 7.616 1.00 0.00 N ATOM 196 CA MET A 15 2.892 -2.614 6.408 1.00 0.00 C ATOM 197 C MET A 15 4.140 -1.791 6.735 1.00 0.00 C ATOM 198 O MET A 15 5.188 -1.973 6.116 1.00 0.00 O ATOM 199 CB MET A 15 1.988 -1.818 5.465 1.00 0.00 C ATOM 200 CG MET A 15 0.689 -2.575 5.182 1.00 0.00 C ATOM 201 SD MET A 15 0.762 -3.330 3.566 1.00 0.00 S ATOM 202 CE MET A 15 -0.061 -2.074 2.600 1.00 0.00 C ATOM 0 H MET A 15 1.180 -2.661 7.615 1.00 0.00 H new ATOM 0 HA MET A 15 3.206 -3.541 5.928 1.00 0.00 H new ATOM 0 HB2 MET A 15 1.759 -0.848 5.907 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.512 -1.626 4.529 1.00 0.00 H new ATOM 0 HG2 MET A 15 0.531 -3.339 5.943 1.00 0.00 H new ATOM 0 HG3 MET A 15 -0.159 -1.892 5.235 1.00 0.00 H new ATOM 0 HE1 MET A 15 -0.571 -2.540 1.757 1.00 0.00 H new ATOM 0 HE2 MET A 15 -0.789 -1.555 3.223 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.674 -1.360 2.230 1.00 0.00 H new ATOM 212 N HIS A 16 3.987 -0.904 7.707 1.00 0.00 N ATOM 213 CA HIS A 16 5.088 -0.053 8.123 1.00 0.00 C ATOM 214 C HIS A 16 6.266 -0.920 8.570 1.00 0.00 C ATOM 215 O HIS A 16 7.414 -0.479 8.536 1.00 0.00 O ATOM 216 CB HIS A 16 4.634 0.933 9.203 1.00 0.00 C ATOM 217 CG HIS A 16 4.093 2.233 8.659 1.00 0.00 C ATOM 218 ND1 HIS A 16 2.911 2.517 8.040 1.00 0.00 N flip ATOM 219 CD2 HIS A 16 4.796 3.423 8.723 1.00 0.00 C flip ATOM 220 CE1 HIS A 16 2.893 3.811 7.744 1.00 0.00 C flip ATOM 221 NE2 HIS A 16 4.061 4.374 8.166 1.00 0.00 N flip ATOM 0 H HIS A 16 3.117 -0.756 8.218 1.00 0.00 H new ATOM 0 HA HIS A 16 5.425 0.550 7.280 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.866 0.459 9.814 1.00 0.00 H new ATOM 0 HB3 HIS A 16 5.476 1.149 9.861 1.00 0.00 H new ATOM 0 HD2 HIS A 16 5.778 3.554 9.154 1.00 0.00 H new ATOM 0 HE1 HIS A 16 2.086 4.332 7.250 1.00 0.00 H new ATOM 0 HE2 HIS A 16 4.323 5.355 8.070 1.00 0.00 H new ATOM 229 N ASP A 17 5.942 -2.138 8.978 1.00 0.00 N ATOM 230 CA ASP A 17 6.960 -3.071 9.430 1.00 0.00 C ATOM 231 C ASP A 17 7.646 -3.699 8.216 1.00 0.00 C ATOM 232 O ASP A 17 7.136 -3.619 7.099 1.00 0.00 O ATOM 233 CB ASP A 17 6.344 -4.199 10.261 1.00 0.00 C ATOM 234 CG ASP A 17 7.276 -4.819 11.303 1.00 0.00 C ATOM 235 OD1 ASP A 17 8.484 -4.919 10.995 1.00 0.00 O ATOM 236 OD2 ASP A 17 6.761 -5.178 12.383 1.00 0.00 O ATOM 0 H ASP A 17 4.989 -2.500 9.005 1.00 0.00 H new ATOM 0 HA ASP A 17 7.674 -2.520 10.043 1.00 0.00 H new ATOM 0 HB2 ASP A 17 5.460 -3.814 10.770 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.006 -4.985 9.585 1.00 0.00 H new ATOM 241 N THR A 18 8.793 -4.311 8.474 1.00 0.00 N ATOM 242 CA THR A 18 9.554 -4.953 7.416 1.00 0.00 C ATOM 243 C THR A 18 9.628 -6.463 7.652 1.00 0.00 C ATOM 244 O THR A 18 9.607 -7.245 6.703 1.00 0.00 O ATOM 245 CB THR A 18 10.927 -4.281 7.347 1.00 0.00 C ATOM 246 OG1 THR A 18 11.535 -4.852 6.192 1.00 0.00 O ATOM 247 CG2 THR A 18 11.843 -4.701 8.497 1.00 0.00 C ATOM 0 H THR A 18 9.214 -4.376 9.401 1.00 0.00 H new ATOM 0 HA THR A 18 9.067 -4.831 6.449 1.00 0.00 H new ATOM 0 HB THR A 18 10.802 -3.198 7.360 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.430 -4.471 6.071 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.804 -4.195 8.400 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.383 -4.428 9.447 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.996 -5.780 8.465 1.00 0.00 H new ATOM 255 N SER A 19 9.712 -6.827 8.923 1.00 0.00 N ATOM 256 CA SER A 19 9.789 -8.229 9.296 1.00 0.00 C ATOM 257 C SER A 19 8.512 -8.955 8.869 1.00 0.00 C ATOM 258 O SER A 19 8.567 -9.912 8.097 1.00 0.00 O ATOM 259 CB SER A 19 10.011 -8.387 10.802 1.00 0.00 C ATOM 260 OG SER A 19 11.396 -8.435 11.135 1.00 0.00 O ATOM 0 H SER A 19 9.728 -6.175 9.707 1.00 0.00 H new ATOM 0 HA SER A 19 10.641 -8.673 8.782 1.00 0.00 H new ATOM 0 HB2 SER A 19 9.540 -7.556 11.327 1.00 0.00 H new ATOM 0 HB3 SER A 19 9.523 -9.299 11.147 1.00 0.00 H new ATOM 0 HG SER A 19 11.496 -8.535 12.105 1.00 0.00 H new ATOM 266 N THR A 20 7.393 -8.473 9.389 1.00 0.00 N ATOM 267 CA THR A 20 6.105 -9.064 9.070 1.00 0.00 C ATOM 268 C THR A 20 5.343 -8.182 8.079 1.00 0.00 C ATOM 269 O THR A 20 4.422 -8.647 7.409 1.00 0.00 O ATOM 270 CB THR A 20 5.352 -9.292 10.383 1.00 0.00 C ATOM 271 OG1 THR A 20 5.245 -7.990 10.953 1.00 0.00 O ATOM 272 CG2 THR A 20 6.178 -10.079 11.402 1.00 0.00 C ATOM 0 H THR A 20 7.352 -7.680 10.029 1.00 0.00 H new ATOM 0 HA THR A 20 6.224 -10.027 8.574 1.00 0.00 H new ATOM 0 HB THR A 20 4.423 -9.824 10.181 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.768 -8.045 11.807 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.598 -10.213 12.315 1.00 0.00 H new ATOM 0 HG22 THR A 20 6.433 -11.054 10.988 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.092 -9.531 11.630 1.00 0.00 H new ATOM 280 N GLY A 21 5.757 -6.925 8.016 1.00 0.00 N ATOM 281 CA GLY A 21 5.126 -5.973 7.117 1.00 0.00 C ATOM 282 C GLY A 21 5.511 -6.254 5.663 1.00 0.00 C ATOM 283 O GLY A 21 6.116 -7.282 5.365 1.00 0.00 O ATOM 0 H GLY A 21 6.522 -6.543 8.573 1.00 0.00 H new ATOM 0 HA2 GLY A 21 4.043 -6.026 7.227 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.424 -4.960 7.387 1.00 0.00 H new ATOM 287 N ILE A 22 5.145 -5.320 4.797 1.00 0.00 N ATOM 288 CA ILE A 22 5.445 -5.453 3.382 1.00 0.00 C ATOM 289 C ILE A 22 6.931 -5.169 3.151 1.00 0.00 C ATOM 290 O ILE A 22 7.656 -4.836 4.087 1.00 0.00 O ATOM 291 CB ILE A 22 4.513 -4.569 2.551 1.00 0.00 C ATOM 292 CG1 ILE A 22 4.311 -5.149 1.150 1.00 0.00 C ATOM 293 CG2 ILE A 22 5.022 -3.127 2.506 1.00 0.00 C ATOM 294 CD1 ILE A 22 2.834 -5.124 0.754 1.00 0.00 C ATOM 0 H ILE A 22 4.643 -4.468 5.048 1.00 0.00 H new ATOM 0 HA ILE A 22 5.260 -6.474 3.048 1.00 0.00 H new ATOM 0 HB ILE A 22 3.537 -4.552 3.036 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.894 -4.577 0.428 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.682 -6.173 1.120 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.342 -2.519 1.909 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.072 -2.727 3.519 1.00 0.00 H new ATOM 0 HG23 ILE A 22 6.015 -3.106 2.058 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.718 -5.542 -0.246 1.00 0.00 H new ATOM 0 HD12 ILE A 22 2.257 -5.717 1.464 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.473 -4.096 0.762 1.00 0.00 H new ATOM 306 N ARG A 23 7.340 -5.312 1.899 1.00 0.00 N ATOM 307 CA ARG A 23 8.726 -5.075 1.533 1.00 0.00 C ATOM 308 C ARG A 23 8.820 -4.621 0.074 1.00 0.00 C ATOM 309 O ARG A 23 8.897 -5.448 -0.833 1.00 0.00 O ATOM 310 CB ARG A 23 9.569 -6.337 1.722 1.00 0.00 C ATOM 311 CG ARG A 23 9.648 -6.727 3.199 1.00 0.00 C ATOM 312 CD ARG A 23 10.947 -7.478 3.499 1.00 0.00 C ATOM 313 NE ARG A 23 10.657 -8.697 4.287 1.00 0.00 N ATOM 314 CZ ARG A 23 11.491 -9.740 4.390 1.00 0.00 C ATOM 315 NH1 ARG A 23 12.672 -9.720 3.757 1.00 0.00 N ATOM 316 NH2 ARG A 23 11.145 -10.805 5.127 1.00 0.00 N ATOM 0 H ARG A 23 6.736 -5.589 1.125 1.00 0.00 H new ATOM 0 HA ARG A 23 9.112 -4.293 2.186 1.00 0.00 H new ATOM 0 HB2 ARG A 23 9.137 -7.157 1.148 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.573 -6.170 1.332 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.590 -5.832 3.819 1.00 0.00 H new ATOM 0 HG3 ARG A 23 8.794 -7.352 3.460 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.444 -7.747 2.567 1.00 0.00 H new ATOM 0 HD3 ARG A 23 11.631 -6.833 4.051 1.00 0.00 H new ATOM 0 HE ARG A 23 9.767 -8.746 4.782 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.936 -8.910 3.196 1.00 0.00 H new ATOM 0 HH12 ARG A 23 13.307 -10.515 3.836 1.00 0.00 H new ATOM 0 HH21 ARG A 23 10.246 -10.821 5.609 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.780 -11.599 5.205 1.00 0.00 H new ATOM 330 N PRO A 24 8.809 -3.274 -0.110 1.00 0.00 N ATOM 331 CA PRO A 24 8.892 -2.700 -1.443 1.00 0.00 C ATOM 332 C PRO A 24 10.316 -2.799 -1.994 1.00 0.00 C ATOM 333 O PRO A 24 11.133 -1.907 -1.776 1.00 0.00 O ATOM 334 CB PRO A 24 8.415 -1.266 -1.284 1.00 0.00 C ATOM 335 CG PRO A 24 8.525 -0.952 0.199 1.00 0.00 C ATOM 336 CD PRO A 24 8.718 -2.264 0.941 1.00 0.00 C ATOM 0 HA PRO A 24 8.277 -3.232 -2.169 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.026 -0.583 -1.874 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.388 -1.155 -1.631 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.364 -0.281 0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.626 -0.444 0.549 1.00 0.00 H new ATOM 0 HD2 PRO A 24 9.621 -2.245 1.551 1.00 0.00 H new ATOM 0 HD3 PRO A 24 7.884 -2.466 1.613 1.00 0.00 H new ATOM 344 N SER A 25 10.568 -3.893 -2.699 1.00 0.00 N ATOM 345 CA SER A 25 11.879 -4.120 -3.284 1.00 0.00 C ATOM 346 C SER A 25 11.803 -3.984 -4.806 1.00 0.00 C ATOM 347 O SER A 25 11.373 -4.907 -5.495 1.00 0.00 O ATOM 348 CB SER A 25 12.421 -5.498 -2.900 1.00 0.00 C ATOM 349 OG SER A 25 13.324 -5.429 -1.800 1.00 0.00 O ATOM 0 H SER A 25 9.887 -4.631 -2.878 1.00 0.00 H new ATOM 0 HA SER A 25 12.564 -3.368 -2.893 1.00 0.00 H new ATOM 0 HB2 SER A 25 11.590 -6.156 -2.646 1.00 0.00 H new ATOM 0 HB3 SER A 25 12.928 -5.940 -3.758 1.00 0.00 H new ATOM 0 HG SER A 25 13.646 -6.329 -1.584 1.00 0.00 H new ATOM 355 N PRO A 26 12.240 -2.794 -5.299 1.00 0.00 N ATOM 356 CA PRO A 26 12.226 -2.525 -6.727 1.00 0.00 C ATOM 357 C PRO A 26 13.356 -3.272 -7.436 1.00 0.00 C ATOM 358 O PRO A 26 13.106 -4.075 -8.334 1.00 0.00 O ATOM 359 CB PRO A 26 12.348 -1.014 -6.843 1.00 0.00 C ATOM 360 CG PRO A 26 12.891 -0.535 -5.507 1.00 0.00 C ATOM 361 CD PRO A 26 12.756 -1.677 -4.513 1.00 0.00 C ATOM 0 HA PRO A 26 11.316 -2.877 -7.213 1.00 0.00 H new ATOM 0 HB2 PRO A 26 13.017 -0.738 -7.658 1.00 0.00 H new ATOM 0 HB3 PRO A 26 11.381 -0.560 -7.057 1.00 0.00 H new ATOM 0 HG2 PRO A 26 13.934 -0.235 -5.604 1.00 0.00 H new ATOM 0 HG3 PRO A 26 12.339 0.339 -5.162 1.00 0.00 H new ATOM 0 HD2 PRO A 26 13.716 -1.922 -4.059 1.00 0.00 H new ATOM 0 HD3 PRO A 26 12.077 -1.417 -3.701 1.00 0.00 H new ATOM 369 N ASN A 27 14.575 -2.983 -7.007 1.00 0.00 N ATOM 370 CA ASN A 27 15.745 -3.618 -7.590 1.00 0.00 C ATOM 371 C ASN A 27 15.561 -3.721 -9.106 1.00 0.00 C ATOM 372 O ASN A 27 15.665 -4.807 -9.674 1.00 0.00 O ATOM 373 CB ASN A 27 15.936 -5.032 -7.039 1.00 0.00 C ATOM 374 CG ASN A 27 16.490 -4.995 -5.613 1.00 0.00 C ATOM 375 OD1 ASN A 27 16.996 -3.990 -5.142 1.00 0.00 O ATOM 376 ND2 ASN A 27 16.366 -6.144 -4.955 1.00 0.00 N ATOM 0 H ASN A 27 14.779 -2.317 -6.262 1.00 0.00 H new ATOM 0 HA ASN A 27 16.617 -3.014 -7.340 1.00 0.00 H new ATOM 0 HB2 ASN A 27 14.983 -5.562 -7.049 1.00 0.00 H new ATOM 0 HB3 ASN A 27 16.617 -5.588 -7.683 1.00 0.00 H new ATOM 0 HD21 ASN A 27 16.705 -6.222 -3.996 1.00 0.00 H new ATOM 0 HD22 ASN A 27 15.932 -6.948 -5.409 1.00 0.00 H new ATOM 383 N MET A 28 15.291 -2.577 -9.716 1.00 0.00 N ATOM 384 CA MET A 28 15.092 -2.525 -11.155 1.00 0.00 C ATOM 385 C MET A 28 14.252 -3.711 -11.635 1.00 0.00 C ATOM 386 O MET A 28 14.703 -4.502 -12.462 1.00 0.00 O ATOM 387 CB MET A 28 16.450 -2.543 -11.859 1.00 0.00 C ATOM 388 CG MET A 28 16.476 -1.554 -13.026 1.00 0.00 C ATOM 389 SD MET A 28 17.160 -2.337 -14.476 1.00 0.00 S ATOM 390 CE MET A 28 15.680 -3.060 -15.165 1.00 0.00 C ATOM 0 H MET A 28 15.205 -1.679 -9.241 1.00 0.00 H new ATOM 0 HA MET A 28 14.560 -1.605 -11.397 1.00 0.00 H new ATOM 0 HB2 MET A 28 17.236 -2.291 -11.147 1.00 0.00 H new ATOM 0 HB3 MET A 28 16.661 -3.548 -12.225 1.00 0.00 H new ATOM 0 HG2 MET A 28 15.467 -1.200 -13.236 1.00 0.00 H new ATOM 0 HG3 MET A 28 17.071 -0.680 -12.760 1.00 0.00 H new ATOM 0 HE1 MET A 28 15.824 -4.133 -15.291 1.00 0.00 H new ATOM 0 HE2 MET A 28 14.841 -2.883 -14.492 1.00 0.00 H new ATOM 0 HE3 MET A 28 15.470 -2.606 -16.133 1.00 0.00 H new ATOM 400 N GLU A 29 13.045 -3.796 -11.096 1.00 0.00 N ATOM 401 CA GLU A 29 12.137 -4.871 -11.459 1.00 0.00 C ATOM 402 C GLU A 29 12.070 -5.018 -12.980 1.00 0.00 C ATOM 403 O GLU A 29 12.411 -6.068 -13.522 1.00 0.00 O ATOM 404 CB GLU A 29 10.746 -4.637 -10.868 1.00 0.00 C ATOM 405 CG GLU A 29 10.490 -5.568 -9.681 1.00 0.00 