USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1101 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 Set 1.1: A 127 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 90 GLN : amide:sc= -0.039 K(o=-0.039,f=-2) USER MOD Set 2.2: A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 84:sc= 0.275 USER MOD Single : A 14 TYR OH : rot 5:sc= -0.476 USER MOD Single : A 15 ASN : amide:sc=-0.00775 X(o=-0.0077,f=-0.14) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 158:sc= -1.8 USER MOD Single : A 30 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.409) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.116 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.24 K(o=-1.2,f=-3.2!) USER MOD Single : A 45 TYR OH : rot -69:sc= 0.633 USER MOD Single : A 46 GLN : amide:sc= -0.0869 X(o=-0.087,f=-0.013) USER MOD Single : A 47 HIS : no HD1:sc= -0.102 X(o=-0.1,f=-0.27) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 CYS SG : rot 130:sc= 1.19 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0327 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 26:sc= 0.354 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= -0.0103 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0977 USER MOD Single : A 75 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.191) USER MOD Single : A 80 THR OG1 : rot -140:sc= -2.3! USER MOD Single : A 85 ASN : amide:sc= 0.0729 X(o=0.073,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 84:sc= 0.166 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -153:sc= -0.0267 (180deg=-0.837) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN :FLIP amide:sc= -0.0474 F(o=-0.73,f=-0.047) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 173:sc= -1.37 (180deg=-1.37) USER MOD Single : A 115 SER OG : rot -170:sc= -0.0396 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -0.0168 X(o=-0.017,f=0) USER MOD Single : A 126 LYS NZ :NH3+ -109:sc= 0.372 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ -132:sc= 0.175 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.226 X(o=-0.23,f=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0.0999 K(o=0.1,f=-4.2!) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -1.568 -19.576 -11.605 1.00 0.00 N ATOM 2 CA ALA A 2 -2.777 -18.772 -11.926 1.00 0.00 C ATOM 3 C ALA A 2 -3.442 -18.250 -10.653 1.00 0.00 C ATOM 4 O ALA A 2 -3.862 -19.032 -9.797 1.00 0.00 O ATOM 5 CB ALA A 2 -3.763 -19.602 -12.736 1.00 0.00 C ATOM 0 HA ALA A 2 -2.466 -17.914 -12.522 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.643 -19.001 -12.964 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -3.292 -19.922 -13.665 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.061 -20.478 -12.160 1.00 0.00 H new ATOM 13 N THR A 3 -3.532 -16.926 -10.534 1.00 0.00 N ATOM 14 CA THR A 3 -4.146 -16.298 -9.367 1.00 0.00 C ATOM 15 C THR A 3 -5.384 -15.501 -9.769 1.00 0.00 C ATOM 16 O THR A 3 -5.310 -14.605 -10.612 1.00 0.00 O ATOM 17 CB THR A 3 -3.140 -15.389 -8.654 1.00 0.00 C ATOM 18 OG1 THR A 3 -2.316 -14.710 -9.589 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.236 -16.136 -7.694 1.00 0.00 C ATOM 0 H THR A 3 -3.187 -16.268 -11.233 1.00 0.00 H new ATOM 0 HA THR A 3 -4.452 -17.087 -8.680 1.00 0.00 H new ATOM 0 HB THR A 3 -3.744 -14.683 -8.084 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.683 -14.135 -9.110 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.548 -15.435 -7.222 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.841 -16.622 -6.928 1.00 0.00 H new ATOM 0 HG23 THR A 3 -1.669 -16.890 -8.240 1.00 0.00 H new ATOM 27 N LYS A 4 -6.520 -15.835 -9.161 1.00 0.00 N ATOM 28 CA LYS A 4 -7.775 -15.152 -9.456 1.00 0.00 C ATOM 29 C LYS A 4 -7.916 -13.885 -8.618 1.00 0.00 C ATOM 30 O LYS A 4 -7.471 -13.837 -7.472 1.00 0.00 O ATOM 31 CB LYS A 4 -8.963 -16.082 -9.196 1.00 0.00 C ATOM 32 CG LYS A 4 -9.497 -16.753 -10.452 1.00 0.00 C ATOM 33 CD LYS A 4 -10.969 -17.114 -10.309 1.00 0.00 C ATOM 34 CE LYS A 4 -11.150 -18.479 -9.656 1.00 0.00 C ATOM 35 NZ LYS A 4 -12.574 -18.751 -9.307 1.00 0.00 N ATOM 0 H LYS A 4 -6.596 -16.574 -8.462 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.766 -14.872 -10.509 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -8.663 -16.850 -8.483 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.766 -15.511 -8.730 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.366 -16.087 -11.305 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.919 -17.654 -10.658 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -11.474 -16.355 -9.712 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -11.441 -17.114 -11.291 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -10.789 -19.254 -10.332 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -10.540 -18.533 -8.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -12.650 -19.690 -8.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.913 -18.027 -8.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -13.154 -18.726 -10.170 1.00 0.00 H new ATOM 49 N ILE A 5 -8.543 -12.862 -9.197 1.00 0.00 N ATOM 50 CA ILE A 5 -8.747 -11.595 -8.501 1.00 0.00 C ATOM 51 C ILE A 5 -10.235 -11.326 -8.286 1.00 0.00 C ATOM 52 O ILE A 5 -11.022 -11.332 -9.236 1.00 0.00 O ATOM 53 CB ILE A 5 -8.115 -10.413 -9.272 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.284 -9.111 -8.486 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.727 -10.281 -10.661 1.00 0.00 C ATOM 56 CD1 ILE A 5 -7.080 -8.197 -8.559 1.00 0.00 C ATOM 0 H ILE A 5 -8.918 -12.887 -10.145 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.253 -11.679 -7.533 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.050 -10.613 -9.388 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.157 -8.579 -8.864 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.485 -9.351 -7.442 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.266 -9.443 -11.184 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.554 -11.199 -11.223 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.799 -10.107 -10.571 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.272 -7.295 -7.979 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.208 -8.710 -8.153 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.891 -7.927 -9.598 1.00 0.00 H new ATOM 68 N ASP A 6 -10.612 -11.087 -7.033 1.00 0.00 N ATOM 69 CA ASP A 6 -12.003 -10.810 -6.694 1.00 0.00 C ATOM 70 C ASP A 6 -12.337 -9.344 -6.957 1.00 0.00 C ATOM 71 O ASP A 6 -11.873 -8.452 -6.245 1.00 0.00 O ATOM 72 CB ASP A 6 -12.277 -11.157 -5.228 1.00 0.00 C ATOM 73 CG ASP A 6 -13.750 -11.387 -4.946 1.00 0.00 C ATOM 74 OD1 ASP A 6 -14.572 -10.529 -5.330 1.00 0.00 O ATOM 75 OD2 ASP A 6 -14.082 -12.424 -4.337 1.00 0.00 O ATOM 0 H ASP A 6 -9.974 -11.080 -6.237 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.638 -11.431 -7.325 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.716 -12.052 -4.960 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -11.912 -10.350 -4.593 1.00 0.00 H new ATOM 80 N LYS A 7 -13.145 -9.105 -7.988 1.00 0.00 N ATOM 81 CA LYS A 7 -13.547 -7.750 -8.355 1.00 0.00 C ATOM 82 C LYS A 7 -14.478 -7.148 -7.304 1.00 0.00 C ATOM 83 O LYS A 7 -14.406 -5.953 -7.015 1.00 0.00 O ATOM 84 CB LYS A 7 -14.237 -7.754 -9.721 1.00 0.00 C ATOM 85 CG LYS A 7 -13.273 -7.669 -10.895 1.00 0.00 C ATOM 86 CD LYS A 7 -13.639 -8.659 -11.992 1.00 0.00 C ATOM 87 CE LYS A 7 -12.403 -9.286 -12.618 1.00 0.00 C ATOM 88 NZ LYS A 7 -12.706 -9.923 -13.931 1.00 0.00 N ATOM 0 H LYS A 7 -13.535 -9.835 -8.585 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.648 -7.136 -8.408 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.831 -8.663 -9.815 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -14.930 -6.914 -9.770 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -13.280 -6.657 -11.300 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.259 -7.867 -10.549 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.275 -9.442 -11.579 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.219 -8.151 -12.762 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -11.638 -8.522 -12.753 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.991 -10.033 -11.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.837 -10.338 -14.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.418 -10.670 -13.799 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.075 -9.206 -14.588 1.00 0.00 H new ATOM 102 N GLU A 8 -15.348 -7.985 -6.738 1.00 0.00 N ATOM 103 CA GLU A 8 -16.297 -7.543 -5.719 1.00 0.00 C ATOM 104 C GLU A 8 -15.581 -7.206 -4.410 1.00 0.00 C ATOM 105 O GLU A 8 -15.824 -6.152 -3.820 1.00 0.00 O ATOM 106 CB GLU A 8 -17.357 -8.623 -5.476 1.00 0.00 C ATOM 107 CG GLU A 8 -18.783 -8.092 -5.474 1.00 0.00 C ATOM 108 CD GLU A 8 -19.251 -7.676 -6.856 1.00 0.00 C ATOM 109 OE1 GLU A 8 -18.997 -6.516 -7.244 1.00 0.00 O ATOM 110 OE2 GLU A 8 -19.868 -8.511 -7.550 1.00 0.00 O ATOM 0 H GLU A 8 -15.414 -8.976 -6.970 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.786 -6.639 -6.083 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.265 -9.389 -6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.158 -9.107 -4.520 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -19.452 -8.859 -5.083 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.848 -7.238 -4.800 1.00 0.00 H new ATOM 117 N ALA A 9 -14.699 -8.104 -3.965 1.00 0.00 N ATOM 118 CA ALA A 9 -13.948 -7.900 -2.730 1.00 0.00 C ATOM 119 C ALA A 9 -13.164 -6.593 -2.780 1.00 0.00 C ATOM 120 O ALA A 9 -13.297 -5.745 -1.896 1.00 0.00 O ATOM 121 CB ALA A 9 -13.014 -9.076 -2.477 1.00 0.00 C ATOM 0 H ALA A 9 -14.489 -8.980 -4.444 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.658 -7.837 -1.905 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.461 -8.909 -1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.598 -9.992 -2.390 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.314 -9.169 -3.307 1.00 0.00 H new ATOM 127 N CYS A 10 -12.354 -6.435 -3.827 1.00 0.00 N ATOM 128 CA CYS A 10 -11.555 -5.232 -4.007 1.00 0.00 C ATOM 129 C CYS A 10 -12.442 -3.990 -4.100 1.00 0.00 C ATOM 130 O CYS A 10 -12.104 -2.937 -3.561 1.00 0.00 O ATOM 131 CB CYS A 10 -10.697 -5.361 -5.264 1.00 0.00 C ATOM 132 SG CYS A 10 -9.571 -6.779 -5.253 1.00 0.00 S ATOM 0 H CYS A 10 -12.237 -7.131 -4.564 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.907 -5.119 -3.138 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -11.353 -5.439 -6.131 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.113 -4.449 -5.387 1.00 0.00 H new ATOM 0 HG CYS A 10 -10.206 -7.841 -5.652 1.00 0.00 H new ATOM 138 N ARG A 11 -13.583 -4.128 -4.783 1.00 0.00 N ATOM 139 CA ARG A 11 -14.527 -3.021 -4.943 1.00 0.00 C ATOM 140 C ARG A 11 -15.029 -2.531 -3.587 1.00 0.00 C ATOM 141 O ARG A 11 -14.935 -1.343 -3.275 1.00 0.00 O ATOM 142 CB ARG A 11 -15.716 -3.452 -5.808 1.00 0.00 C ATOM 143 CG ARG A 11 -15.642 -2.960 -7.244 1.00 0.00 C ATOM 144 CD ARG A 11 -16.981 -3.108 -7.948 1.00 0.00 C ATOM 145 NE ARG A 11 -17.023 -2.376 -9.215 1.00 0.00 N ATOM 146 CZ ARG A 11 -17.208 -1.056 -9.313 1.00 0.00 C ATOM 147 NH1 ARG A 11 -17.368 -0.315 -8.220 1.00 0.00 N ATOM 148 NH2 ARG A 11 -17.235 -0.477 -10.509 1.00 0.00 N ATOM 0 H ARG A 11 -13.874 -4.996 -5.233 1.00 0.00 H new ATOM 0 HA ARG A 11 -14.002 -2.203 -5.437 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.776 -4.540 -5.810 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.636 -3.083 -5.354 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -15.336 -1.914 -7.257 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.880 -3.522 -7.785 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.177 -4.164 -8.134 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.775 -2.746 -7.295 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.904 -2.907 -10.078 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -17.350 -0.754 -7.299 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -17.509 0.692 -8.303 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -17.115 -1.040 -11.351 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -17.376 0.530 -10.585 1.00 0.00 H new ATOM 162 N ALA A 12 -15.566 -3.457 -2.787 1.00 0.00 N ATOM 163 CA ALA A 12 -16.085 -3.124 -1.462 1.00 0.00 C ATOM 164 C ALA A 12 -15.022 -2.442 -0.608 1.00 0.00 C ATOM 165 O ALA A 12 -15.286 -1.412 0.017 1.00 0.00 O ATOM 166 CB ALA A 12 -16.603 -4.375 -0.766 1.00 0.00 C ATOM 0 H ALA A 12 -15.652 -4.442 -3.036 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.911 -2.425 -1.590 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.986 -4.111 0.220 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -17.403 -4.817 -1.360 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.791 -5.094 -0.659 1.00 0.00 H new ATOM 172 N ALA A 13 -13.820 -3.021 -0.588 1.00 0.00 N ATOM 173 CA ALA A 13 -12.714 -2.468 0.187 1.00 0.00 C ATOM 174 C ALA A 13 -12.343 -1.070 -0.301 1.00 0.00 C ATOM 175 O ALA A 13 -12.221 -0.144 0.499 1.00 0.00 O ATOM 176 CB ALA A 13 -11.508 -3.392 0.122 1.00 0.00 C ATOM 0 H ALA A 13 -13.590 -3.872 -1.100 1.00 0.00 H new ATOM 0 HA ALA A 13 -13.037 -2.386 1.225 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.691 -2.966 0.705 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.774 -4.367 0.530 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.193 -3.506 -0.915 1.00 0.00 H new ATOM 182 N TYR A 14 -12.172 -0.926 -1.617 1.00 0.00 N ATOM 183 CA TYR A 14 -11.822 0.363 -2.214 1.00 0.00 C ATOM 184 C TYR A 14 -12.830 1.440 -1.817 1.00 0.00 C ATOM 185 O TYR A 14 -12.449 2.546 -1.428 1.00 0.00 O ATOM 186 CB TYR A 14 -11.760 0.245 -3.741 1.00 0.00 C ATOM 187 CG TYR A 14 -11.161 1.457 -4.424 1.00 0.00 C ATOM 188 CD1 TYR A 14 -9.795 1.542 -4.662 1.00 0.00 C ATOM 189 CD2 TYR A 14 -11.964 2.516 -4.829 1.00 0.00 C ATOM 190 CE1 TYR A 14 -9.245 2.648 -5.282 1.00 0.00 C ATOM 191 CE2 TYR A 14 -11.423 3.625 -5.450 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.064 3.687 -5.674 1.00 0.00 C ATOM 193 OH TYR A 14 -9.523 4.792 -6.291 1.00 0.00 O ATOM 0 H TYR A 14 -12.270 -1.687 -2.289 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.840 0.652 -1.839 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.174 -0.636 -4.005 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.767 0.084 -4.125 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.152 0.730 -4.357 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -13.029 2.471 -4.655 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -8.181 2.699 -5.459 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -12.061 4.440 -5.759 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.565 4.648 -6.438 1.00 0.00 H new ATOM 203 N ASN A 15 -14.118 1.103 -1.916 1.00 0.00 N ATOM 204 CA ASN A 15 -15.192 2.031 -1.567 1.00 0.00 C ATOM 205 C ASN A 15 -15.182 2.362 -0.071 1.00 0.00 C ATOM 206 O ASN A 15 -15.636 3.434 0.333 1.00 0.00 O ATOM 207 CB ASN A 15 -16.545 1.436 -1.960 1.00 0.00 C ATOM 208 CG ASN A 15 -16.810 1.528 -3.451 1.00 0.00 C ATOM 209 OD1 ASN A 15 -16.719 2.603 -4.044 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.140 0.398 -4.069 1.00 0.00 N ATOM 0 H ASN A 15 -14.442 0.190 -2.236 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.028 2.957 -2.118 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.582 0.391 -1.652 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.337 1.956 -1.421 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.329 0.401 -5.071 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -17.205 -0.472 -3.541 1.00 0.00 H new ATOM 217 N LEU A 16 -14.666 1.441 0.745 1.00 0.00 N ATOM 218 CA LEU A 16 -14.599 1.646 2.190 1.00 0.00 C ATOM 219 C LEU A 16 -13.402 2.520 2.566 1.00 0.00 C ATOM 220 O LEU A 16 -13.499 3.361 3.460 1.00 0.00 O ATOM 221 CB LEU A 16 -14.515 0.299 2.914 1.00 0.00 C ATOM 222 CG LEU A 16 -15.344 0.197 4.197 1.00 0.00 C ATOM 223 CD1 LEU A 16 -16.828 0.324 3.890 1.00 0.00 C ATOM 224 CD2 LEU A 16 -15.056 -1.115 4.911 1.00 0.00 C ATOM 0 H LEU A 16 -14.289 0.547 0.429 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.508 2.161 2.501 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.837 -0.485 2.229 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.471 0.100 3.158 1.00 0.00 H new ATOM 0 HG LEU A 16 -15.061 1.019 4.855 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -17.399 0.249 4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -17.021 1.289 3.422 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -17.129 -0.475 3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -15.653 -1.173 5.821 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -15.311 -1.949 4.257 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.998 -1.165 5.167 1.00 0.00 H new ATOM 236 N VAL A 17 -12.276 2.317 1.877 1.00 0.00 N ATOM 237 CA VAL A 17 -11.062 3.093 2.140 1.00 0.00 C ATOM 238 C VAL A 17 -11.228 4.540 1.678 1.00 0.00 C ATOM 239 O VAL A 17 -10.760 5.466 2.342 1.00 0.00 O ATOM 240 CB VAL A 17 -9.824 2.478 1.447 1.00 0.00 C ATOM 241 CG1 VAL A 17 -8.543 3.099 1.985 1.00 0.00 C ATOM 242 CG2 VAL A 17 -9.794 0.966 1.624 1.00 0.00 C ATOM 0 H VAL A 17 -12.180 1.624 1.135 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.903 3.070 3.218 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.895 2.695 0.381 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.684 2.652 1.484 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.553 4.173 1.799 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.473 2.917 3.057 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -8.913 0.559 1.127 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.755 0.725 2.686 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.692 0.530 1.186 1.00 0.00 H new ATOM 252 N ARG A 18 -11.903 4.729 0.539 1.00 0.00 N ATOM 253 CA ARG A 18 -12.137 6.068 -0.004 1.00 0.00 C ATOM 254 C ARG A 18 -12.968 6.918 0.961 1.00 0.00 C ATOM 255 O ARG A 18 -12.846 8.143 0.979 1.00 0.00 O ATOM 256 CB ARG A 18 -12.840 5.983 -1.365 1.00 0.00 C ATOM 257 CG ARG A 18 -14.176 5.260 -1.323 1.00 0.00 C ATOM 258 CD ARG A 18 -15.010 5.547 -2.563 1.00 0.00 C ATOM 259 NE ARG A 18 -16.440 5.630 -2.257 1.00 0.00 N ATOM 260 CZ ARG A 18 -17.349 6.158 -3.079 1.00 0.00 C ATOM 261 NH1 ARG A 18 -16.983 6.661 -4.255 1.00 0.00 N ATOM 262 NH2 ARG A 18 -18.629 6.184 -2.725 1.00 0.00 N ATOM 0 H ARG A 18 -12.295 3.973 -0.022 1.00 0.00 H new ATOM 0 HA ARG A 18 -11.167 6.547 -0.136 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -12.996 6.992 -1.746 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.184 5.473 -2.071 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -14.006 4.187 -1.239 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.728 5.566 -0.434 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -14.681 6.484 -3.012 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.842 4.763 -3.302 1.00 0.00 H new ATOM 0 HE ARG A 18 -16.760 5.262 -1.361 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -16.002 6.645 -4.534 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -17.683 7.063 -4.878 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -18.917 5.800 -1.825 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -19.324 6.588 -3.353 1.00 0.00 H new ATOM 276 N ASP A 19 -13.807 6.259 1.767 1.00 0.00 N ATOM 277 CA ASP A 19 -14.646 6.956 2.734 1.00 0.00 C ATOM 278 C ASP A 19 -13.794 7.555 3.851 1.00 0.00 C ATOM 279 O ASP A 19 -13.080 6.835 4.552 1.00 0.00 O ATOM 280 CB ASP A 19 -15.688 6.000 3.324 1.00 0.00 C ATOM 281 CG ASP A 19 -16.730 6.719 4.160 1.00 0.00 C ATOM 282 OD1 ASP A 19 -17.738 7.178 3.584 1.00 0.00 O ATOM 283 OD2 ASP A 19 -16.537 6.822 5.389 1.00 0.00 O ATOM 0 H ASP A 19 -13.920 5.245 1.765 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.163 7.765 2.218 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.183 5.464 2.515 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.185 5.254 3.939 1.00 0.00 H new ATOM 288 N ASP A 20 -13.872 8.876 4.008 1.00 0.00 N ATOM 289 CA ASP A 20 -13.106 9.573 5.039 1.00 0.00 C ATOM 290 C ASP A 20 -13.943 9.798 6.305 1.00 0.00 C ATOM 291 O ASP A 20 -13.702 10.744 7.059 1.00 0.00 O ATOM 292 CB ASP A 20 -12.592 10.911 4.496 1.00 0.00 C ATOM 293 CG ASP A 20 -11.368 10.747 3.615 1.00 0.00 C ATOM 294 OD1 ASP A 20 -10.248 10.654 4.161 1.00 0.00 O ATOM 295 OD2 ASP A 20 -11.528 10.711 2.376 1.00 0.00 O ATOM 0 H ASP A 20 -14.457 9.484 3.435 1.00 0.00 H new ATOM 0 HA ASP A 20 -12.257 8.946 5.310 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -13.384 11.397 3.926 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -12.350 11.569 5.330 1.00 0.00 H new ATOM 300 N GLY A 21 -14.922 8.919 6.537 1.00 0.00 N ATOM 301 CA GLY A 21 -15.773 9.034 7.710 1.00 0.00 C ATOM 302 C GLY A 21 -15.482 7.966 8.751 1.00 0.00 C ATOM 303 O GLY A 21 -15.574 8.228 9.952 1.00 0.00 O ATOM 0 H GLY A 21 -15.139 8.128 5.930 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.637 10.019 8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -16.817 8.964 7.405 1.00 0.00 H new ATOM 307 N SER A 22 -15.132 6.759 8.297 1.00 0.00 N ATOM 308 CA SER A 22 -14.832 5.654 9.205 1.00 0.00 C ATOM 309 C SER A 22 -13.351 5.628 9.577 1.00 0.00 C ATOM 310 O SER A 22 -12.525 6.271 8.925 1.00 0.00 O ATOM 311 CB SER A 22 -15.237 4.319 8.572 1.00 0.00 C ATOM 312 OG SER A 22 -16.353 3.757 9.242 1.00 0.00 O ATOM 0 H SER A 22 -15.050 6.525 7.308 1.00 0.00 H new ATOM 0 HA SER A 22 -15.409 5.807 10.117 1.00 0.00 H new ATOM 0 HB2 SER A 22 -15.478 4.470 7.520 1.00 0.00 H new ATOM 0 HB3 SER A 22 -14.398 3.625 8.610 1.00 0.00 H new ATOM 0 HG SER A 22 -16.594 2.906 8.819 1.00 0.00 H new ATOM 318 N ALA A 23 -13.025 4.875 10.629 1.00 0.00 N ATOM 319 CA ALA A 23 -11.643 4.758 11.091 1.00 0.00 C ATOM 320 C ALA A 23 -10.859 3.764 10.233 1.00 0.00 C ATOM 321 O ALA A 23 -10.337 2.766 10.734 1.00 0.00 O ATOM 322 CB ALA A 23 -11.612 4.343 12.557 1.00 0.00 C ATOM 0 H ALA A 23 -13.699 4.338 11.176 1.00 0.00 H new ATOM 0 HA ALA A 23 -11.166 5.733 10.993 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -10.577 4.259 12.890 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.127 5.092 13.158 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.110 3.380 12.673 1.00 0.00 H new ATOM 328 N VAL A 24 -10.789 4.043 8.933 1.00 0.00 N ATOM 329 CA VAL A 24 -10.081 3.177 7.996 1.00 0.00 C ATOM 330 C VAL A 24 -9.174 3.992 7.071 1.00 0.00 C ATOM 331 O VAL A 24 -9.649 4.853 6.329 1.00 0.00 O ATOM 332 CB VAL A 24 -11.072 2.357 7.142 1.00 0.00 C ATOM 333 CG1 VAL A 24 -10.329 1.379 6.244 1.00 0.00 C ATOM 334 CG2 VAL A 24 -12.065 1.617 8.030 1.00 0.00 C ATOM 0 H VAL A 24 -11.216 4.865 8.505 1.00 0.00 H new ATOM 0 HA VAL A 24 -9.469 2.495 8.586 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.627 3.050 6.509 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -11.047 0.812 5.651 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.664 1.929 5.579 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.744 0.694 6.858 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.754 1.046 7.408 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.526 0.939 8.692 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -12.626 2.336 8.626 1.00 0.00 H new ATOM 344 N ILE A 25 -7.869 3.713 7.119 1.00 0.00 N ATOM 345 CA ILE A 25 -6.903 4.424 6.280 1.00 0.00 C ATOM 346 C ILE A 25 -6.135 3.470 5.360 1.00 0.00 C ATOM 347 O ILE A 25 -5.888 3.793 4.196 1.00 0.00 O ATOM 348 CB ILE A 25 -5.898 5.246 7.124 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.948 4.330 7.904 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.638 6.179 8.071 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.837 5.074 8.615 1.00 0.00 C ATOM 0 H ILE A 25 -7.459 3.004 7.727 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.485 5.110 5.665 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.297 5.846 6.441 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -5.523 3.764 8.637 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.508 3.607 7.217 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.917 6.749 8.657 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -7.260 6.864 7.495 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -7.267 5.593 8.741 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -3.204 4.363 9.146 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -3.238 5.618 7.885 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.268 5.778 9.327 1.00 0.00 H new ATOM 363 N TRP A 26 -5.758 2.299 5.882 1.00 0.00 N ATOM 364 CA TRP A 26 -5.018 1.313 5.096 1.00 0.00 C ATOM 365 C TRP A 26 -5.748 -0.027 5.050 1.00 0.00 C ATOM 366 O TRP A 26 -6.572 -0.328 5.915 1.00 0.00 O ATOM 367 CB TRP A 26 -3.604 1.118 5.663 1.00 0.00 C ATOM 368 CG TRP A 26 -3.576 0.532 7.048 1.00 0.00 C ATOM 369 CD1 TRP A 26 -3.333 1.203 8.212 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.793 -0.840 7.414 1.00 0.00 C ATOM 371 NE1 TRP A 26 -3.390 0.339 9.277 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.671 -0.920 8.816 1.00 0.00 C ATOM 373 CE3 TRP A 26 -4.080 -2.008 6.699 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.829 -2.116 9.510 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -4.236 -3.195 7.391 1.00 0.00 C ATOM 376 CH2 TRP A 26 -4.111 -3.240 8.782 1.00 0.00 C ATOM 0 H TRP A 26 -5.953 2.013 6.842 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.944 1.696 4.078 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -3.041 0.468 4.993 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -3.093 2.081 5.676 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.126 2.260 8.284 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.246 0.593 10.254 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -4.178 -1.983 5.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.732 -2.156 10.585 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.458 -4.102 6.848 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.240 -4.182 9.294 1.00 0.00 H new ATOM 387 N VAL A 27 -5.424 -0.831 4.039 1.00 0.00 N ATOM 388 CA VAL A 27 -6.024 -2.151 3.873 1.00 0.00 C ATOM 389 C VAL A 27 -4.966 -3.149 3.403 1.00 0.00 C ATOM 390 O VAL A 27 -4.074 -2.786 2.634 1.00 0.00 O ATOM 391 CB VAL A 27 -7.193 -2.125 2.867 1.00 0.00 C ATOM 392 CG1 VAL A 27 -8.359 -1.327 3.429 1.00 0.00 C ATOM 393 CG2 VAL A 27 -6.745 -1.553 1.529 1.00 0.00 C ATOM 0 H VAL A 27 -4.744 -0.588 3.318 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.419 -2.458 4.841 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.524 -3.150 2.701 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.176 -1.318 2.707 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -8.700 -1.786 4.357 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.038 -0.304 3.626 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -7.587 -1.545 0.837 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -6.383 -0.535 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.944 -2.169 1.120 1.00 0.00 H new ATOM 403 N THR A 28 -5.045 -4.397 3.873 1.00 0.00 N ATOM 404 CA THR A 28 -4.050 -5.406 3.483 1.00 0.00 C ATOM 405 C THR A 28 -4.590 -6.361 2.420 1.00 0.00 C ATOM 406 O THR A 28 -5.263 -7.339 2.735 1.00 0.00 O ATOM 407 CB THR A 28 -3.574 -6.192 4.709 1.00 0.00 C ATOM 408 OG1 THR A 28 -4.652 -6.477 5.579 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.515 -5.463 5.512 1.00 0.00 C ATOM 0 H THR A 28 -5.769 -4.730 4.510 1.00 0.00 H new ATOM 0 HA THR A 28 -3.203 -4.875 3.048 1.00 0.00 H new ATOM 0 HB THR A 28 -3.141 -7.109 4.310 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.421 -7.242 6.146 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.221 -6.074 6.366 1.00 0.00 H new ATOM 0 HG22 THR A 28 -1.645 -5.277 4.882 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.916 -4.513 5.866 1.00 0.00 H new ATOM 417 N PHE A 29 -4.269 -6.084 1.156 1.00 0.00 N ATOM 418 CA PHE A 29 -4.713 -6.928 0.048 1.00 0.00 C ATOM 419 C PHE A 29 -3.835 -8.173 -0.065 1.00 0.00 C ATOM 420 O PHE A 29 -2.643 -8.082 -0.354 1.00 0.00 O ATOM 421 CB PHE A 29 -4.682 -6.145 -1.271 1.00 0.00 C ATOM 422 CG PHE A 29 -5.944 -5.375 -1.551 1.00 0.00 C ATOM 423 CD1 PHE A 29 -6.439 -4.465 -0.630 1.00 0.00 C ATOM 424 CD2 PHE A 29 -6.632 -5.559 -2.740 1.00 0.00 C ATOM 425 CE1 PHE A 29 -7.596 -3.755 -0.888 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.790 -4.852 -3.004 1.00 0.00 C ATOM 427 CZ PHE A 29 -8.273 -3.949 -2.077 1.00 0.00 C ATOM 0 H PHE A 29 -3.704 -5.283 0.875 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.738 -7.239 0.249 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -3.841 -5.451 -1.251 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -4.502 -6.840 -2.091 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -5.914 -4.309 0.301 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.259 -6.263 -3.469 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -7.971 -3.049 -0.161 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -8.317 -5.005 -3.934 1.00 0.00 H new ATOM 0 HZ PHE A 29 -9.178 -3.396 -2.281 1.00 0.00 H new ATOM 437 N LYS A 30 -4.440 -9.334 0.175 1.00 0.00 N ATOM 438 CA LYS A 30 -3.724 -10.606 0.111 1.00 0.00 C ATOM 439 C LYS A 30 -4.564 -11.663 -0.604 1.00 0.00 C ATOM 440 O LYS A 30 -5.777 -11.508 -0.746 1.00 0.00 O ATOM 441 CB LYS A 30 -3.362 -11.079 1.523 1.00 0.00 C ATOM 442 CG LYS A 30 -4.542 -11.098 2.487 1.00 0.00 C ATOM 443 CD LYS A 30 -4.100 -10.844 3.920 1.00 0.00 C ATOM 444 CE LYS A 30 -3.783 -12.142 4.648 1.00 0.00 C ATOM 445 NZ LYS A 30 -2.506 -12.749 4.181 1.00 0.00 N ATOM 0 H LYS A 30 -5.427 -9.420 0.416 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.806 -10.458 -0.457 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.938 -12.081 1.463 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.586 -10.428 1.926 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.267 -10.340 2.190 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.046 -12.063 2.427 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -3.220 -10.201 3.921 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -4.885 -10.309 4.454 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.722 -11.951 5.719 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -4.597 -12.850 4.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.172 -13.439 4.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -2.662 -13.229 3.