C ATOM 406 CD GLU A 29 9.963 -6.925 -10.151 1.00 0.00 C ATOM 407 OE1 GLU A 29 8.863 -6.932 -10.745 1.00 0.00 O ATOM 408 OE2 GLU A 29 10.673 -7.925 -9.907 1.00 0.00 O ATOM 0 H GLU A 29 12.674 -3.138 -10.410 1.00 0.00 H new ATOM 0 HA GLU A 29 12.521 -5.801 -11.041 1.00 0.00 H new ATOM 0 HB2 GLU A 29 10.653 -3.599 -10.547 1.00 0.00 H new ATOM 0 HB3 GLU A 29 9.989 -4.803 -11.634 1.00 0.00 H new ATOM 0 HG2 GLU A 29 11.413 -5.708 -9.118 1.00 0.00 H new ATOM 0 HG3 GLU A 29 9.770 -5.109 -9.003 1.00 0.00 H new ATOM 415 N GLN A 30 11.627 -3.949 -13.626 1.00 0.00 N ATOM 416 CA GLN A 30 11.510 -3.946 -15.075 1.00 0.00 C ATOM 417 C GLN A 30 11.349 -2.514 -15.591 1.00 0.00 C ATOM 418 O GLN A 30 10.229 -2.035 -15.761 1.00 0.00 O ATOM 419 CB GLN A 30 10.347 -4.828 -15.533 1.00 0.00 C ATOM 420 CG GLN A 30 10.295 -4.917 -17.059 1.00 0.00 C ATOM 421 CD GLN A 30 9.675 -6.241 -17.511 1.00 0.00 C ATOM 422 OE1 GLN A 30 9.983 -7.306 -17.001 1.00 0.00 O ATOM 423 NE2 GLN A 30 8.787 -6.116 -18.493 1.00 0.00 N ATOM 0 H GLN A 30 11.345 -3.080 -13.173 1.00 0.00 H new ATOM 0 HA GLN A 30 12.426 -4.362 -15.495 1.00 0.00 H new ATOM 0 HB2 GLN A 30 10.455 -5.827 -15.110 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.408 -4.422 -15.157 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.713 -4.085 -17.456 1.00 0.00 H new ATOM 0 HG3 GLN A 30 11.302 -4.825 -17.467 1.00 0.00 H new ATOM 0 HE21 GLN A 30 8.575 -5.194 -18.875 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.318 -6.942 -18.864 1.00 0.00 H new ATOM 432 N GLY A 31 12.484 -1.872 -15.825 1.00 0.00 N ATOM 433 CA GLY A 31 12.482 -0.506 -16.318 1.00 0.00 C ATOM 434 C GLY A 31 11.883 0.450 -15.284 1.00 0.00 C ATOM 435 O GLY A 31 10.935 0.098 -14.584 1.00 0.00 O ATOM 0 H GLY A 31 13.411 -2.273 -15.682 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.501 -0.200 -16.554 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.910 -0.451 -17.244 1.00 0.00 H new ATOM 439 N SER A 32 12.462 1.640 -15.219 1.00 0.00 N ATOM 440 CA SER A 32 11.998 2.649 -14.283 1.00 0.00 C ATOM 441 C SER A 32 12.085 2.114 -12.852 1.00 0.00 C ATOM 442 O SER A 32 11.127 1.535 -12.342 1.00 0.00 O ATOM 443 CB SER A 32 10.564 3.078 -14.602 1.00 0.00 C ATOM 444 OG SER A 32 10.489 3.826 -15.813 1.00 0.00 O ATOM 0 H SER A 32 13.249 1.928 -15.800 1.00 0.00 H new ATOM 0 HA SER A 32 12.640 3.524 -14.377 1.00 0.00 H new ATOM 0 HB2 SER A 32 9.930 2.195 -14.681 1.00 0.00 H new ATOM 0 HB3 SER A 32 10.173 3.678 -13.780 1.00 0.00 H new ATOM 0 HG SER A 32 9.558 4.080 -15.983 1.00 0.00 H new ATOM 450 N THR A 33 13.243 2.326 -12.244 1.00 0.00 N ATOM 451 CA THR A 33 13.468 1.873 -10.882 1.00 0.00 C ATOM 452 C THR A 33 12.449 2.508 -9.934 1.00 0.00 C ATOM 453 O THR A 33 12.636 3.637 -9.482 1.00 0.00 O ATOM 454 CB THR A 33 14.919 2.185 -10.513 1.00 0.00 C ATOM 455 OG1 THR A 33 15.679 1.240 -11.262 1.00 0.00 O ATOM 456 CG2 THR A 33 15.238 1.849 -9.055 1.00 0.00 C ATOM 0 H THR A 33 14.036 2.806 -12.670 1.00 0.00 H new ATOM 0 HA THR A 33 13.320 0.797 -10.794 1.00 0.00 H new ATOM 0 HB THR A 33 15.120 3.241 -10.694 1.00 0.00 H new ATOM 0 HG1 THR A 33 16.633 1.373 -11.083 1.00 0.00 H new ATOM 0 HG21 THR A 33 16.280 2.090 -8.846 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.592 2.431 -8.398 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.069 0.786 -8.881 1.00 0.00 H new ATOM 464 N TYR A 34 11.394 1.755 -9.659 1.00 0.00 N ATOM 465 CA TYR A 34 10.346 2.231 -8.772 1.00 0.00 C ATOM 466 C TYR A 34 10.906 2.553 -7.385 1.00 0.00 C ATOM 467 O TYR A 34 11.645 1.755 -6.810 1.00 0.00 O ATOM 468 CB TYR A 34 9.343 1.082 -8.651 1.00 0.00 C ATOM 469 CG TYR A 34 8.941 0.462 -9.991 1.00 0.00 C ATOM 470 CD1 TYR A 34 7.964 1.059 -10.761 1.00 0.00 C ATOM 471 CD2 TYR A 34 9.556 -0.693 -10.428 1.00 0.00 C ATOM 472 CE1 TYR A 34 7.586 0.476 -12.023 1.00 0.00 C ATOM 473 CE2 TYR A 34 9.178 -1.276 -11.690 1.00 0.00 C ATOM 474 CZ TYR A 34 8.212 -0.663 -12.424 1.00 0.00 C ATOM 475 OH TYR A 34 7.855 -1.214 -13.615 1.00 0.00 O ATOM 0 H TYR A 34 11.242 0.819 -10.035 1.00 0.00 H new ATOM 0 HA TYR A 34 9.893 3.141 -9.165 1.00 0.00 H new ATOM 0 HB2 TYR A 34 9.771 0.305 -8.017 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.447 1.447 -8.148 1.00 0.00 H new ATOM 0 HD1 TYR A 34 7.483 1.963 -10.418 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.320 -1.160 -9.824 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.823 0.933 -12.636 1.00 0.00 H new ATOM 0 HE2 TYR A 34 9.651 -2.180 -12.045 1.00 0.00 H new ATOM 0 HH TYR A 34 8.657 -1.373 -14.156 1.00 0.00 H new ATOM 485 N LYS A 35 10.532 3.722 -6.888 1.00 0.00 N ATOM 486 CA LYS A 35 10.987 4.159 -5.579 1.00 0.00 C ATOM 487 C LYS A 35 10.066 3.579 -4.504 1.00 0.00 C ATOM 488 O LYS A 35 8.918 4.002 -4.370 1.00 0.00 O ATOM 489 CB LYS A 35 11.102 5.684 -5.533 1.00 0.00 C ATOM 490 CG LYS A 35 12.109 6.190 -6.568 1.00 0.00 C ATOM 491 CD LYS A 35 11.952 7.694 -6.797 1.00 0.00 C ATOM 492 CE LYS A 35 13.137 8.255 -7.586 1.00 0.00 C ATOM 493 NZ LYS A 35 13.220 9.724 -7.422 1.00 0.00 N ATOM 0 H LYS A 35 9.919 4.381 -7.368 1.00 0.00 H new ATOM 0 HA LYS A 35 11.989 3.781 -5.378 1.00 0.00 H new ATOM 0 HB2 LYS A 35 10.126 6.132 -5.721 1.00 0.00 H new ATOM 0 HB3 LYS A 35 11.410 5.999 -4.536 1.00 0.00 H new ATOM 0 HG2 LYS A 35 13.123 5.974 -6.230 1.00 0.00 H new ATOM 0 HG3 LYS A 35 11.967 5.659 -7.509 1.00 0.00 H new ATOM 0 HD2 LYS A 35 11.026 7.888 -7.338 1.00 0.00 H new ATOM 0 HD3 LYS A 35 11.874 8.205 -5.838 1.00 0.00 H new ATOM 0 HE2 LYS A 35 14.062 7.792 -7.243 1.00 0.00 H new ATOM 0 HE3 LYS A 35 13.029 8.007 -8.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 14.029 10.089 -7.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.344 10.162 -7.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 13.345 9.954 -6.416 1.00 0.00 H new ATOM 507 N LYS A 36 10.603 2.620 -3.764 1.00 0.00 N ATOM 508 CA LYS A 36 9.844 1.978 -2.705 1.00 0.00 C ATOM 509 C LYS A 36 8.451 1.620 -3.227 1.00 0.00 C ATOM 510 O LYS A 36 7.511 2.401 -3.086 1.00 0.00 O ATOM 511 CB LYS A 36 9.824 2.856 -1.452 1.00 0.00 C ATOM 512 CG LYS A 36 11.052 2.593 -0.578 1.00 0.00 C ATOM 513 CD LYS A 36 11.408 3.827 0.253 1.00 0.00 C ATOM 514 CE LYS A 36 12.219 4.829 -0.571 1.00 0.00 C ATOM 515 NZ LYS A 36 13.658 4.725 -0.243 1.00 0.00 N ATOM 0 H LYS A 36 11.555 2.272 -3.877 1.00 0.00 H new ATOM 0 HA LYS A 36 10.322 1.046 -2.405 1.00 0.00 H new ATOM 0 HB2 LYS A 36 9.797 3.907 -1.740 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.917 2.659 -0.880 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.858 1.748 0.083 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.898 2.317 -1.207 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.496 4.302 0.614 1.00 0.00 H new ATOM 0 HD3 LYS A 36 11.980 3.526 1.131 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.068 4.641 -1.634 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.867 5.841 -0.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.194 5.412 -0.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.799 4.926 0.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.994 3.764 -0.455 1.00 0.00 H new ATOM 529 N THR A 37 8.362 0.438 -3.819 1.00 0.00 N ATOM 530 CA THR A 37 7.099 -0.034 -4.362 1.00 0.00 C ATOM 531 C THR A 37 7.004 -1.556 -4.246 1.00 0.00 C ATOM 532 O THR A 37 8.020 -2.249 -4.263 1.00 0.00 O ATOM 533 CB THR A 37 6.985 0.474 -5.801 1.00 0.00 C ATOM 534 OG1 THR A 37 8.245 0.152 -6.384 1.00 0.00 O ATOM 535 CG2 THR A 37 6.918 2.001 -5.880 1.00 0.00 C ATOM 0 H THR A 37 9.144 -0.207 -3.935 1.00 0.00 H new ATOM 0 HA THR A 37 6.254 0.357 -3.795 1.00 0.00 H new ATOM 0 HB THR A 37 6.097 0.047 -6.267 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.203 -0.744 -6.780 1.00 0.00 H new ATOM 0 HG21 THR A 37 6.838 2.308 -6.923 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.047 2.356 -5.329 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.821 2.428 -5.444 1.00 0.00 H new ATOM 543 N PHE A 38 5.773 -2.033 -4.131 1.00 0.00 N ATOM 544 CA PHE A 38 5.531 -3.461 -4.012 1.00 0.00 C ATOM 545 C PHE A 38 4.525 -3.936 -5.062 1.00 0.00 C ATOM 546 O PHE A 38 3.493 -3.300 -5.271 1.00 0.00 O ATOM 547 CB PHE A 38 4.948 -3.701 -2.618 1.00 0.00 C ATOM 548 CG PHE A 38 3.742 -2.820 -2.288 1.00 0.00 C ATOM 549 CD1 PHE A 38 2.494 -3.205 -2.669 1.00 0.00 C ATOM 550 CD2 PHE A 38 3.917 -1.651 -1.614 1.00 0.00 C ATOM 551 CE1 PHE A 38 1.374 -2.387 -2.362 1.00 0.00 C ATOM 552 CE2 PHE A 38 2.797 -0.834 -1.308 1.00 0.00 C ATOM 553 CZ PHE A 38 1.550 -1.219 -1.688 1.00 0.00 C ATOM 0 H PHE A 38 4.932 -1.456 -4.118 1.00 0.00 H new ATOM 0 HA PHE A 38 6.460 -4.010 -4.164 1.00 0.00 H new ATOM 0 HB2 PHE A 38 4.655 -4.747 -2.533 1.00 0.00 H new ATOM 0 HB3 PHE A 38 5.726 -3.527 -1.875 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.355 -4.132 -3.205 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.908 -1.345 -1.312 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.383 -2.693 -2.664 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.936 0.094 -0.773 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.699 -0.597 -1.455 1.00 0.00 H new ATOM 563 N LEU A 39 4.861 -5.050 -5.695 1.00 0.00 N ATOM 564 CA LEU A 39 3.999 -5.618 -6.718 1.00 0.00 C ATOM 565 C LEU A 39 2.580 -5.760 -6.163 1.00 0.00 C ATOM 566 O LEU A 39 2.397 -5.965 -4.964 1.00 0.00 O ATOM 567 CB LEU A 39 4.586 -6.929 -7.246 1.00 0.00 C ATOM 568 CG LEU A 39 6.068 -6.894 -7.629 1.00 0.00 C ATOM 569 CD1 LEU A 39 6.518 -8.239 -8.202 1.00 0.00 C ATOM 570 CD2 LEU A 39 6.360 -5.736 -8.586 1.00 0.00 C ATOM 0 H LEU A 39 5.718 -5.575 -5.520 1.00 0.00 H new ATOM 0 HA LEU A 39 3.940 -4.952 -7.579 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.445 -7.699 -6.487 1.00 0.00 H new ATOM 0 HB3 LEU A 39 4.012 -7.235 -8.121 1.00 0.00 H new ATOM 0 HG LEU A 39 6.651 -6.719 -6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.574 -8.187 -8.466 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.368 -9.020 -7.457 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.933 -8.469 -9.092 1.00 0.00 H new ATOM 0 HD21 LEU A 39 7.419 -5.734 -8.842 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.768 -5.855 -9.493 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.101 -4.793 -8.105 1.00 0.00 H new ATOM 582 N GLY A 40 1.613 -5.645 -7.062 1.00 0.00 N ATOM 583 CA GLY A 40 0.217 -5.758 -6.677 1.00 0.00 C ATOM 584 C GLY A 40 -0.054 -7.094 -5.982 1.00 0.00 C ATOM 585 O GLY A 40 -0.766 -7.143 -4.980 1.00 0.00 O ATOM 0 H GLY A 40 1.769 -5.475 -8.055 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.048 -4.937 -6.011 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.416 -5.668 -7.560 1.00 0.00 H new ATOM 589 N SER A 41 0.529 -8.144 -6.541 1.00 0.00 N ATOM 590 CA SER A 41 0.359 -9.477 -5.987 1.00 0.00 C ATOM 591 C SER A 41 0.994 -9.551 -4.597 1.00 0.00 C ATOM 592 O SER A 41 0.456 -10.197 -3.699 1.00 0.00 O ATOM 593 CB SER A 41 0.969 -10.537 -6.906 1.00 0.00 C ATOM 594 OG SER A 41 0.838 -11.850 -6.368 1.00 0.00 O ATOM 0 H SER A 41 1.119 -8.099 -7.372 1.00 0.00 H new ATOM 0 HA SER A 41 -0.709 -9.679 -5.903 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.483 -10.495 -7.881 1.00 0.00 H new ATOM 0 HB3 SER A 41 2.024 -10.314 -7.066 1.00 0.00 H new ATOM 0 HG SER A 41 1.238 -12.498 -6.985 1.00 0.00 H new ATOM 600 N SER A 42 2.129 -8.880 -4.463 1.00 0.00 N ATOM 601 CA SER A 42 2.842 -8.862 -3.198 1.00 0.00 C ATOM 602 C SER A 42 1.907 -8.406 -2.076 1.00 0.00 C ATOM 603 O SER A 42 1.888 -9.000 -0.999 1.00 0.00 O ATOM 604 CB SER A 42 4.069 -7.950 -3.270 1.00 0.00 C ATOM 605 OG SER A 42 5.101 -8.372 -2.383 1.00 0.00 O ATOM 0 H SER A 42 2.572 -8.345 -5.210 1.00 0.00 H new ATOM 0 HA SER A 42 3.187 -9.874 -2.986 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.451 -7.937 -4.291 1.00 0.00 H new ATOM 0 HB3 SER A 42 3.776 -6.929 -3.026 1.00 0.00 H new ATOM 0 HG SER A 42 5.867 -7.765 -2.460 1.00 0.00 H new ATOM 611 N LEU A 43 1.154 -7.355 -2.367 1.00 0.00 N ATOM 612 CA LEU A 43 0.219 -6.813 -1.396 1.00 0.00 C ATOM 613 C LEU A 43 -0.889 -7.835 -1.136 1.00 0.00 C ATOM 614 O LEU A 43 -1.090 -8.261 0.001 1.00 0.00 O ATOM 615 CB LEU A 43 -0.299 -5.448 -1.856 1.00 0.00 C ATOM 616 CG LEU A 43 -1.419 -4.837 -1.012 1.00 0.00 C ATOM 617 CD1 LEU A 43 -1.186 -5.095 0.478 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.585 -3.347 -1.317 1.00 0.00 C ATOM 0 H LEU A 43 1.173 -6.865 -3.261 1.00 0.00 H new ATOM 0 HA LEU A 43 0.719 -6.635 -0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.538 -4.750 -1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.655 -5.543 -2.882 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.355 -5.327 -1.281 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.996 -4.650 1.055 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.157 -6.169 0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.238 -4.650 0.781 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.388 -2.937 -0.704 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.655 -2.824 -1.094 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.831 -3.217 -2.371 1.00 0.00 H new ATOM 630 N VAL A 44 -1.578 -8.199 -2.207 1.00 0.00 N ATOM 631 CA VAL A 44 -2.661 -9.163 -2.108 1.00 0.00 C ATOM 632 C VAL A 44 -2.224 -10.324 -1.213 1.00 0.00 C ATOM 633 O VAL A 44 -2.777 -10.522 -0.133 1.00 0.00 O ATOM 634 CB VAL A 44 -3.089 -9.614 -3.506 1.00 0.00 C ATOM 635 CG1 VAL A 44 -4.107 -10.754 -3.427 1.00 0.00 C ATOM 636 CG2 VAL A 44 -3.643 -8.440 -4.316 1.00 0.00 C ATOM 0 H VAL A 44 -1.408 -7.844 -3.148 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.537 -8.708 -1.645 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.205 -9.989 -4.022 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -4.394 -11.056 -4.434 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.663 -11.603 -2.907 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.990 -10.417 -2.883 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.940 -8.788 -5.305 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.509 -8.021 -3.804 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.875 -7.673 -4.417 1.00 0.00 H new ATOM 646 N ASP A 45 -1.235 -11.062 -1.696 1.00 0.00 N ATOM 647 CA ASP A 45 -0.717 -12.199 -0.954 1.00 0.00 C ATOM 648 C ASP A 45 -0.454 -11.779 0.494 1.00 0.00 C ATOM 649 O ASP A 45 -0.870 -12.464 1.428 1.00 0.00 O ATOM 650 CB ASP A 45 0.603 -12.691 -1.550 1.00 0.00 C ATOM 651 CG ASP A 45 0.908 -14.171 -1.311 1.00 0.00 C ATOM 652 OD1 ASP A 45 0.065 -14.827 -0.662 1.00 0.00 O ATOM 653 OD2 ASP A 45 1.978 -14.613 -1.782 1.00 0.00 O ATOM 0 H ASP A 45 -0.779 -10.894 -2.593 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.455 -12.999 -1.004 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.590 -12.507 -2.624 1.00 0.00 H new ATOM 0 HB3 ASP A 45 1.416 -12.096 -1.134 1.00 0.00 H new ATOM 658 N TRP A 46 0.234 -10.656 0.636 1.00 0.00 N ATOM 659 CA TRP A 46 0.557 -10.137 1.954 1.00 0.00 C ATOM 660 C TRP A 46 -0.741 -10.056 2.761 1.00 0.00 C ATOM 661 O TRP A 46 -0.909 -10.773 3.746 1.00 0.00 O ATOM 662 CB TRP A 46 1.283 -8.794 1.852 1.00 0.00 C ATOM 663 CG TRP A 46 1.733 -8.226 3.200 1.00 0.00 C ATOM 664 CD1 TRP A 46 2.880 -8.461 3.852 1.00 0.00 C ATOM 665 CD2 TRP A 46 0.994 -7.313 4.038 1.00 0.00 C ATOM 666 NE1 TRP A 46 2.934 -7.769 5.045 1.00 0.00 N ATOM 667 CE2 TRP A 46 1.751 -7.049 5.162 1.00 0.00 C ATOM 668 CE3 TRP A 46 -0.272 -6.730 3.853 1.00 0.00 C ATOM 669 CZ2 TRP A 46 1.327 -6.196 6.188 1.00 0.00 C ATOM 670 CZ3 TRP A 46 -0.680 -5.880 4.888 1.00 0.00 C ATOM 671 CH2 TRP A 46 0.069 -5.604 6.025 1.00 0.00 C ATOM 0 H TRP A 46 0.577 -10.091 -0.141 1.00 0.00 H new ATOM 0 HA TRP A 46 1.248 -10.802 2.472 1.00 0.00 H new ATOM 0 HB2 TRP A 46 2.156 -8.912 1.210 1.00 0.00 H new ATOM 0 HB3 TRP A 46 0.625 -8.073 1.367 1.00 0.00 H new ATOM 0 HD1 TRP A 46 3.663 -9.110 3.490 1.00 0.00 H new ATOM 0 HE1 TRP A 46 3.701 -7.783 5.717 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.881 -6.922 2.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 1.937 -6.005 7.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.646 -5.405 4.796 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -0.318 -4.936 6.780 1.00 0.00 H new ATOM 682 N LEU A 47 -1.624 -9.176 2.313 1.00 0.00 N ATOM 683 CA LEU A 47 -2.901 -8.992 2.981 1.00 0.00 C ATOM 684 C LEU A 47 -3.436 -10.352 3.434 1.00 0.00 C ATOM 685 O LEU A 47 -3.881 -10.501 4.571 1.00 0.00 O ATOM 686 CB LEU A 47 -3.869 -8.218 2.083 1.00 0.00 C ATOM 687 CG LEU A 47 -3.717 -6.696 2.088 1.00 0.00 C ATOM 688 CD1 LEU A 47 -4.486 -6.064 0.926 1.00 0.00 C ATOM 689 CD2 LEU A 47 -4.133 -6.107 3.438 1.00 0.00 C ATOM 0 H LEU A 47 -1.480 -8.583 1.496 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.778 -8.383 3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.746 -8.572 1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.888 -8.463 2.385 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.663 -6.458 1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.361 -4.982 0.953 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.101 -6.450 -0.018 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.544 -6.309 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.015 -5.024 3.414 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.176 -6.354 3.637 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.505 -6.523 4.226 1.00 0.00 H new ATOM 701 N ILE A 48 -3.376 -11.309 2.520 1.00 0.00 N ATOM 702 CA ILE A 48 -3.849 -12.652 2.811 1.00 0.00 C ATOM 703 C ILE A 48 -3.015 -13.246 3.949 1.00 0.00 C ATOM 704 O ILE A 48 -3.564 -13.732 4.937 1.00 0.00 O ATOM 705 CB ILE A 48 -3.853 -13.506 1.541 1.00 0.00 C ATOM 706 CG1 ILE A 48 -4.724 -12.870 0.456 1.00 0.00 C ATOM 707 CG2 ILE A 48 -4.278 -14.943 1.848 1.00 0.00 C ATOM 708 CD1 ILE A 48 -4.440 -13.495 -0.911 1.00 0.00 C ATOM 0 H ILE A 48 -3.007 -11.181 1.578 1.00 0.00 H new ATOM 0 HA ILE A 48 -4.884 -12.626 3.153 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.835 -13.547 1.154 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.777 -12.999 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.535 -11.797 0.416 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.272 -15.528 0.929 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.583 -15.383 2.563 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.282 -14.943 2.272 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.072 -13.025 -1.664 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.392 -13.343 -1.170 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.653 -14.563 -0.874 1.00 0.00 H new ATOM 720 N SER A 49 -1.704 -13.188 3.772 1.00 0.00 N ATOM 721 CA SER A 49 -0.790 -13.714 4.771 1.00 0.00 C ATOM 722 C SER A 49 -0.979 -12.973 6.096 1.00 0.00 C ATOM 723 O SER A 49 -0.713 -13.523 7.163 1.00 0.00 O ATOM 724 CB SER A 49 0.663 -13.601 4.303 1.00 0.00 C ATOM 725 OG SER A 49 1.585 -13.837 5.363 1.00 0.00 O ATOM 0 H SER A 49 -1.252 -12.785 2.951 1.00 0.00 H new ATOM 0 HA SER A 49 -1.016 -14.770 4.917 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.842 -14.317 3.501 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.834 -12.608 3.888 1.00 0.00 H new ATOM 0 HG SER A 49 2.501 -13.757 5.024 1.00 0.00 H new ATOM 731 N SER A 50 -1.438 -11.735 5.984 1.00 0.00 N ATOM 732 CA SER A 50 -1.666 -10.912 7.160 1.00 0.00 C ATOM 733 C SER A 50 -2.953 -11.351 7.863 1.00 0.00 C ATOM 734 O SER A 50 -3.322 -10.790 8.894 1.00 0.00 O ATOM 735 CB SER A 50 -1.743 -9.430 6.789 1.00 0.00 C ATOM 736 OG SER A 50 -0.460 -8.810 6.800 1.00 0.00 O ATOM 0 H SER A 50 -1.658 -11.282 5.097 1.00 0.00 H new ATOM 0 HA SER A 50 -0.824 -11.045 7.839 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.187 -9.327 5.799 1.00 0.00 H new ATOM 0 HB3 SER A 50 -2.401 -8.915 7.489 1.00 0.00 H new ATOM 0 HG SER A 50 -0.530 -7.906 6.427 1.00 0.00 H new ATOM 742 N ASN A 51 -3.599 -12.348 7.278 1.00 0.00 N ATOM 743 CA ASN A 51 -4.835 -12.868 7.836 1.00 0.00 C ATOM 744 C ASN A 51 -5.924 -11.798 7.737 1.00 0.00 C ATOM 745 O ASN A 51 -6.923 -11.855 8.453 1.00 0.00 O ATOM 746 CB ASN A 51 -4.664 -13.233 9.312 1.00 0.00 C ATOM 747 CG ASN A 51 -5.861 -14.038 9.821 1.00 0.00 C ATOM 748 OD1 ASN A 51 -6.209 -15.082 9.294 1.00 0.00 O ATOM 749 ND2 ASN A 51 -6.470 -13.496 10.872 1.00 0.00 N ATOM 0 H ASN A 51 -3.290 -12.810 6.423 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.109 -13.761 7.274 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -3.750 -13.812 9.443 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.554 -12.325 9.904 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -7.280 -13.957 11.286 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -6.127 -12.619 11.264 1.00 0.00 H new ATOM 756 N PHE A 52 -5.694 -10.846 6.844 1.00 0.00 N ATOM 757 CA PHE A 52 -6.643 -9.765 6.643 1.00 0.00 C ATOM 758 C PHE A 52 -7.634 -10.105 5.527 1.00 0.00 C ATOM 759 O PHE A 52 -8.711 -9.517 5.449 1.00 0.00 O ATOM 760 CB PHE A 52 -5.835 -8.532 6.232 1.00 0.00 C ATOM 761 CG PHE A 52 -4.877 -8.028 7.313 1.00 0.00 C ATOM 762 CD1 PHE A 52 -4.923 -8.560 8.564 1.00 0.00 C ATOM 763 CD2 PHE A 52 -3.979 -7.048 7.023 1.00 0.00 C ATOM 764 CE1 PHE A 52 -4.033 -8.092 9.568 1.00 0.00 C ATOM 765 CE2 PHE A 52 -3.089 -6.581 8.026 1.00 0.00 C ATOM 766 CZ PHE A 52 -3.135 -7.112 9.278 1.00 0.00 C ATOM 0 H PHE A 52 -4.865 -10.801 6.252 1.00 0.00 H new ATOM 0 HA PHE A 52 -7.211 -9.594 7.557 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -5.263 -8.768 5.335 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -6.524 -7.730 5.969 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.636 -9.338 8.794 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.943 -6.625 6.030 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.069 -8.514 10.561 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -2.375 -5.804 7.795 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.459 -6.756 10.041 1.00 0.00 H new ATOM 776 N ALA A 53 -7.233 -11.053 4.693 1.00 0.00 N ATOM 777 CA ALA A 53 -8.073 -11.478 3.586 1.00 0.00 C ATOM 778 C ALA A 53 -8.107 -13.007 3.536 1.00 0.00 C ATOM 779 O ALA A 53 -7.223 -13.670 4.076 1.00 0.00 O ATOM 780 CB ALA A 53 -7.551 -10.864 2.285 1.00 0.00 C ATOM 0 H ALA A 53 -6.339 -11.538 4.761 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.096 -11.129 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.181 -11.182 1.454 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.573 -9.777 2.361 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.527 -11.195 2.112 1.00 0.00 H new ATOM 786 N ALA A 54 -9.139 -13.523 2.883 1.00 0.00 N ATOM 787 CA ALA A 54 -9.300 -14.961 2.756 1.00 0.00 C ATOM 788 C ALA A 54 -8.841 -15.400 1.364 1.00 0.00 C ATOM 789 O ALA A 54 -8.298 -16.492 1.201 1.00 0.00 O ATOM 790 CB ALA A 54 -10.757 -15.338 3.035 1.00 0.00 C ATOM 0 H ALA A 54 -9.871 -12.971 2.437 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.682 -15.483 3.487 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.878 -16.417 2.940 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -11.025 -15.030 4.046 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.407 -14.835 2.318 1.00 0.00 H new ATOM 796 N SER A 55 -9.077 -14.528 0.395 1.00 0.00 N ATOM 797 CA SER A 55 -8.694 -14.812 -0.978 1.00 0.00 C ATOM 798 C SER A 55 -8.190 -13.536 -1.655 1.00 0.00 C ATOM 799 O SER A 55 -8.455 -12.432 -1.183 1.00 0.00 O ATOM 800 CB SER A 55 -9.866 -15.404 -1.764 1.00 0.00 C ATOM 801 OG SER A 55 -9.473 -16.536 -2.535 1.00 0.00 O ATOM 0 H SER A 55 -9.529 -13.624 0.533 1.00 0.00 H new ATOM 0 HA SER A 55 -7.891 -15.549 -0.965 1.00 0.00 H new ATOM 0 HB2 SER A 55 -10.657 -15.693 -1.072 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.282 -14.642 -2.424 1.00 0.00 H new ATOM 0 HG SER A 55 -10.249 -16.886 -3.021 1.00 0.00 H new ATOM 807 N ARG A 56 -7.473 -13.731 -2.752 1.00 0.00 N ATOM 808 CA ARG A 56 -6.929 -12.610 -3.499 1.00 0.00 