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -1.791 -12.004 4.061 1.00 0.00 H new ATOM 459 N TYR A 31 -3.917 -12.736 -1.055 1.00 0.00 N ATOM 460 CA TYR A 31 -4.624 -13.802 -1.757 1.00 0.00 C ATOM 461 C TYR A 31 -4.675 -15.084 -0.927 1.00 0.00 C ATOM 462 O TYR A 31 -3.641 -15.641 -0.554 1.00 0.00 O ATOM 463 CB TYR A 31 -3.983 -14.071 -3.127 1.00 0.00 C ATOM 464 CG TYR A 31 -2.585 -14.653 -3.063 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.481 -13.837 -2.850 1.00 0.00 C ATOM 466 CD2 TYR A 31 -2.371 -16.017 -3.222 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.204 -14.363 -2.796 1.00 0.00 C ATOM 468 CE2 TYR A 31 -1.097 -16.551 -3.168 1.00 0.00 C ATOM 469 CZ TYR A 31 -0.017 -15.719 -2.956 1.00 0.00 C ATOM 470 OH TYR A 31 1.253 -16.249 -2.902 1.00 0.00 O ATOM 0 H TYR A 31 -2.914 -12.889 -0.948 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.649 -13.467 -1.913 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.622 -14.755 -3.685 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.949 -13.137 -3.688 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -1.623 -12.774 -2.725 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -3.214 -16.671 -3.391 1.00 0.00 H new ATOM 0 HE1 TYR A 31 0.643 -13.714 -2.629 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -0.948 -17.614 -3.291 1.00 0.00 H new ATOM 0 HH TYR A 31 1.208 -17.219 -3.033 1.00 0.00 H new ATOM 480 N ASP A 32 -5.894 -15.550 -0.652 1.00 0.00 N ATOM 481 CA ASP A 32 -6.095 -16.772 0.120 1.00 0.00 C ATOM 482 C ASP A 32 -6.225 -17.970 -0.818 1.00 0.00 C ATOM 483 O ASP A 32 -7.242 -18.131 -1.498 1.00 0.00 O ATOM 484 CB ASP A 32 -7.341 -16.651 1.007 1.00 0.00 C ATOM 485 CG ASP A 32 -7.161 -17.317 2.359 1.00 0.00 C ATOM 486 OD1 ASP A 32 -6.545 -16.695 3.249 1.00 0.00 O ATOM 487 OD2 ASP A 32 -7.636 -18.460 2.526 1.00 0.00 O ATOM 0 H ASP A 32 -6.757 -15.097 -0.954 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.229 -16.922 0.764 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.577 -15.597 1.154 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.192 -17.100 0.495 1.00 0.00 H new ATOM 492 N GLY A 33 -5.184 -18.801 -0.859 1.00 0.00 N ATOM 493 CA GLY A 33 -5.190 -19.969 -1.722 1.00 0.00 C ATOM 494 C GLY A 33 -4.921 -19.614 -3.172 1.00 0.00 C ATOM 495 O GLY A 33 -3.802 -19.786 -3.660 1.00 0.00 O ATOM 0 H GLY A 33 -4.334 -18.684 -0.307 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.436 -20.677 -1.377 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.155 -20.470 -1.646 1.00 0.00 H new ATOM 499 N SER A 34 -5.945 -19.112 -3.859 1.00 0.00 N ATOM 500 CA SER A 34 -5.815 -18.723 -5.264 1.00 0.00 C ATOM 501 C SER A 34 -6.791 -17.602 -5.620 1.00 0.00 C ATOM 502 O SER A 34 -7.297 -17.543 -6.744 1.00 0.00 O ATOM 503 CB SER A 34 -6.053 -19.929 -6.178 1.00 0.00 C ATOM 504 OG SER A 34 -5.267 -21.039 -5.781 1.00 0.00 O ATOM 0 H SER A 34 -6.875 -18.965 -3.467 1.00 0.00 H new ATOM 0 HA SER A 34 -4.800 -18.355 -5.414 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.108 -20.202 -6.157 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.814 -19.661 -7.207 1.00 0.00 H new ATOM 0 HG SER A 34 -5.441 -21.794 -6.381 1.00 0.00 H new ATOM 510 N THR A 35 -7.052 -16.713 -4.663 1.00 0.00 N ATOM 511 CA THR A 35 -7.967 -15.598 -4.883 1.00 0.00 C ATOM 512 C THR A 35 -7.494 -14.354 -4.133 1.00 0.00 C ATOM 513 O THR A 35 -7.298 -14.390 -2.918 1.00 0.00 O ATOM 514 CB THR A 35 -9.384 -15.981 -4.446 1.00 0.00 C ATOM 515 OG1 THR A 35 -10.241 -14.853 -4.467 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.447 -16.578 -3.055 1.00 0.00 C ATOM 0 H THR A 35 -6.643 -16.744 -3.729 1.00 0.00 H new ATOM 0 HA THR A 35 -7.980 -15.368 -5.948 1.00 0.00 H new ATOM 0 HB THR A 35 -9.707 -16.737 -5.162 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.141 -15.121 -4.186 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.480 -16.825 -2.812 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.839 -17.482 -3.019 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.067 -15.857 -2.332 1.00 0.00 H new ATOM 524 N ILE A 36 -7.307 -13.260 -4.868 1.00 0.00 N ATOM 525 CA ILE A 36 -6.849 -12.004 -4.279 1.00 0.00 C ATOM 526 C ILE A 36 -8.018 -11.202 -3.714 1.00 0.00 C ATOM 527 O ILE A 36 -8.992 -10.930 -4.419 1.00 0.00 O ATOM 528 CB ILE A 36 -6.087 -11.142 -5.309 1.00 0.00 C ATOM 529 CG1 ILE A 36 -5.008 -11.974 -6.000 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.471 -9.924 -4.633 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.770 -11.591 -7.443 1.00 0.00 C ATOM 0 H ILE A 36 -7.466 -13.218 -5.875 1.00 0.00 H new ATOM 0 HA ILE A 36 -6.169 -12.264 -3.467 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.794 -10.795 -6.063 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -4.074 -11.870 -5.448 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.290 -13.026 -5.955 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.938 -9.328 -5.373 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -6.259 -9.321 -4.181 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.775 -10.250 -3.860 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.991 -12.226 -7.864 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.691 -11.722 -8.011 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.456 -10.548 -7.496 1.00 0.00 H new ATOM 543 N VAL A 37 -7.911 -10.828 -2.439 1.00 0.00 N ATOM 544 CA VAL A 37 -8.959 -10.061 -1.771 1.00 0.00 C ATOM 545 C VAL A 37 -8.379 -9.129 -0.703 1.00 0.00 C ATOM 546 O VAL A 37 -7.284 -9.363 -0.189 1.00 0.00 O ATOM 547 CB VAL A 37 -10.009 -10.989 -1.121 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.910 -11.604 -2.180 1.00 0.00 C ATOM 549 CG2 VAL A 37 -9.333 -12.076 -0.296 1.00 0.00 C ATOM 0 H VAL A 37 -7.108 -11.045 -1.849 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.444 -9.459 -2.540 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.626 -10.388 -0.453 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -11.642 -12.254 -1.702 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -11.427 -10.812 -2.722 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -10.307 -12.187 -2.876 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -10.092 -12.717 0.152 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.687 -12.673 -0.940 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.735 -11.617 0.491 1.00 0.00 H new ATOM 559 N PRO A 38 -9.114 -8.057 -0.355 1.00 0.00 N ATOM 560 CA PRO A 38 -8.673 -7.088 0.659 1.00 0.00 C ATOM 561 C PRO A 38 -8.590 -7.706 2.054 1.00 0.00 C ATOM 562 O PRO A 38 -9.246 -8.711 2.335 1.00 0.00 O ATOM 563 CB PRO A 38 -9.756 -6.005 0.616 1.00 0.00 C ATOM 564 CG PRO A 38 -10.954 -6.682 0.046 1.00 0.00 C ATOM 565 CD PRO A 38 -10.433 -7.710 -0.916 1.00 0.00 C ATOM 0 HA PRO A 38 -7.671 -6.713 0.454 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.961 -5.612 1.612 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -9.447 -5.162 -0.002 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -11.548 -7.149 0.831 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.602 -5.967 -0.461 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -11.089 -8.579 -0.971 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -10.348 -7.310 -1.926 1.00 0.00 H new ATOM 573 N GLY A 39 -7.776 -7.102 2.921 1.00 0.00 N ATOM 574 CA GLY A 39 -7.613 -7.604 4.266 1.00 0.00 C ATOM 575 C GLY A 39 -7.745 -6.514 5.306 1.00 0.00 C ATOM 576 O GLY A 39 -8.397 -5.501 5.068 1.00 0.00 O ATOM 0 H GLY A 39 -7.226 -6.270 2.708 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.358 -8.376 4.456 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.635 -8.075 4.359 1.00 0.00 H new ATOM 580 N GLU A 40 -7.113 -6.742 6.455 1.00 0.00 N ATOM 581 CA GLU A 40 -7.130 -5.813 7.592 1.00 0.00 C ATOM 582 C GLU A 40 -7.327 -4.366 7.150 1.00 0.00 C ATOM 583 O GLU A 40 -6.668 -3.893 6.228 1.00 0.00 O ATOM 584 CB GLU A 40 -5.836 -5.932 8.401 1.00 0.00 C ATOM 585 CG GLU A 40 -5.794 -7.135 9.335 1.00 0.00 C ATOM 586 CD GLU A 40 -5.644 -8.452 8.595 1.00 0.00 C ATOM 587 OE1 GLU A 40 -4.761 -8.544 7.713 1.00 0.00 O ATOM 588 OE2 GLU A 40 -6.412 -9.391 8.893 1.00 0.00 O ATOM 0 H GLU A 40 -6.567 -7.586 6.629 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.979 -6.091 8.217 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.994 -5.991 7.712 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.703 -5.024 8.989 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.964 -7.019 10.032 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.708 -7.160 9.929 1.00 0.00 H new ATOM 595 N GLN A 41 -8.240 -3.675 7.823 1.00 0.00 N ATOM 596 CA GLN A 41 -8.534 -2.278 7.516 1.00 0.00 C ATOM 597 C GLN A 41 -8.604 -1.461 8.800 1.00 0.00 C ATOM 598 O GLN A 41 -9.630 -1.443 9.483 1.00 0.00 O ATOM 599 CB GLN A 41 -9.852 -2.154 6.743 1.00 0.00 C ATOM 600 CG GLN A 41 -10.081 -3.264 5.730 1.00 0.00 C ATOM 601 CD GLN A 41 -11.259 -2.984 4.817 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.330 -2.589 5.275 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.070 -3.192 3.519 1.00 0.00 N ATOM 0 H GLN A 41 -8.792 -4.061 8.589 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.730 -1.891 6.890 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.679 -2.148 7.453 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.869 -1.195 6.226 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.182 -3.393 5.128 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -10.249 -4.203 6.257 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.165 -3.520 3.182 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.830 -3.024 2.860 1.00 0.00 H new ATOM 612 N GLY A 42 -7.499 -0.800 9.130 1.00 0.00 N ATOM 613 CA GLY A 42 -7.450 -0.002 10.342 1.00 0.00 C ATOM 614 C GLY A 42 -6.935 1.405 10.112 1.00 0.00 C ATOM 615 O GLY A 42 -6.346 1.698 9.070 1.00 0.00 O ATOM 0 H GLY A 42 -6.639 -0.802 8.582 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.449 0.050 10.775 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.812 -0.501 11.072 1.00 0.00 H new ATOM 619 N ALA A 43 -7.156 2.270 11.099 1.00 0.00 N ATOM 620 CA ALA A 43 -6.707 3.657 11.028 1.00 0.00 C ATOM 621 C ALA A 43 -5.321 3.819 11.656 1.00 0.00 C ATOM 622 O ALA A 43 -4.640 4.817 11.420 1.00 0.00 O ATOM 623 CB ALA A 43 -7.713 4.574 11.712 1.00 0.00 C ATOM 0 H ALA A 43 -7.646 2.032 11.961 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.635 3.938 9.977 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.365 5.605 11.651 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.680 4.487 11.216 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.815 4.286 12.758 1.00 0.00 H new ATOM 629 N GLU A 44 -4.909 2.831 12.456 1.00 0.00 N ATOM 630 CA GLU A 44 -3.607 2.866 13.113 1.00 0.00 C ATOM 631 C GLU A 44 -2.556 2.157 12.264 1.00 0.00 C ATOM 632 O GLU A 44 -2.762 1.021 11.829 1.00 0.00 O ATOM 633 CB GLU A 44 -3.694 2.208 14.491 1.00 0.00 C ATOM 634 CG GLU A 44 -4.351 3.083 15.546 1.00 0.00 C ATOM 635 CD GLU A 44 -3.341 3.777 16.438 1.00 0.00 C ATOM 636 OE1 GLU A 44 -2.768 3.106 17.321 1.00 0.00 O ATOM 637 OE2 GLU A 44 -3.120 4.992 16.250 1.00 0.00 O ATOM 0 H GLU A 44 -5.461 1.999 12.662 1.00 0.00 H new ATOM 0 HA GLU A 44 -3.311 3.908 13.233 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.254 1.277 14.404 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -2.689 1.946 14.823 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.973 3.832 15.056 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.013 2.472 16.160 1.00 0.00 H new ATOM 644 N TYR A 45 -1.429 2.829 12.035 1.00 0.00 N ATOM 645 CA TYR A 45 -0.345 2.257 11.240 1.00 0.00 C ATOM 646 C TYR A 45 0.474 1.243 12.043 1.00 0.00 C ATOM 647 O TYR A 45 1.228 0.460 11.463 1.00 0.00 O ATOM 648 CB TYR A 45 0.575 3.355 10.706 1.00 0.00 C ATOM 649 CG TYR A 45 1.419 2.904 9.535 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.885 2.838 8.256 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.747 2.535 9.712 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.650 2.416 7.184 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.518 2.115 8.647 1.00 0.00 C ATOM 654 CZ TYR A 45 2.966 2.057 7.385 1.00 0.00 C ATOM 655 OH TYR A 45 3.729 1.631 6.320 1.00 0.00 O ATOM 0 H TYR A 45 -1.243 3.768 12.388 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.805 1.735 10.401 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -0.028 4.211 10.403 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.230 