C ATOM 809 C ARG A 56 -7.948 -11.470 -3.563 1.00 0.00 C ATOM 810 O ARG A 56 -7.578 -10.298 -3.518 1.00 0.00 O ATOM 811 CB ARG A 56 -6.552 -13.027 -4.922 1.00 0.00 C ATOM 812 CG ARG A 56 -5.222 -13.785 -4.937 1.00 0.00 C ATOM 813 CD ARG A 56 -5.453 -15.295 -5.006 1.00 0.00 C ATOM 814 NE ARG A 56 -5.189 -15.909 -3.685 1.00 0.00 N ATOM 815 CZ ARG A 56 -5.543 -17.158 -3.353 1.00 0.00 C ATOM 816 NH1 ARG A 56 -6.178 -17.933 -4.241 1.00 0.00 N ATOM 817 NH2 ARG A 56 -5.262 -17.631 -2.131 1.00 0.00 N ATOM 0 H ARG A 56 -7.256 -14.649 -3.141 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.031 -12.272 -2.981 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.338 -13.656 -5.341 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.478 -12.144 -5.556 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -4.627 -13.465 -5.792 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.650 -13.541 -4.041 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -6.478 -15.501 -5.313 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.800 -15.737 -5.759 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.708 -15.346 -2.984 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -6.393 -17.573 -5.171 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -6.447 -18.884 -3.988 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.779 -17.040 -1.454 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.531 -18.582 -1.878 1.00 0.00 H new ATOM 831 N LEU A 57 -9.212 -11.854 -3.667 1.00 0.00 N ATOM 832 CA LEU A 57 -10.287 -10.880 -3.737 1.00 0.00 C ATOM 833 C LEU A 57 -10.264 -10.009 -2.479 1.00 0.00 C ATOM 834 O LEU A 57 -9.965 -8.818 -2.549 1.00 0.00 O ATOM 835 CB LEU A 57 -11.628 -11.577 -3.977 1.00 0.00 C ATOM 836 CG LEU A 57 -12.605 -10.851 -4.905 1.00 0.00 C ATOM 837 CD1 LEU A 57 -13.342 -9.736 -4.160 1.00 0.00 C ATOM 838 CD2 LEU A 57 -11.891 -10.331 -6.154 1.00 0.00 C ATOM 0 H LEU A 57 -9.515 -12.827 -3.704 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.142 -10.215 -4.589 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -11.432 -12.566 -4.391 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -12.115 -11.725 -3.013 1.00 0.00 H new ATOM 0 HG LEU A 57 -13.356 -11.567 -5.238 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -14.030 -9.236 -4.842 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -13.902 -10.163 -3.328 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.620 -9.014 -3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.608 -9.819 -6.796 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -11.105 -9.635 -5.861 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -11.451 -11.168 -6.696 1.00 0.00 H new ATOM 850 N GLU A 58 -10.583 -10.638 -1.357 1.00 0.00 N ATOM 851 CA GLU A 58 -10.602 -9.935 -0.085 1.00 0.00 C ATOM 852 C GLU A 58 -9.375 -9.030 0.040 1.00 0.00 C ATOM 853 O GLU A 58 -9.446 -7.962 0.647 1.00 0.00 O ATOM 854 CB GLU A 58 -10.679 -10.919 1.084 1.00 0.00 C ATOM 855 CG GLU A 58 -12.117 -11.389 1.311 1.00 0.00 C ATOM 856 CD GLU A 58 -12.168 -12.523 2.337 1.00 0.00 C ATOM 857 OE1 GLU A 58 -11.650 -12.302 3.453 1.00 0.00 O ATOM 858 OE2 GLU A 58 -12.724 -13.585 1.982 1.00 0.00 O ATOM 0 H GLU A 58 -10.830 -11.626 -1.302 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.495 -9.310 -0.051 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -10.039 -11.778 0.883 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.301 -10.444 1.989 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.726 -10.554 1.656 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.546 -11.728 0.368 1.00 0.00 H new ATOM 865 N ALA A 59 -8.278 -9.490 -0.544 1.00 0.00 N ATOM 866 CA ALA A 59 -7.037 -8.736 -0.505 1.00 0.00 C ATOM 867 C ALA A 59 -7.096 -7.611 -1.540 1.00 0.00 C ATOM 868 O ALA A 59 -6.670 -6.490 -1.269 1.00 0.00 O ATOM 869 CB ALA A 59 -5.857 -9.681 -0.738 1.00 0.00 C ATOM 0 H ALA A 59 -8.223 -10.376 -1.047 1.00 0.00 H new ATOM 0 HA ALA A 59 -6.898 -8.277 0.474 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.926 -9.115 -0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.842 -10.444 0.041 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.960 -10.159 -1.712 1.00 0.00 H new ATOM 875 N VAL A 60 -7.629 -7.950 -2.705 1.00 0.00 N ATOM 876 CA VAL A 60 -7.750 -6.983 -3.783 1.00 0.00 C ATOM 877 C VAL A 60 -8.532 -5.766 -3.285 1.00 0.00 C ATOM 878 O VAL A 60 -8.153 -4.627 -3.555 1.00 0.00 O ATOM 879 CB VAL A 60 -8.386 -7.642 -5.009 1.00 0.00 C ATOM 880 CG1 VAL A 60 -8.857 -6.589 -6.014 1.00 0.00 C ATOM 881 CG2 VAL A 60 -7.420 -8.632 -5.662 1.00 0.00 C ATOM 0 H VAL A 60 -7.982 -8.881 -2.926 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.766 -6.632 -4.094 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.261 -8.200 -4.675 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.305 -7.083 -6.876 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.596 -5.941 -5.543 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.006 -5.991 -6.340 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.897 -9.086 -6.531 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.518 -8.107 -5.976 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.156 -9.409 -4.945 1.00 0.00 H new ATOM 891 N THR A 61 -9.608 -6.048 -2.566 1.00 0.00 N ATOM 892 CA THR A 61 -10.447 -4.991 -2.027 1.00 0.00 C ATOM 893 C THR A 61 -9.736 -4.283 -0.872 1.00 0.00 C ATOM 894 O THR A 61 -9.812 -3.061 -0.747 1.00 0.00 O ATOM 895 CB THR A 61 -11.789 -5.608 -1.628 1.00 0.00 C ATOM 896 OG1 THR A 61 -12.651 -5.301 -2.721 1.00 0.00 O ATOM 897 CG2 THR A 61 -12.430 -4.896 -0.436 1.00 0.00 C ATOM 0 H THR A 61 -9.919 -6.994 -2.344 1.00 0.00 H new ATOM 0 HA THR A 61 -10.638 -4.219 -2.772 1.00 0.00 H new ATOM 0 HB THR A 61 -11.646 -6.661 -1.387 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.544 -5.666 -2.546 1.00 0.00 H new ATOM 0 HG21 THR A 61 -13.380 -5.374 -0.195 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.764 -4.956 0.425 1.00 0.00 H new ATOM 0 HG23 THR A 61 -12.604 -3.850 -0.688 1.00 0.00 H new ATOM 905 N LEU A 62 -9.063 -5.080 -0.056 1.00 0.00 N ATOM 906 CA LEU A 62 -8.339 -4.545 1.085 1.00 0.00 C ATOM 907 C LEU A 62 -7.256 -3.584 0.591 1.00 0.00 C ATOM 908 O LEU A 62 -6.983 -2.569 1.230 1.00 0.00 O ATOM 909 CB LEU A 62 -7.803 -5.680 1.959 1.00 0.00 C ATOM 910 CG LEU A 62 -8.603 -5.986 3.227 1.00 0.00 C ATOM 911 CD1 LEU A 62 -9.130 -7.422 3.209 1.00 0.00 C ATOM 912 CD2 LEU A 62 -7.776 -5.695 4.481 1.00 0.00 C ATOM 0 H LEU A 62 -9.004 -6.093 -0.162 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.008 -3.970 1.725 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.757 -6.586 1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.780 -5.437 2.248 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.469 -5.325 3.252 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.695 -7.614 4.121 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.779 -7.561 2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.292 -8.116 3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.368 -5.921 5.368 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.879 -6.314 4.477 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.491 -4.643 4.493 1.00 0.00 H new ATOM 924 N ALA A 63 -6.667 -3.939 -0.541 1.00 0.00 N ATOM 925 CA ALA A 63 -5.619 -3.120 -1.128 1.00 0.00 C ATOM 926 C ALA A 63 -6.211 -1.779 -1.566 1.00 0.00 C ATOM 927 O ALA A 63 -5.767 -0.724 -1.115 1.00 0.00 O ATOM 928 CB ALA A 63 -4.969 -3.877 -2.288 1.00 0.00 C ATOM 0 H ALA A 63 -6.895 -4.782 -1.068 1.00 0.00 H new ATOM 0 HA ALA A 63 -4.839 -2.913 -0.396 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.183 -3.263 -2.728 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.538 -4.808 -1.919 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.722 -4.100 -3.044 1.00 0.00 H new ATOM 934 N SER A 64 -7.204 -1.863 -2.439 1.00 0.00 N ATOM 935 CA SER A 64 -7.860 -0.669 -2.942 1.00 0.00 C ATOM 936 C SER A 64 -8.344 0.194 -1.775 1.00 0.00 C ATOM 937 O SER A 64 -8.414 1.417 -1.890 1.00 0.00 O ATOM 938 CB SER A 64 -9.033 -1.029 -3.857 1.00 0.00 C ATOM 939 OG SER A 64 -10.237 -1.238 -3.125 1.00 0.00 O ATOM 0 H SER A 64 -7.570 -2.740 -2.811 1.00 0.00 H new ATOM 0 HA SER A 64 -7.136 -0.103 -3.529 1.00 0.00 H new ATOM 0 HB2 SER A 64 -9.184 -0.230 -4.583 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.790 -1.930 -4.420 1.00 0.00 H new ATOM 0 HG SER A 64 -10.063 -1.845 -2.376 1.00 0.00 H new ATOM 945 N MET A 65 -8.665 -0.476 -0.678 1.00 0.00 N ATOM 946 CA MET A 65 -9.139 0.214 0.509 1.00 0.00 C ATOM 947 C MET A 65 -8.031 1.071 1.125 1.00 0.00 C ATOM 948 O MET A 65 -8.256 2.231 1.467 1.00 0.00 O ATOM 949 CB MET A 65 -9.623 -0.811 1.537 1.00 0.00 C ATOM 950 CG MET A 65 -11.060 -1.248 1.240 1.00 0.00 C ATOM 951 SD MET A 65 -12.077 -1.026 2.690 1.00 0.00 S ATOM 952 CE MET A 65 -11.744 -2.561 3.540 1.00 0.00 C ATOM 0 H MET A 65 -8.606 -1.490 -0.587 1.00 0.00 H new ATOM 0 HA MET A 65 -9.961 0.869 0.221 1.00 0.00 H new ATOM 0 HB2 MET A 65 -8.965 -1.680 1.527 1.00 0.00 H new ATOM 0 HB3 MET A 65 -9.569 -0.382 2.537 1.00 0.00 H new ATOM 0 HG2 MET A 65 -11.462 -0.666 0.411 1.00 0.00 H new ATOM 0 HG3 MET A 65 -11.075 -2.293 0.932 1.00 0.00 H new ATOM 0 HE1 MET A 65 -11.894 -2.424 4.611 1.00 0.00 H new ATOM 0 HE2 MET A 65 -12.421 -3.334 3.174 1.00 0.00 H new ATOM 0 HE3 MET A 65 -10.713 -2.864 3.354 1.00 0.00 H new ATOM 962 N LEU A 66 -6.859 0.466 1.248 1.00 0.00 N ATOM 963 CA LEU A 66 -5.716 1.159 1.817 1.00 0.00 C ATOM 964 C LEU A 66 -5.404 2.397 0.975 1.00 0.00 C ATOM 965 O LEU A 66 -5.158 3.474 1.516 1.00 0.00 O ATOM 966 CB LEU A 66 -4.530 0.203 1.967 1.00 0.00 C ATOM 967 CG LEU A 66 -4.789 -1.064 2.785 1.00 0.00 C ATOM 968 CD1 LEU A 66 -3.925 -2.224 2.287 1.00 0.00 C ATOM 969 CD2 LEU A 66 -4.590 -0.802 4.279 1.00 0.00 C ATOM 0 H LEU A 66 -6.676 -0.496 0.963 1.00 0.00 H new ATOM 0 HA LEU A 66 -5.945 1.507 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.199 -0.093 0.971 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.706 0.747 2.428 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.830 -1.354 2.645 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.128 -3.112 2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.158 -2.429 1.242 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.872 -1.959 2.378 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.780 -1.718 4.838 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.566 -0.474 4.458 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.282 -0.026 4.608 1.00 0.00 H new ATOM 981 N MET A 67 -5.426 2.203 -0.335 1.00 0.00 N ATOM 982 CA MET A 67 -5.149 3.291 -1.258 1.00 0.00 C ATOM 983 C MET A 67 -6.114 4.458 -1.035 1.00 0.00 C ATOM 984 O MET A 67 -5.707 5.618 -1.064 1.00 0.00 O ATOM 985 CB MET A 67 -5.280 2.787 -2.696 1.00 0.00 C ATOM 986 CG MET A 67 -4.060 1.956 -3.100 1.00 0.00 C ATOM 987 SD MET A 67 -3.761 2.121 -4.852 1.00 0.00 S ATOM 988 CE MET A 67 -5.374 1.689 -5.483 1.00 0.00 C ATOM 0 H MET A 67 -5.631 1.308 -0.780 1.00 0.00 H new ATOM 0 HA MET A 67 -4.134 3.645 -1.079 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.183 2.184 -2.793 1.00 0.00 H new ATOM 0 HB3 MET A 67 -5.388 3.634 -3.373 1.00 0.00 H new ATOM 0 HG2 MET A 67 -3.184 2.285 -2.541 1.00 0.00 H new ATOM 0 HG3 MET A 67 -4.224 0.908 -2.848 1.00 0.00 H new ATOM 0 HE1 MET A 67 -5.317 1.550 -6.563 1.00 0.00 H new ATOM 0 HE2 MET A 67 -5.712 0.764 -5.015 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.079 2.489 -5.257 1.00 0.00 H new ATOM 998 N GLU A 68 -7.373 4.109 -0.819 1.00 0.00 N ATOM 999 CA GLU A 68 -8.399 5.112 -0.591 1.00 0.00 C ATOM 1000 C GLU A 68 -8.122 5.870 0.709 1.00 0.00 C ATOM 1001 O GLU A 68 -8.243 7.093 0.757 1.00 0.00 O ATOM 1002 CB GLU A 68 -9.791 4.478 -0.570 1.00 0.00 C ATOM 1003 CG GLU A 68 -10.511 4.688 -1.904 1.00 0.00 C ATOM 1004 CD GLU A 68 -11.708 5.627 -1.739 1.00 0.00 C ATOM 1005 OE1 GLU A 68 -12.373 5.519 -0.686 1.00 0.00 O ATOM 1006 OE2 GLU A 68 -11.930 6.431 -2.670 1.00 0.00 O ATOM 0 H GLU A 68 -7.706 3.145 -0.797 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.372 5.824 -1.416 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -9.705 3.411 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.380 4.913 0.237 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -9.817 5.103 -2.635 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.848 3.728 -2.294 1.00 0.00 H new ATOM 1013 N GLU A 69 -7.755 5.111 1.731 1.00 0.00 N ATOM 1014 CA GLU A 69 -7.460 5.696 3.028 1.00 0.00 C ATOM 1015 C GLU A 69 -6.248 6.625 2.928 1.00 0.00 C ATOM 1016 O GLU A 69 -5.941 7.354 3.870 1.00 0.00 O ATOM 1017 CB GLU A 69 -7.232 4.609 4.081 1.00 0.00 C ATOM 1018 CG GLU A 69 -8.563 4.071 4.609 1.00 0.00 C ATOM 1019 CD GLU A 69 -8.691 4.306 6.116 1.00 0.00 C ATOM 1020 OE1 GLU A 69 -8.931 5.475 6.489 1.00 0.00 O ATOM 1021 OE2 GLU A 69 -8.545 3.313 6.860 1.00 0.00 O ATOM 0 H GLU A 69 -7.655 4.097 1.687 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.321 6.286 3.343 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.652 3.794 3.648 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.646 5.014 4.906 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.388 4.559 4.090 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.638 3.005 4.396 1.00 0.00 H new ATOM 1028 N ASN A 70 -5.592 6.568 1.779 1.00 0.00 N ATOM 1029 CA ASN A 70 -4.421 7.394 1.543 1.00 0.00 C ATOM 1030 C ASN A 70 -3.183 6.689 2.101 1.00 0.00 C ATOM 1031 O ASN A 70 -2.196 7.337 2.445 1.00 0.00 O ATOM 1032 CB ASN A 70 -4.551 8.747 2.247 1.00 0.00 C ATOM 1033 CG ASN A 70 -3.908 9.860 1.418 1.00 0.00 C ATOM 1034 OD1 ASN A 70 -2.742 9.811 1.063 1.00 0.00 O ATOM 1035 ND2 ASN A 70 -4.731 10.865 1.130 1.00 0.00 N ATOM 0 H ASN A 70 -5.850 5.962 1.000 1.00 0.00 H new ATOM 0 HA ASN A 70 -4.332 7.553 0.468 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -5.604 8.975 2.414 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.076 8.698 3.227 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -4.396 11.657 0.581 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -5.696 10.844 1.458 1.00 0.00 H new ATOM 1042 N PHE A 71 -3.276 5.369 2.174 1.00 0.00 N ATOM 1043 CA PHE A 71 -2.177 4.568 2.684 1.00 0.00 C ATOM 1044 C PHE A 71 -1.305 4.042 1.541 1.00 0.00 C ATOM 1045 O PHE A 71 -0.209 3.536 1.775 1.00 0.00 O ATOM 1046 CB PHE A 71 -2.794 3.381 3.426 1.00 0.00 C ATOM 1047 CG PHE A 71 -3.561 3.770 4.692 1.00 0.00 C ATOM 1048 CD1 PHE A 71 -3.075 4.741 5.511 1.00 0.00 C ATOM 1049 CD2 PHE A 71 -4.729 3.145 4.999 1.00 0.00 C ATOM 1050 CE1 PHE A 71 -3.786 5.102 6.685 1.00 0.00 C ATOM 1051 CE2 PHE A 71 -5.441 3.505 6.173 1.00 0.00 C ATOM 1052 CZ PHE A 71 -4.954 4.477 6.992 1.00 0.00 C ATOM 0 H PHE A 71 -4.096 4.834 1.888 1.00 0.00 H new ATOM 0 HA PHE A 71 -1.548 5.173 3.337 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.469 2.855 2.751 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.002 2.681 3.694 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.147 5.238 5.268 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -5.115 2.374 4.349 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -3.399 5.873 7.335 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -6.368 3.008 6.416 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.495 4.752 7.885 1.00 0.00 H new ATOM 1062 N LEU A 72 -1.826 4.180 0.331 1.00 0.00 N ATOM 1063 CA LEU A 72 -1.110 3.724 -0.848 1.00 0.00 C ATOM 1064 C LEU A 72 -1.715 4.379 -2.092 1.00 0.00 C ATOM 1065 O LEU A 72 -2.766 5.013 -2.014 1.00 0.00 O ATOM 1066 CB LEU A 72 -1.089 2.196 -0.906 1.00 0.00 C ATOM 1067 CG LEU A 72 -2.189 1.480 -0.120 1.00 0.00 C ATOM 1068 CD1 LEU A 72 -2.825 0.368 -0.956 1.00 0.00 C ATOM 1069 CD2 LEU A 72 -1.658 0.959 1.217 1.00 0.00 C ATOM 0 H LEU A 72 -2.735 4.601 0.142 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.065 4.031 -0.801 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.159 1.891 -1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.123 1.851 -0.537 1.00 0.00 H new ATOM 0 HG LEU A 72 -2.973 2.203 0.105 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.604 -0.125 -0.374 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.262 0.796 -1.858 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.063 -0.360 -1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.460 0.454 1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.844 0.257 1.036 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.291 1.794 1.813 1.00 0.00 H new ATOM 1081 N ARG A 73 -1.026 4.201 -3.209 1.00 0.00 N ATOM 1082 CA ARG A 73 -1.483 4.766 -4.468 1.00 0.00 C ATOM 1083 C ARG A 73 -1.023 3.895 -5.639 1.00 0.00 C ATOM 1084 O ARG A 73 0.037 3.275 -5.576 1.00 0.00 O ATOM 1085 CB ARG A 73 -0.951 6.188 -4.659 1.00 0.00 C ATOM 1086 CG ARG A 73 0.561 6.243 -4.430 1.00 0.00 C ATOM 1087 CD ARG A 73 0.886 6.788 -3.038 1.00 0.00 C ATOM 1088 NE ARG A 73 2.225 7.419 -3.041 1.00 0.00 N ATOM 1089 CZ ARG A 73 2.459 8.680 -3.428 1.00 0.00 C ATOM 1090 NH1 ARG A 73 1.447 9.453 -3.844 1.00 0.00 N ATOM 1091 NH2 ARG A 73 3.707 9.169 -3.397 1.00 0.00 N ATOM 0 H ARG A 73 -0.155 3.674 -3.269 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.572 4.798 -4.441 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.183 6.535 -5.666 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.452 6.864 -3.966 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.986 5.245 -4.542 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.024 6.874 -5.189 1.00 0.00 H new ATOM 0 HD2 ARG A 73 0.132 7.516 -2.739 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.857 5.980 -2.306 1.00 0.00 H new ATOM 0 HE ARG A 73 3.019 6.859 -2.729 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.497 9.082 -3.866 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.626 10.413 -4.138 1.00 0.00 H new ATOM 0 HH21 ARG A 73 4.477 8.581 -3.079 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.886 10.129 -3.692 1.00 0.00 H new ATOM 1105 N PRO A 74 -1.864 3.877 -6.707 1.00 0.00 N ATOM 1106 CA PRO A 74 -1.555 3.093 -7.890 1.00 0.00 C ATOM 1107 C PRO A 74 -0.459 3.763 -8.721 1.00 0.00 C ATOM 1108 O PRO A 74 -0.588 4.926 -9.102 1.00 0.00 O ATOM 1109 CB PRO A 74 -2.874 2.969 -8.636 1.00 0.00 C ATOM 1110 CG PRO A 74 -3.767 4.071 -8.090 1.00 0.00 C ATOM 1111 CD PRO A 74 -3.128 4.600 -6.816 1.00 0.00 C ATOM 0 HA PRO A 74 -1.155 2.108 -7.649 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -2.727 3.082 -9.710 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -3.322 1.988 -8.477 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.878 4.871 -8.822 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.766 3.686 -7.885 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.965 5.676 -6.872 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.764 4.419 -5.949 1.00 0.00 H new ATOM 1119 N VAL A 75 0.594 3.002 -8.978 1.00 0.00 N ATOM 1120 CA VAL A 75 1.711 3.507 -9.757 1.00 0.00 C ATOM 1121 C VAL A 75 1.458 3.235 -11.241 1.00 0.00 C ATOM 1122 O VAL A 75 0.424 2.676 -11.606 1.00 0.00 O ATOM 1123 CB VAL A 75 3.020 2.897 -9.252 1.00 0.00 C ATOM 1124 CG1 VAL A 75 3.170 3.094 -7.742 1.00 0.00 C ATOM 1125 CG2 VAL A 75 3.114 1.416 -9.624 1.00 0.00 C ATOM 0 H VAL A 75 0.697 2.038 -8.660 1.00 0.00 H new ATOM 0 HA VAL A 75 1.803 4.586 -9.636 1.00 0.00 H new ATOM 0 HB VAL A 75 3.843 3.418 -9.741 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.109 2.651 -7.409 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.170 4.160 -7.512 1.00 0.00 H new ATOM 0 HG13 VAL A 75 2.339 2.612 -7.228 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.054 1.007 -9.253 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.281 0.875 -9.176 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.075 1.310 -10.708 1.00 0.00 H new ATOM 1135 N GLY A 76 2.419 3.641 -12.057 1.00 0.00 N ATOM 1136 CA GLY A 76 2.313 3.448 -13.493 1.00 0.00 C ATOM 1137 C GLY A 76 2.153 1.965 -13.837 1.00 0.00 C ATOM 1138 O GLY A 76 1.463 1.232 -13.130 1.00 0.00 O ATOM 0 H GLY A 76 3.275 4.103 -11.751 1.00 0.00 H new ATOM 0 HA2 GLY A 76 1.460 4.008 -13.877 1.00 0.00 H new ATOM 0 HA3 GLY A 76 3.202 3.845 -13.983 1.00 0.00 H new ATOM 1142 N VAL A 77 2.802 1.568 -14.921 1.00 0.00 N ATOM 1143 CA VAL A 77 2.741 0.186 -15.366 1.00 0.00 C ATOM 1144 C VAL A 77 1.279 -0.261 -15.425 1.00 0.00 C ATOM 1145 O VAL A 77 0.377 0.566 -15.548 1.00 0.00 O ATOM 1146 CB VAL A 77 3.600 -0.695 -14.458 1.00 0.00 C ATOM 1147 CG1 VAL A 77 5.005 -0.112 -14.298 1.00 0.00 C ATOM 1148 CG2 VAL A 77 2.931 -0.895 -13.096 1.00 0.00 C ATOM 0 H VAL A 77 3.373 2.179 -15.505 1.00 0.00 H new ATOM 0 HA VAL A 77 3.152 0.089 -16.371 1.00 0.00 H new ATOM 0 HB VAL A 77 3.695 -1.672 -14.932 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.595 -0.758 -13.648 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.484 -0.045 -15.275 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.938 0.883 -13.858 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.562 -1.525 -12.470 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.791 0.072 -12.614 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.962 -1.375 -13.234 1.00 0.00 H new ATOM 1158 N ARG A 78 1.090 -1.569 -15.335 1.00 0.00 N ATOM 1159 CA ARG A 78 -0.247 -2.137 -15.376 1.00 0.00 C ATOM 1160 C ARG A 78 -1.207 -1.296 -14.532 1.00 0.00 C ATOM 1161 O ARG A 78 -2.214 -0.803 -15.037 1.00 0.00 O ATOM 1162 CB ARG A 78 -0.251 -3.577 -14.858 1.00 0.00 C ATOM 1163 CG ARG A 78 0.425 -4.520 -15.856 1.00 0.00 C ATOM 1164 CD ARG A 78 -0.474 -4.769 -17.069 1.00 0.00 C ATOM 1165 NE ARG A 78 0.263 -5.540 -18.095 1.00 0.00 N ATOM 1166 CZ ARG A 78 -0.256 -5.910 -19.274 1.00 0.00 C ATOM 1167 NH1 ARG A 78 -1.518 -5.582 -19.583 1.00 0.00 N ATOM 1168 NH2 ARG A 78 0.487 -6.608 -20.144 1.00 0.00 N ATOM 0 H ARG A 78 1.841 -2.252 -15.234 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.575 -2.136 -16.415 1.00 0.00 H new ATOM 0 HB2 ARG A 78 0.266 -3.624 -13.900 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.277 -3.902 -14.683 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.372 -4.091 -16.183 1.00 0.00 H new ATOM 0 HG3 ARG A 78 0.655 -5.467 -15.368 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -1.367 -5.314 -16.764 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -0.808 -3.819 -17.486 1.00 0.00 H new ATOM 0 HE ARG A 78 1.226 -5.807 -17.892 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.084 -5.051 -18.921 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.913 -5.864 -20.480 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.448 -6.858 -19.909 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.092 -6.890 -21.041 1.00 0.00 H new ATOM 1182 N SER A 79 -0.861 -1.159 -13.260 1.00 0.00 N ATOM 1183 CA SER A 79 -1.679 -0.386 -12.341 1.00 0.00 C ATOM 1184 C SER A 79 -1.996 0.982 -12.946 1.00 0.00 C ATOM 1185 O SER A 79 -1.573 1.285 -14.061 1.00 0.00 O ATOM 1186 CB SER A 79 -0.982 -0.220 -10.989 1.00 0.00 C ATOM 1187 OG SER A 79 -0.641 -1.475 -10.407 1.00 0.00 O ATOM 0 H SER A 79 -0.025 -1.570 -12.844 1.00 0.00 H new ATOM 0 HA SER A 79 -2.611 -0.927 -12.175 1.00 0.00 H new ATOM 0 HB2 SER A 79 -0.079 0.377 -11.117 1.00 0.00 H new ATOM 0 HB3 SER A 79 -1.634 0.329 -10.310 1.00 0.00 H new ATOM 0 HG SER A 79 -0.294 -1.332 -9.502 1.00 0.00 H new ATOM 1193 N MET A 80 -2.738 1.773 -12.185 1.00 0.00 N ATOM 1194 CA MET A 80 -3.116 3.103 -12.632 1.00 0.00 C ATOM 1195 C MET A 80 -4.057 3.029 -13.836 1.00 0.00 C ATOM 1196 O MET A 80 -3.713 3.484 -14.926 1.00 0.00 O ATOM 1197 CB MET A 80 -1.861 3.890 -13.013 1.00 0.00 C ATOM 1198 CG MET A 80 -1.498 4.903 -11.924 1.00 0.00 C ATOM 1199 SD MET A 80 -1.018 6.453 -12.669 1.00 0.00 S ATOM 1200 CE MET A 80 -1.181 7.537 -11.259 1.00 0.00 C ATOM 0 H MET A 80 -3.088 1.518 -11.261 1.00 0.00 H new ATOM 0 HA MET A 80 -3.637 3.605 -11.817 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.029 3.203 -13.167 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.025 4.409 -13.957 1.00 0.00 H new ATOM 0 HG2 MET A 80 -2.349 5.057 -11.260 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.683 4.516 -11.313 1.00 0.00 H new ATOM 0 HE1 MET A 80 -0.917 8.554 -11.549 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.211 7.517 -10.902 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.515 7.202 -10.464 1.00 0.00 H new ATOM 1210 N GLY A 81 -5.226 2.452 -13.599 1.00 0.00 N ATOM 1211 CA GLY A 81 -6.219 2.313 -14.651 1.00 0.00 C ATOM 1212 C GLY A 81 -7.184 3.500 -14.654 1.00 0.00 C ATOM 1213 O GLY A 81 -6.882 4.548 -15.222 1.00 0.00 O ATOM 0 H GLY A 81 -5.508 2.075 -12.694 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.722 2.242 -15.618 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.776 1.387 -14.510 1.00 0.00 H new ATOM 1217 N ALA A 82 -8.326 3.295 -14.014 1.00 0.00 N ATOM 1218 CA ALA A 82 -9.337 4.335 -13.936 1.00 0.00 C ATOM 1219 C ALA A 82 -9.145 5.132 -12.644 1.00 0.00 C ATOM 1220 O ALA A 82 -9.771 6.174 -12.454 1.00 0.00 O ATOM 1221 CB ALA A 82 -10.728 3.703 -14.030 1.00 0.00 C ATOM 0 H ALA A 82 -8.573 2.424 -13.545 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.237 5.030 -14.770 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -11.487 4.483 -13.971 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -10.824 3.174 -14.978 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -10.865 3.001 -13.207 1.00 0.00 H new ATOM 1227 N ILE A 83 -8.277 4.611 -11.789 1.00 0.00 N ATOM 1228 CA ILE A 83 -7.994 5.261 -10.521 1.00 0.00 C ATOM 1229 C ILE A 83 -9.298 5.432 -9.739 1.00 0.00 C ATOM 1230 O ILE A 83 -10.384 5.329 -10.306 1.00 0.00 O ATOM 1231 CB ILE A 83 -7.236 6.571 -10.747 1.00 0.00 C ATOM 1232 CG1 ILE A 83 -6.123 6.388 -11.780 1.00 0.00 C ATOM 1233 CG2 ILE A 83 -6.706 7.132 -9.426 1.00 0.00 C ATOM 1234 CD1 ILE A 83 -4.988 5.530 -11.218 1.00 0.00 C ATOM 0 H ILE A 83 -7.761 3.746 -11.950 1.00 0.00 H new ATOM 0 HA ILE A 83 -7.336 4.640 -9.913 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.933 7.305 -11.151 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -6.528 5.919 -12.677 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -5.734 7.362 -12.077 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -6.171 8.063 -9.614 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.540 7.323 -8.751 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.028 6.410 -8.970 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -4.210 5.416 -11.973 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -4.569 6.014 -10.336 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.375 4.548 -10.944 1.00 0.00 H new ATOM 1246 N ARG A 84 -9.147 5.691 -8.448 1.00 0.00 N ATOM 1247 CA ARG A 84 -10.299 5.878 -7.582 1.00 0.00 C ATOM 1248 C ARG A 84 -10.870 7.287 -7.755 1.00 0.00 C ATOM 1249 O ARG A 84 -10.135 8.271 -7.681 1.00 0.00 O ATOM 1250 CB ARG A 84 -9.926 5.662 -6.114 1.00 0.00 C ATOM 1251 CG ARG A 84 -8.935 6.726 -5.638 1.00 0.00 C ATOM 1252 CD ARG A 84 -9.613 7.725 -4.698 1.00 0.00 C ATOM 1253 NE ARG A 84 -8.979 7.672 -3.362 1.00 0.00 N ATOM 1254 CZ ARG A 84 -7.850 8.318 -3.039 1.00 0.00 C ATOM 1255 NH1 ARG A 84 -7.224 9.070 -3.955 1.00 0.00 N ATOM 1256 NH2 ARG A 84 -7.347 8.212 -1.802 1.00 0.00 N ATOM 0 H ARG A 84 -8.244 5.776 -7.981 1.00 0.00 H new ATOM 0 HA ARG A 84 -11.050 5.141 -7.866 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -10.825 5.695 -5.498 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -9.490 4.671 -5.988 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -8.100 6.248 -5.125 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -8.521 7.253 -6.498 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -9.535 8.732 -5.107 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -10.675 7.496 -4.615 1.00 0.00 H new ATOM 0 HE ARG A 84 -9.430 7.108 -2.641 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -7.607 9.150 -4.897 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -6.365 9.562 -3.710 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -7.823 7.639 -1.105 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.488 8.704 -1.557 1.00 0.00 H new ATOM 1270 N SER A 85 -12.174 7.339 -7.980 1.00 0.00 N ATOM 1271 CA SER A 85 -12.852 8.611 -8.163 1.00 0.00 C ATOM 1272 C SER A 85 -13.749 8.905 -6.959 1.00 0.00 C ATOM 1273 O SER A 85 -14.911 9.274 -7.121 1.00 0.00 O ATOM 1274 CB SER A 85 -13.676 8.616 -9.452 1.00 0.00 C ATOM 1275 OG SER A 85 -14.317 9.870 -9.671 1.00 0.00 O ATOM 0 H SER A 85 -12.780 6.520 -8.040 1.00 0.00 H new ATOM 0 HA SER A 85 -12.096 9.392 -8.244 1.00 0.00 H new ATOM 0 HB2 SER A 85 -13.027 8.388 -10.298 1.00 0.00 H new ATOM 0 HB3 SER A 85 -14.428 7.828 -9.405 1.00 0.00 H new ATOM 0 HG SER A 85 -14.792 10.141 -8.858 1.00 0.00 H new ATOM 1281 N GLY A 86 -13.175 8.729 -5.778 1.00 0.00 N ATOM 1282 CA GLY A 86 -13.909 8.970 -4.546 1.00 0.00 C ATOM 1283 C GLY A 86 -15.053 7.967 -4.384 1.00 0.00 C ATOM 1284 O GLY A 86 -16.223 8.334 -4.478 1.00 0.00 O ATOM 0 H GLY A 86 -12.211 8.423 -5.647 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -13.232 8.896 -3.695 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -14.308 9.984 -4.549 1.00 0.00 H new ATOM 1288 N ASP A 87 -14.674 6.720 -4.143 1.00 0.00 N ATOM 1289 CA ASP A 87 -15.654 5.662 -3.967 1.00 0.00 C ATOM 1290 C ASP A 87 -15.008 4.495 -3.217 1.00 0.00 C ATOM 1291 O ASP A 87 -13.898 4.622 -2.702 1.00 0.00 O ATOM 1292 CB ASP A 87 -16.149 5.139 -5.317 1.00 0.00 C ATOM 1293 CG ASP A 87 -17.665 5.197 -5.516 1.00 0.00 C ATOM 1294 OD1 ASP A 87 -18.364 4.492 -4.757 1.00 0.00 O ATOM 1295 OD2 ASP A 87 -18.090 5.944 -6.424 1.00 0.00 O ATOM 0 H ASP A 87 -13.702 6.419 -4.066 1.00 0.00 H new ATOM 0 HA ASP A 87 -16.496 6.071 -3.408 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -15.671 5.714 -6.110 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -15.822 4.106 -5.432 1.00 0.00 H new ATOM 1300 N LEU A 88 -15.732 3.386 -3.178 1.00 0.00 N ATOM 1301 CA LEU A 88 -15.243 2.198 -2.499 1.00 0.00 C ATOM 1302 C LEU A 88 -14.860 1.143 -3.538 1.00 0.00 C ATOM 1303 O LEU A 88 -14.786 -0.045 -3.225 1.00 0.00 O ATOM 1304 CB LEU A 88 -16.268 1.707 -1.474 1.00 0.00 C ATOM 1305 CG LEU A 88 -15.716 1.352 -0.091 1.00 0.00 C ATOM 1306 CD1 LEU A 88 -14.524 0.400 -0.204 1.00 0.00 C ATOM 1307 CD2 LEU A 88 -15.369 2.614 0.701 1.00 0.00 C ATOM 0 H LEU A 88 -16.653 3.285 -3.605 1.00 0.00 H new ATOM 0 HA LEU A 88 -14.342 2.428 -1.930 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -17.029 2.478 -1.353 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -16.767 0.828 -1.881 1.00 0.00 H new ATOM 0 HG LEU A 88 -16.495 0.828 0.463 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -14.151 0.164 0.793 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -14.837 -0.518 -0.701 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -13.733 0.875 -0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -14.979 2.334 1.680 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -14.615 3.187 0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -16.265 3.222 0.828 1.00 0.00 H new ATOM 1319 N ALA A 89 -14.626 1.614 -4.754 1.00 0.00 N ATOM 1320 CA ALA A 89 -14.252 0.726 -5.842 1.00 0.00 C ATOM 1321 C ALA A 89 -13.100 -0.173 -5.387 1.00 0.00 C ATOM 1322 O ALA A 89 -12.509 0.054 -4.333 1.00 0.00 O ATOM 1323 CB ALA A 89 -13.892 1.554 -7.077 1.00 0.00 C ATOM 0 H ALA A 89 -14.688 2.599 -5.010 1.00 0.00 H new ATOM 0 HA ALA A 89 -15.087 0.081 -6.115 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.612 0.888 -7.893 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.752 2.153 -7.377 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.056 2.212 -6.842 1.00 0.00 H new ATOM 1329 N GLU A 90 -12.816 -1.176 -6.206 1.00 0.00 N ATOM 1330 CA GLU A 90 -11.746 -2.110 -5.901 1.00 0.00 C ATOM 1331 C GLU A 90 -10.698 -2.099 -7.016 1.00 0.00 C ATOM 1332 O GLU A 90 -10.058 -3.115 -7.281 1.00 0.00 O ATOM 1333 CB GLU A 90 -12.296 -3.521 -5.680 1.00 0.00 C ATOM 1334 CG GLU A 90 -12.737 -4.151 -7.002 1.00 0.00 C ATOM 1335 CD GLU A 90 -13.359 -5.530 -6.772 1.00 0.00 C ATOM 1336 OE1 GLU A 90 -12.645 -6.388 -6.211 1.00 0.00 O ATOM 1337 OE2 GLU A 90 -14.535 -5.693 -7.163 1.00 0.00 O ATOM 0 H GLU A 90 -13.308 -1.362 -7.080 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.267 -1.793 -4.975 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -11.533 -4.144 -5.213 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -13.141 -3.482 -4.992 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -13.459 -3.500 -7.496 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -11.880 -4.241 -7.670 1.00 0.00 H new ATOM 1344 N GLN A 91 -10.555 -0.938 -7.638 1.00 0.00 N ATOM 1345 CA GLN A 91 -9.596 -0.781 -8.718 1.00 0.00 C ATOM 1346 C GLN A 91 -8.206 -1.232 -8.263 1.00 0.00 C ATOM 1347 O GLN A 91 -7.415 -0.425 -7.780 1.00 0.00 O ATOM 1348 CB GLN A 91 -9.566 0.664 -9.219 1.00 0.00 C ATOM 1349 CG GLN A 91 -9.313 1.639 -8.067 1.00 0.00 C ATOM 1350 CD GLN A 91 -10.612 2.317 -7.628 1.00 0.00 C ATOM 1351 OE1 GLN A 91 -11.470 2.651 -8.428 1.00 0.00 O ATOM 1352 NE2 GLN A 91 -10.708 2.502 -6.314 1.00 0.00 N ATOM 0 H GLN A 91 -11.087 -0.097 -7.415 1.00 0.00 H new ATOM 0 HA GLN A 91 -9.908 -1.413 -9.550 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.786 0.775 -9.972 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -10.513 0.905 -9.703 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.874 1.105 -7.224 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -8.591 2.394 -8.377 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.952 2.198 -5.700 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -11.537 2.947 -5.921 1.00 0.00 H new ATOM 1361 N PHE A 92 -7.952 -2.521 -8.435 1.00 0.00 N ATOM 1362 CA PHE A 92 -6.672 -3.090 -8.049 1.00 0.00 C ATOM 1363 C PHE A 92 -6.445 -4.442 -8.728 1.00 0.00 C ATOM 1364 O PHE A 92 -7.387 -5.209 -8.923 1.00 0.00 O ATOM 1365 CB PHE A 92 -6.713 -3.294 -6.533 1.00 0.00 C ATOM 1366 CG PHE A 92 -5.339 -3.516 -5.898 1.00 0.00 C ATOM 1367 CD1 PHE A 92 -4.794 -4.762 -5.873 1.00 0.00 C ATOM 1368 CD2 PHE A 92 -4.662 -2.467 -5.358 1.00 0.00 C ATOM 1369 CE1 PHE A 92 -3.519 -4.968 -5.283 1.00 0.00 C ATOM 1370 CE2 PHE A 92 -3.386 -2.673 -4.769 1.00 0.00 C ATOM 1371 CZ PHE A 92 -2.842 -3.919 -4.744 1.00 0.00 C ATOM 0 H PHE A 92 -8.611 -3.188 -8.837 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.863 -2.424 -8.349 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -7.179 -2.423 -6.072 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.348 -4.151 -6.309 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.331 -5.595 -6.302 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -5.095 -1.478 -5.377 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.087 -5.958 -5.262 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.848 -1.840 -4.341 1.00 0.00 H new ATOM 0 HZ PHE A 92 -1.872 -4.076 -4.296 1.00 0.00 H new ATOM 1381 N LEU A 93 -5.190 -4.693 -9.070 1.00 0.00 N ATOM 1382 CA LEU A 93 -4.827 -5.939 -9.723 1.00 0.00 C ATOM 1383 C LEU A 93 -4.075 -6.829 -8.733 1.00 0.00 C ATOM 1384 O LEU A 93 -3.726 -6.389 -7.638 1.00 0.00 O ATOM 1385 CB LEU A 93 -4.051 -5.662 -11.013 1.00 0.00 C ATOM 1386 CG LEU A 93 -4.665 -4.624 -11.955 1.00 0.00 C ATOM 1387 CD1 LEU A 93 -3.578 -3.799 -12.645 1.00 0.00 C ATOM 1388 CD2 LEU A 93 -5.608 -5.287 -12.962 1.00 0.00 C ATOM 0 H LEU A 93 -4.412 -4.054 -8.907 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.721 -6.484 -10.026 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.047 -5.332 -10.746 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.944 -6.600 -11.558 1.00 0.00 H new ATOM 0 HG LEU A 93 -5.263 -3.934 -11.360 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.041 -3.069 -13.309 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.983 -3.280 -11.894 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.933 -4.459 -13.225 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.031 -4.527 -13.619 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.053 -6.013 -13.556 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.412 -5.793 -12.428 1.00 0.00 H new ATOM 1400 N ASP A 94 -3.846 -8.065 -9.152 1.00 0.00 N ATOM 1401 CA ASP A 94 -3.141 -9.021 -8.315 1.00 0.00 C ATOM 1402 C ASP A 94 -2.120 -9.781 -9.164 1.00 0.00 C ATOM 1403 O ASP A 94 -2.303 -10.962 -9.452 1.00 0.00 O ATOM 1404 CB ASP A 94 -4.107 -10.042 -7.711 1.00 0.00 C ATOM 1405 CG ASP A 94 -3.444 -11.278 -7.101 1.00 0.00 C ATOM 1406 OD1 ASP A 94 -2.577 -11.081 -6.222 1.00 0.00 O ATOM 1407 OD2 ASP A 94 -3.818 -12.392 -7.527 1.00 0.00 O ATOM 0 H ASP A 94 -4.136 -8.427 -10.061 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.651 -8.469 -7.513 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.699 -9.548 -6.940 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -4.801 -10.366 -8.487 1.00 0.00 H new ATOM 1412 N ASP A 95 -1.067 -9.071 -9.542 1.00 0.00 N ATOM 1413 CA ASP A 95 -0.017 -9.663 -10.352 1.00 0.00 C ATOM 1414 C ASP A 95 1.296 -8.917 -10.103 1.00 0.00 C ATOM 1415 O ASP A 95 1.291 -7.800 -9.590 1.00 0.00 O ATOM 1416 CB ASP A 95 -0.345 -9.557 -11.843 1.00 0.00 C ATOM 1417 CG ASP A 95 -0.654 -10.887 -12.533 1.00 0.00 C ATOM 1418 OD1 ASP A 95 0.157 -11.821 -12.353 1.00 0.00 O ATOM 1419 OD2 ASP A 95 -1.694 -10.940 -13.225 1.00 0.00 O ATOM 0 H ASP A 95 -0.919 -8.091 -9.302 1.00 0.00 H new ATOM 0 HA ASP A 95 0.070 -10.714 -10.075 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.202 -8.894 -11.965 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.497 -9.088 -12.352 1.00 0.00 H new ATOM 1424 N SER A 96 2.388 -9.566 -10.479 1.00 0.00 N ATOM 1425 CA SER A 96 3.705 -8.978 -10.303 1.00 0.00 C ATOM 1426 C SER A 96 3.762 -7.609 -10.982 1.00 0.00 C ATOM 1427 O SER A 96 4.067 -6.605 -10.340 1.00 0.00 O ATOM 1428 CB SER A 96 4.796 -9.894 -10.862 1.00 0.00 C ATOM 1429 OG SER A 96 4.584 -10.200 -12.237 1.00 0.00 O ATOM 0 H SER A 96 2.388 -10.493 -10.905 1.00 0.00 H new ATOM 0 HA SER A 96 3.884 -8.854 -9.235 1.00 0.00 H new ATOM 0 HB2 SER A 96 5.768 -9.415 -10.743 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.824 -10.818 -10.285 1.00 0.00 H new ATOM 0 HG SER A 96 5.302 -10.785 -12.556 1.00 0.00 H new ATOM 1435 N THR A 97 3.465 -7.612 -12.274 1.00 0.00 N ATOM 1436 CA THR A 97 3.478 -6.382 -13.047 1.00 0.00 C ATOM 1437 C THR A 97 2.952 -5.217 -12.207 1.00 0.00 C ATOM 1438 O THR A 97 3.712 -4.329 -11.824 1.00 0.00 O ATOM 1439 CB THR A 97 2.675 -6.620 -14.327 1.00 0.00 C ATOM 1440 OG1 THR A 97 1.445 -7.173 -13.867 1.00 0.00 O ATOM 1441 CG2 THR A 97 3.276 -7.723 -15.200 1.00 0.00 C ATOM 0 H THR A 97 3.214 -8.447 -12.804 1.00 0.00 H new ATOM 0 HA THR A 97 4.493 -6.104 -13.330 1.00 0.00 H new ATOM 0 HB THR A 97 2.622 -5.694 -14.899 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.929 -7.503 -14.632 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.667 -7.851 -16.095 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.291 -7.447 -15.487 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.299 -8.658 -14.640 1.00 0.00 H new ATOM 1449 N ALA A 98 1.654 -5.258 -11.944 1.00 0.00 N ATOM 1450 CA ALA A 98 1.016 -4.217 -11.156 1.00 0.00 C ATOM 1451 C ALA A 98 1.945 -3.810 -10.010 1.00 0.00 C ATOM 1452 O ALA A 98 2.663 -4.645 -9.461 1.00 0.00 O ATOM 1453 CB ALA A 98 -0.342 -4.714 -10.657 1.00 0.00 C ATOM 0 H ALA A 98 1.027 -5.996 -12.263 1.00 0.00 H new ATOM 0 HA ALA A 98 0.835 -3.331 -11.765 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -0.820 -3.933 -10.066 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.974 -4.963 -11.509 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -0.200 -5.601 -10.040 1.00 0.00 H new ATOM 1459 N LEU A 99 1.902 -2.526 -9.684 1.00 0.00 N ATOM 1460 CA LEU A 99 2.731 -1.998 -8.614 1.00 0.00 C ATOM 1461 C LEU A 99 1.881 -1.104 -7.710 1.00 0.00 C ATOM 1462 O LEU A 99 0.744 -0.776 -8.047 1.00 0.00 O ATOM 1463 CB LEU A 99 3.964 -1.298 -9.187 1.00 0.00 C ATOM 1464 CG LEU A 99 5.220 -2.160 -9.331 1.00 0.00 C ATOM 1465 CD1 LEU A 99 6.128 -1.626 -10.440 1.00 0.00 C ATOM 1466 CD2 LEU A 99 5.957 -2.282 -7.996 1.00 0.00 C ATOM 0 H LEU A 99 1.306 -1.836 -10.142 1.00 0.00 H new ATOM 0 HA LEU A 99 3.113 -2.808 -7.993 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.707 -0.899 -10.168 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.203 -0.447 -8.549 1.00 0.00 H new ATOM 0 HG LEU A 99 4.913 -3.164 -9.623 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.013 -2.257 -10.521 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.589 -1.634 -11.387 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.430 -0.606 -10.203 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.846 -2.900 -8.126 1.00 0.00 H new ATOM 0 HD22 LEU A 99 6.251 -1.291 -7.651 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.300 -2.743 -7.258 1.00 0.00 H new ATOM 1478 N TYR A 100 2.464 -0.735 -6.579 1.00 0.00 N ATOM 1479 CA TYR A 100 1.774 0.115 -5.623 1.00 0.00 C ATOM 1480 C TYR A 100 2.747 0.678 -4.586 1.00 0.00 C ATOM 1481 O TYR A 100 3.670 -0.014 -4.157 1.00 0.00 O ATOM 1482 CB TYR A 100 0.757 -0.783 -4.917 1.00 0.00 C ATOM 1483 CG TYR A 100 -0.453 -1.150 -5.778 1.00 0.00 C ATOM 1484 CD1 TYR A 100 -1.524 -0.285 -5.867 1.00 0.00 C ATOM 1485 CD2 TYR A 100 -0.474 -2.347 -6.465 1.00 0.00 C ATOM 1486 CE1 TYR A 100 -2.664 -0.630 -6.677 1.00 0.00 C ATOM 1487 CE2 TYR A 100 -1.613 -2.692 -7.275 1.00 0.00 C ATOM 1488 CZ TYR A 100 -2.652 -1.817 -7.341 1.00 0.00 C ATOM 1489 OH TYR A 100 -3.728 -2.143 -8.107 1.00 0.00 O ATOM 0 H TYR A 100 3.407 -1.009 -6.303 1.00 0.00 H new ATOM 0 HA TYR A 100 1.306 0.959 -6.129 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.255 -1.699 -4.600 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.409 -0.280 -4.015 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -1.508 0.651 -5.329 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.364 -3.025 -6.395 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.509 0.038 -6.755 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -1.642 -3.625 -7.818 1.00 0.00 H new ATOM 0 HH TYR A 100 -4.364 -2.664 -7.573 1.00 0.00 H new ATOM 1499 N THR A 101 2.509 1.926 -4.213 1.00 0.00 N ATOM 1500 CA THR A 101 3.353 2.589 -3.234 1.00 0.00 C ATOM 1501 C THR A 101 2.505 3.157 -2.095 1.00 0.00 C ATOM 1502 O THR A 101 1.280 3.041 -2.111 1.00 0.00 O ATOM 1503 CB THR A 101 4.180 3.650 -3.963 1.00 0.00 C ATOM 1504 OG1 THR A 101 5.131 4.078 -2.993 1.00 0.00 O ATOM 1505 CG2 THR A 101 3.371 4.912 -4.273 1.00 0.00 C ATOM 0 H THR A 101 1.743 2.496 -4.571 1.00 0.00 H new ATOM 0 HA THR A 101 4.041 1.886 -2.765 1.00 0.00 H new ATOM 0 HB THR A 101 4.570 3.231 -4.891 1.00 0.00 H new ATOM 0 HG1 THR A 101 5.930 3.513 -3.047 1.00 0.00 H new ATOM 0 HG21 THR A 101 4.005 5.632 -4.790 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.523 4.654 -4.907 1.00 0.00 H new ATOM 0 HG23 THR A 101 3.009 5.350 -3.343 1.00 0.00 H new ATOM 1513 N PHE A 102 3.189 3.759 -1.133 1.00 0.00 N ATOM 1514 CA PHE A 102 2.513 4.345 0.012 1.00 0.00 C ATOM 1515 C PHE A 102 2.105 5.791 -0.274 1.00 0.00 C ATOM 1516 O PHE A 102 2.893 6.568 -0.810 1.00 0.00 O ATOM 1517 CB PHE A 102 3.507 4.328 1.175 1.00 0.00 C ATOM 1518 CG PHE A 102 3.789 2.932 1.732 1.00 0.00 C ATOM 1519 CD1 PHE A 102 2.759 2.135 2.124 1.00 0.00 C ATOM 1520 CD2 PHE A 102 5.071 2.487 1.836 1.00 0.00 C ATOM 1521 CE1 PHE A 102 3.021 0.839 2.641 1.00 0.00 C ATOM 1522 CE2 PHE A 102 5.333 1.191 2.354 1.00 0.00 C ATOM 1523 CZ PHE A 102 4.302 0.394 2.745 1.00 0.00 C ATOM 0 H PHE A 102 4.205 3.854 -1.123 1.00 0.00 H new ATOM 0 HA PHE A 102 1.610 3.779 0.241 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.446 4.772 0.844 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.122 4.957 1.978 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.742 2.488 2.042 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.889 3.120 1.525 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.203 0.206 2.952 1.00 0.00 H new ATOM 0 HE2 PHE A 102 6.350 0.838 2.438 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.501 -0.592 3.138 1.00 0.00 H new ATOM 1533 N ALA A 103 0.873 6.109 0.097 1.00 0.00 N ATOM 1534 CA ALA A 103 0.350 7.449 -0.113 1.00 0.00 C ATOM 1535 C ALA A 103 0.621 8.298 1.131 1.00 0.00 C ATOM 1536 O ALA A 103 0.478 7.821 2.255 1.00 0.00 O ATOM 1537 CB ALA A 103 -1.140 7.368 -0.451 1.00 0.00 C ATOM 0 H ALA A 103 0.222 5.462 0.542 1.00 0.00 H new ATOM 0 HA ALA A 103 0.849 7.929 -0.955 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.532 8.373 -0.609 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.276 6.779 -1.358 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.675 6.895 0.372 1.00 0.00 H new ATOM 1543 N GLU A 104 1.007 9.541 0.886 1.00 0.00 N ATOM 1544 CA GLU A 104 1.299 10.461 1.973 1.00 0.00 C ATOM 1545 C GLU A 104 1.948 9.715 3.140 1.00 0.00 C ATOM 1546 O GLU A 104 3.137 9.401 3.097 1.00 0.00 O ATOM 1547 CB GLU A 104 0.035 11.194 2.425 1.00 0.00 C ATOM 1548 CG GLU A 104 -0.428 12.195 1.365 1.00 0.00 C ATOM 1549 CD GLU A 104 0.171 13.580 1.619 1.00 0.00 C ATOM 1550 OE1 GLU A 104 0.261 13.949 2.810 1.00 0.00 O ATOM 1551 OE2 GLU A 104 0.524 14.238 0.617 1.00 0.00 O ATOM 0 H GLU A 104 1.124 9.933 -0.048 1.00 0.00 H new ATOM 0 HA GLU A 104 2.003 11.210 1.610 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -0.758 10.472 2.619 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.228 11.715 3.363 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.135 11.844 0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -1.516 12.259 1.371 1.00 0.00 H new ATOM 1558 N SER A 105 1.139 9.452 4.156 1.00 0.00 N ATOM 1559 CA SER A 105 1.619 8.749 5.333 1.00 0.00 C ATOM 1560 C SER A 105 0.531 8.725 6.409 1.00 0.00 C ATOM 1561 O SER A 105 0.712 9.279 7.492 1.00 0.00 O ATOM 1562 CB SER A 105 2.893 9.397 5.880 1.00 0.00 C ATOM 1563 OG SER A 105 4.063 8.676 5.504 1.00 0.00 O ATOM 0 H SER A 105 0.154 9.714 4.188 1.00 0.00 H new ATOM 0 HA SER A 105 1.859 7.725 5.046 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.965 10.421 5.513 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.834 9.451 6.967 1.00 0.00 H new ATOM 0 HG SER A 105 4.130 8.649 4.527 1.00 0.00 H new ATOM 1569 N TYR A 106 -0.574 8.077 6.072 1.00 0.00 N ATOM 1570 CA TYR A 106 -1.691 7.974 6.996 1.00 0.00 C ATOM 1571 C TYR A 106 -1.913 9.293 7.738 1.00 0.00 C ATOM 1572 O TYR A 106 -1.410 10.336 7.322 1.00 0.00 O ATOM 1573 CB TYR A 106 -1.304 6.893 8.007 1.00 0.00 C ATOM 1574 CG TYR A 106 -0.084 7.247 8.860 1.00 0.00 C ATOM 1575 CD1 TYR A 106 -0.244 7.952 10.035 1.00 0.00 C ATOM 1576 CD2 TYR A 106 1.178 6.861 8.453 1.00 0.00 C ATOM 1577 CE1 TYR A 106 0.904 8.286 10.837 1.00 0.00 C ATOM 1578 CE2 TYR A 106 2.326 7.195 9.256 1.00 0.00 C ATOM 1579 CZ TYR A 106 2.132 7.890 10.408 1.00 0.00 C ATOM 1580 OH TYR A 106 3.217 8.205 11.166 1.00 0.00 O ATOM 0 H TYR A 106 -0.720 7.618 5.173 1.00 0.00 H new ATOM 0 HA TYR A 106 -2.610 7.736 6.461 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -2.152 6.705 8.665 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -1.104 5.965 7.472 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -1.231 8.254 10.353 1.00 0.00 H new ATOM 0 HD2 TYR A 106 1.304 6.309 7.533 1.00 0.00 H new ATOM 0 HE1 TYR A 106 0.792 8.838 11.758 1.00 0.00 H new ATOM 0 HE2 TYR A 106 3.319 6.900 8.950 1.00 0.00 H new ATOM 0 HH TYR A 106 4.027 7.858 10.738 1.00 0.00 H new ATOM 1590 N LYS A 107 -2.667 9.205 8.824 1.00 0.00 N ATOM 1591 CA LYS A 107 -2.962 10.379 9.627 1.00 0.00 C ATOM 1592 C LYS A 107 -1.655 10.968 10.161 1.00 0.00 C ATOM 1593 O LYS A 107 -0.978 10.347 10.978 1.00 0.00 O ATOM 1594 CB LYS A 107 -3.975 10.038 10.723 1.00 0.00 C ATOM 1595 CG LYS A 107 -3.410 8.991 11.685 1.00 0.00 C ATOM 1596 CD LYS A 107 -4.461 8.570 12.715 1.00 0.00 C ATOM 1597 CE LYS A 107 -3.859 8.514 14.120 1.00 0.00 C ATOM 1598 NZ LYS A 107 -4.916 8.677 15.143 1.00 0.00 N ATOM 0 H LYS A 107 -3.082 8.339 9.166 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.434 11.149 9.016 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -4.237 10.941 11.275 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -4.893 9.664 10.271 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -3.076 8.119 11.123 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.536 9.395 12.196 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.293 9.274 12.700 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -4.865 7.593 12.449 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.348 7.562 14.265 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.111 9.299 14.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.491 8.637 16.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -5.386 9.596 15.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -5.615 7.913 15.044 1.00 0.00 H new ATOM 1612 N LYS A 108 -1.339 12.160 9.676 1.00 0.00 N ATOM 1613 CA LYS A 108 -0.125 12.840 10.094 1.00 0.00 C ATOM 1614 C LYS A 108 -0.392 14.344 10.182 1.00 0.00 C ATOM 1615 O LYS A 108 -0.537 15.013 9.160 1.00 0.00 O ATOM 1616 CB LYS A 108 1.038 12.475 9.170 1.00 0.00 C ATOM 1617 CG LYS A 108 2.214 11.906 9.966 1.00 0.00 C ATOM 1618 CD LYS A 108 3.459 11.772 9.086 1.00 0.00 C ATOM 1619 CE LYS A 108 4.715 12.208 9.844 1.00 0.00 C ATOM 1620 NZ LYS A 108 5.206 13.506 9.329 1.00 0.00 N ATOM 0 H LYS A 108 -1.903 12.672 8.998 1.00 0.00 H new ATOM 0 HA LYS A 108 0.173 12.510 11.089 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.706 11.744 8.433 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.361 13.359 8.619 1.00 0.00 H new ATOM 0 HG2 LYS A 108 2.432 12.555 10.814 1.00 0.00 H new ATOM 0 HG3 LYS A 108 1.945 10.931 10.372 1.00 0.00 H new ATOM 0 HD2 LYS A 108 3.568 10.738 8.759 1.00 0.00 H new ATOM 0 HD3 LYS A 108 3.342 12.380 8.189 1.00 0.00 H new ATOM 0 HE2 LYS A 108 4.494 12.292 10.908 1.00 0.00 H new ATOM 0 HE3 LYS A 108 5.492 11.451 9.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 6.059 13.788 9.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 5.436 13.414 8.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 4.469 14.229 9.452 1.00 0.00 H new ATOM 1634 N LYS A 109 -0.450 14.831 11.413 1.00 0.00 N ATOM 1635 CA LYS A 109 -0.697 16.244 11.648 1.00 0.00 C ATOM 1636 C LYS A 109 0.450 17.063 11.053 1.00 0.00 C ATOM 1637 O LYS A 109 1.619 16.762 11.286 1.00 0.00 O ATOM 1638 CB LYS A 109 -0.933 16.506 13.137 1.00 0.00 C ATOM 1639 CG LYS A 109 0.333 16.227 13.950 1.00 0.00 C ATOM 1640 CD LYS A 109 0.011 16.104 15.441 1.00 0.00 C ATOM 1641 CE LYS A 109 1.292 16.046 16.275 1.00 0.00 C ATOM 1642 NZ LYS A 109 1.024 16.470 17.667 1.00 0.00 N ATOM 0 H LYS A 109 -0.330 14.273 12.258 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.610 16.561 11.144 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.243 17.541 13.283 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.747 15.876 13.496 1.00 0.00 H new ATOM 0 HG2 LYS A 109 0.800 15.307 13.598 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.054 17.030 13.795 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -0.595 16.953 15.757 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -0.582 15.206 15.616 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.692 15.032 16.268 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.051 16.691 15.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 1.904 16.425 18.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 0.664 17.446 17.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 0.316 15.838 18.092 1.00 0.00 H new ATOM 1656 N VAL A 110 0.074 18.085 10.297 1.00 0.00 N ATOM 1657 CA VAL A 110 1.057 18.950 9.667 1.00 0.00 C ATOM 1658 C VAL A 110 0.407 20.295 9.336 1.00 0.00 C ATOM 1659 O VAL A 110 -0.796 20.364 9.090 1.00 0.00 O ATOM 1660 CB VAL A 110 1.655 18.258 8.441 1.00 0.00 C ATOM 1661 CG1 VAL A 110 0.613 18.113 7.330 1.00 0.00 C ATOM 1662 CG2 VAL A 110 2.892 19.004 7.939 1.00 0.00 C ATOM 0 H VAL A 110 -0.897 18.333 10.107 1.00 0.00 H new ATOM 0 HA VAL A 110 1.885 19.147 10.348 1.00 0.00 H new ATOM 0 HB VAL A 110 1.966 17.257 8.740 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.064 17.618 6.470 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.225 17.518 7.693 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.256 19.100 7.035 1.00 0.00 H new ATOM 0 HG21 VAL A 110 3.297 18.491 7.067 1.00 0.00 H new ATOM 0 HG22 VAL A 110 2.617 20.022 7.665 1.00 0.00 H new ATOM 0 HG23 VAL A 110 3.645 19.031 8.727 1.00 0.00 H new ATOM 1672 N SER A 111 1.233 21.332 9.341 1.00 0.00 N ATOM 1673 CA SER A 111 0.753 22.671 9.045 1.00 0.00 C ATOM 1674 C SER A 111 -0.212 22.631 7.858 1.00 0.00 C ATOM 1675 O SER A 111 0.214 22.495 6.712 1.00 0.00 O ATOM 1676 CB SER A 111 1.917 23.620 8.750 1.00 0.00 C ATOM 1677 OG SER A 111 2.860 23.656 9.818 1.00 0.00 O ATOM 0 H SER A 111 2.231 21.271 9.545 1.00 0.00 H new ATOM 0 HA SER A 111 0.225 23.047 9.922 1.00 0.00 H new ATOM 0 HB2 SER A 111 2.418 23.306 7.834 1.00 0.00 H new ATOM 0 HB3 SER A 111 1.531 24.624 8.573 1.00 0.00 H new ATOM 0 HG SER A 111 3.588 24.271 9.591 1.00 0.00 H new ATOM 1683 N SER A 112 -1.493 22.752 8.174 1.00 0.00 N ATOM 1684 CA SER A 112 -2.521 22.731 7.148 1.00 0.00 C ATOM 1685 C SER A 112 -3.893 22.981 7.777 1.00 0.00 C ATOM 1686 O SER A 112 -4.582 23.933 7.416 1.00 0.00 O ATOM 1687 CB SER A 112 -2.518 21.401 6.392 1.00 0.00 C ATOM 1688 OG SER A 112 -2.842 21.569 5.014 1.00 0.00 O ATOM 0 H SER A 112 -1.842 22.865 9.126 1.00 0.00 H new ATOM 0 HA SER A 112 -2.306 23.525 6.433 1.00 0.00 H new ATOM 0 HB2 SER A 112 -1.536 20.937 6.479 1.00 0.00 H new ATOM 0 HB3 SER A 112 -3.234 20.721 6.852 1.00 0.00 H new ATOM 0 HG SER A 112 -2.828 20.698 4.566 1.00 0.00 H new ATOM 1694 N LYS A 113 -4.249 22.108 8.709 1.00 0.00 N ATOM 1695 CA LYS A 113 -5.526 22.222 9.392 1.00 0.00 C ATOM 1696 C LYS A 113 -6.635 22.438 8.360 1.00 0.00 C ATOM 1697 O LYS A 113 -7.127 23.553 8.196 1.00 0.00 O ATOM 1698 CB LYS A 113 -5.465 23.310 10.465 1.00 0.00 C ATOM 1699 CG LYS A 113 -4.855 22.770 11.760 1.00 0.00 C ATOM 1700 CD LYS A 113 -5.889 22.752 12.888 1.00 0.00 C ATOM 1701 CE LYS A 113 -6.365 21.326 13.171 1.00 0.00 C ATOM 1702 NZ LYS A 113 -7.666 21.073 12.513 1.00 0.00 N ATOM 0 H LYS A 113 -3.675 21.319 9.007 1.00 0.00 H new ATOM 0 HA LYS A 113 -5.758 21.298 9.921 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -4.873 24.150 10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -6.468 23.688 10.662 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -4.475 21.762 11.594 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -4.005 23.387 12.051 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -5.455 23.181 13.791 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -6.740 23.376 12.616 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -5.624 20.611 12.812 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -6.459 21.175 14.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -7.974 20.101 12.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -8.374 21.743 12.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -7.565 21.197 11.485 1.00 0.00 H new ATOM 1716 N GLU A 114 -6.995 21.353 7.690 1.00 0.00 N ATOM 1717 CA GLU A 114 -8.036 21.410 6.677 1.00 0.00 C ATOM 1718 C GLU A 114 -8.694 20.038 6.516 1.00 0.00 C ATOM 1719 O GLU A 114 -8.164 19.169 5.826 1.00 0.00 O ATOM 1720 CB GLU A 114 -7.478 21.911 5.344 1.00 0.00 C ATOM 1721 CG GLU A 114 -8.446 22.890 4.677 1.00 0.00 C ATOM 1722 CD GLU A 114 -7.985 23.237 3.260 1.00 0.00 C ATOM 1723 OE1 GLU A 114 -6.752 23.292 3.062 1.00 0.00 O ATOM 1724 OE2 GLU A 114 -8.876 23.440 2.408 1.00 0.00 O ATOM 0 H GLU A 114 -6.585 20.430 7.829 1.00 0.00 H new ATOM 0 HA GLU A 114 -8.796 22.120 7.004 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -6.517 22.399 5.508 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.296 21.065 4.681 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -9.444 22.453 4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -8.517 23.800 5.273 1.00 0.00 H new ATOM 1731 N SER A 115 -9.840 19.888 7.163 1.00 0.00 N ATOM 1732 CA SER A 115 -10.577 18.637 7.100 1.00 0.00 C ATOM 1733 C SER A 115 -11.985 18.829 7.665 1.00 0.00 C ATOM 1734 O SER A 115 -12.974 18.595 6.972 1.00 0.00 O ATOM 1735 CB SER A 115 -9.846 17.528 7.860 1.00 0.00 C ATOM 1736 OG SER A 115 -9.443 17.949 9.160 1.00 0.00 O ATOM 0 H SER A 115 -10.277 20.612 7.734 1.00 0.00 H new ATOM 0 HA SER A 115 -10.651 18.336 6.055 1.00 0.00 H new ATOM 0 HB2 SER A 115 -10.497 16.658 7.946 1.00 0.00 H new ATOM 0 HB3 SER A 115 -8.970 17.216 7.292 1.00 0.00 H new ATOM 0 HG SER A 115 -8.982 17.213 9.614 1.00 0.00 H new ATOM 1742 N GLY A 116 -12.032 19.254 8.919 1.00 0.00 N ATOM 1743 CA GLY A 116 -13.303 19.481 9.586 1.00 0.00 C ATOM 1744 C GLY A 116 -14.106 18.183 9.691 1.00 0.00 C ATOM 1745 O GLY A 116 -14.785 17.790 8.744 1.00 0.00 O ATOM 0 H GLY A 116 -11.210 19.447 9.491 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -13.128 19.886 10.583 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -13.879 20.226 9.036 1.00 0.00 H new ATOM 1749 N PRO A 117 -13.999 17.535 10.882 1.00 0.00 N ATOM 1750 CA PRO A 117 -14.707 16.290 11.124 1.00 0.00 C ATOM 1751 C PRO A 117 -16.198 16.543 11.356 1.00 0.00 C ATOM 1752 O PRO A 117 -16.646 17.688 11.345 1.00 0.00 O ATOM 1753 CB PRO A 117 -14.015 15.671 12.327 1.00 0.00 C ATOM 1754 CG PRO A 117 -13.254 16.802 12.998 1.00 0.00 C ATOM 1755 CD PRO A 117 -13.204 17.970 12.027 1.00 0.00 C ATOM 0 HA PRO A 117 -14.672 15.614 10.270 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -14.740 15.229 13.010 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -13.339 14.873 12.021 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -13.747 17.097 13.925 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -12.246 16.481 13.261 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -13.616 18.875 12.474 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -12.179 18.198 11.734 1.00 0.00 H new ATOM 1763 N SER A 118 -16.926 15.455 11.561 1.00 0.00 N ATOM 1764 CA SER A 118 -18.357 15.544 11.795 1.00 0.00 C ATOM 1765 C SER A 118 -18.893 14.196 12.281 1.00 0.00 C ATOM 1766 O SER A 118 -18.406 13.145 11.868 1.00 0.00 O ATOM 1767 CB SER A 118 -19.096 15.984 10.530 1.00 0.00 C ATOM 1768 OG SER A 118 -20.039 17.019 10.795 1.00 0.00 O ATOM 0 H SER A 118 -16.551 14.506 11.570 1.00 0.00 H new ATOM 0 HA SER A 118 -18.531 16.296 12.565 1.00 0.00 H new ATOM 0 HB2 SER A 118 -18.374 16.332 9.791 1.00 0.00 H new ATOM 0 HB3 SER A 118 -19.611 15.128 10.094 1.00 0.00 H new ATOM 0 HG SER A 118 -20.488 17.273 9.962 1.00 0.00 H new ATOM 1774 N SER A 119 -19.888 14.271 13.153 1.00 0.00 N ATOM 1775 CA SER A 119 -20.496 13.070 13.700 1.00 0.00 C ATOM 1776 C SER A 119 -21.598 13.446 14.691 1.00 0.00 C ATOM 1777 O SER A 119 -21.456 14.403 15.450 1.00 0.00 O ATOM 1778 CB SER A 119 -19.450 12.184 14.380 1.00 0.00 C ATOM 1779 OG SER A 119 -18.608 12.929 15.256 1.00 0.00 O ATOM 0 H SER A 119 -20.288 15.145 13.494 1.00 0.00 H new ATOM 0 HA SER A 119 -20.934 12.504 12.878 1.00 0.00 H new ATOM 0 HB2 SER A 119 -19.952 11.397 14.942 1.00 0.00 H new ATOM 0 HB3 SER A 119 -18.840 11.694 13.620 1.00 0.00 H new ATOM 0 HG SER A 119 -17.955 12.328 15.672 1.00 0.00 H new ATOM 1785 N GLY A 120 -22.673 12.672 14.653 1.00 0.00 N ATOM 1786 CA GLY A 120 -23.800 12.912 15.539 1.00 0.00 C ATOM 1787 C GLY A 120 -24.509 14.220 15.182 1.00 0.00 C ATOM 1788 O GLY A 120 -23.866 15.259 15.039 1.00 0.00 O ATOM 0 H GLY A 120 -22.787 11.878 14.023 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -24.504 12.082 15.471 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -23.453 12.952 16.572 1.00 0.00 H new TER 1792 GLY A 120