3.695 11.509 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.145 3.121 8.095 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.183 2.578 10.699 1.00 0.00 H new ATOM 0 HE1 TYR A 45 1.219 2.368 6.195 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.549 1.833 8.802 1.00 0.00 H new ATOM 0 HH TYR A 45 3.403 0.759 6.012 1.00 0.00 H new ATOM 665 N GLN A 46 0.322 1.253 13.372 1.00 0.00 N ATOM 666 CA GLN A 46 1.049 0.322 14.238 1.00 0.00 C ATOM 667 C GLN A 46 0.939 -1.108 13.708 1.00 0.00 C ATOM 668 O GLN A 46 1.921 -1.852 13.696 1.00 0.00 O ATOM 669 CB GLN A 46 0.507 0.396 15.669 1.00 0.00 C ATOM 670 CG GLN A 46 1.213 1.425 16.540 1.00 0.00 C ATOM 671 CD GLN A 46 1.147 2.828 15.964 1.00 0.00 C ATOM 672 OE1 GLN A 46 0.185 3.559 16.192 1.00 0.00 O ATOM 673 NE2 GLN A 46 2.173 3.212 15.210 1.00 0.00 N ATOM 0 H GLN A 46 -0.296 1.894 13.869 1.00 0.00 H new ATOM 0 HA GLN A 46 2.101 0.609 14.242 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -0.556 0.632 15.633 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.600 -0.585 16.134 1.00 0.00 H new ATOM 0 HG2 GLN A 46 0.764 1.423 17.533 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.257 1.136 16.662 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.952 2.574 15.046 1.00 0.00 H new ATOM 0 HE22 GLN A 46 2.181 4.144 14.796 1.00 0.00 H new ATOM 682 N HIS A 47 -0.261 -1.473 13.256 1.00 0.00 N ATOM 683 CA HIS A 47 -0.508 -2.803 12.706 1.00 0.00 C ATOM 684 C HIS A 47 0.221 -2.982 11.376 1.00 0.00 C ATOM 685 O HIS A 47 0.751 -4.057 11.092 1.00 0.00 O ATOM 686 CB HIS A 47 -2.009 -3.026 12.510 1.00 0.00 C ATOM 687 CG HIS A 47 -2.714 -3.511 13.741 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.089 -3.663 14.962 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.004 -3.882 13.933 1.00 0.00 C ATOM 690 CE1 HIS A 47 -2.961 -4.107 15.849 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.130 -4.248 15.251 1.00 0.00 N ATOM 0 H HIS A 47 -1.078 -0.863 13.261 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.128 -3.540 13.414 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.466 -2.092 12.185 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.158 -3.749 11.708 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.786 -3.889 13.189 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.753 -4.319 16.887 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.987 -4.576 15.696 1.00 0.00 H new ATOM 700 N PHE A 48 0.250 -1.920 10.569 1.00 0.00 N ATOM 701 CA PHE A 48 0.919 -1.950 9.273 1.00 0.00 C ATOM 702 C PHE A 48 2.396 -2.313 9.425 1.00 0.00 C ATOM 703 O PHE A 48 2.917 -3.150 8.686 1.00 0.00 O ATOM 704 CB PHE A 48 0.784 -0.593 8.579 1.00 0.00 C ATOM 705 CG PHE A 48 0.891 -0.671 7.085 1.00 0.00 C ATOM 706 CD1 PHE A 48 2.111 -0.915 6.478 1.00 0.00 C ATOM 707 CD2 PHE A 48 -0.228 -0.501 6.289 1.00 0.00 C ATOM 708 CE1 PHE A 48 2.215 -0.988 5.104 1.00 0.00 C ATOM 709 CE2 PHE A 48 -0.132 -0.573 4.913 1.00 0.00 C ATOM 710 CZ PHE A 48 1.091 -0.817 4.320 1.00 0.00 C ATOM 0 H PHE A 48 -0.185 -1.025 10.794 1.00 0.00 H new ATOM 0 HA PHE A 48 0.440 -2.715 8.663 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.177 -0.153 8.844 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.556 0.077 8.956 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.992 -1.050 7.087 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -1.187 -0.310 6.748 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.173 -1.178 4.643 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -1.012 -0.439 4.302 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.168 -0.874 3.244 1.00 0.00 H new ATOM 720 N ILE A 49 3.061 -1.679 10.393 1.00 0.00 N ATOM 721 CA ILE A 49 4.479 -1.932 10.655 1.00 0.00 C ATOM 722 C ILE A 49 4.698 -3.362 11.150 1.00 0.00 C ATOM 723 O ILE A 49 5.604 -4.058 10.688 1.00 0.00 O ATOM 724 CB ILE A 49 5.046 -0.948 11.707 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.731 0.498 11.316 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.548 -1.141 11.872 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.990 1.496 12.424 1.00 0.00 C ATOM 0 H ILE A 49 2.639 -0.985 11.010 1.00 0.00 H new ATOM 0 HA ILE A 49 5.005 -1.787 9.711 1.00 0.00 H new ATOM 0 HB ILE A 49 4.567 -1.159 12.663 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.330 0.769 10.447 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.685 0.565 11.016 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.925 -0.439 12.616 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.750 -2.161 12.200 1.00 0.00 H new ATOM 0 HG23 ILE A 49 7.045 -0.961 10.919 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.745 2.499 12.075 1.00 0.00 H new ATOM 0 HD12 ILE A 49 4.371 1.250 13.287 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.041 1.458 12.709 1.00 0.00 H new ATOM 739 N GLN A 50 3.862 -3.783 12.099 1.00 0.00 N ATOM 740 CA GLN A 50 3.949 -5.122 12.680 1.00 0.00 C ATOM 741 C GLN A 50 3.674 -6.215 11.643 1.00 0.00 C ATOM 742 O GLN A 50 4.317 -7.266 11.660 1.00 0.00 O ATOM 743 CB GLN A 50 2.961 -5.244 13.843 1.00 0.00 C ATOM 744 CG GLN A 50 3.483 -6.067 15.010 1.00 0.00 C ATOM 745 CD GLN A 50 3.158 -5.444 16.355 1.00 0.00 C ATOM 746 OE1 GLN A 50 4.052 -5.015 17.085 1.00 0.00 O ATOM 747 NE2 GLN A 50 1.873 -5.386 16.692 1.00 0.00 N ATOM 0 H GLN A 50 3.111 -3.210 12.484 1.00 0.00 H new ATOM 0 HA GLN A 50 4.967 -5.263 13.042 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.709 -4.245 14.199 1.00 0.00 H new ATOM 0 HB3 GLN A 50 2.038 -5.694 13.477 1.00 0.00 H new ATOM 0 HG2 GLN A 50 3.054 -7.068 14.964 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.563 -6.178 14.917 1.00 0.00 H new ATOM 0 HE21 GLN A 50 1.163 -5.753 16.059 1.00 0.00 H new ATOM 0 HE22 GLN A 50 1.598 -4.975 17.584 1.00 0.00 H new ATOM 756 N GLN A 51 2.714 -5.967 10.749 1.00 0.00 N ATOM 757 CA GLN A 51 2.354 -6.938 9.715 1.00 0.00 C ATOM 758 C GLN A 51 3.387 -6.975 8.586 1.00 0.00 C ATOM 759 O GLN A 51 3.589 -8.018 7.962 1.00 0.00 O ATOM 760 CB GLN A 51 0.971 -6.618 9.141 1.00 0.00 C ATOM 761 CG GLN A 51 -0.084 -7.659 9.480 1.00 0.00 C ATOM 762 CD GLN A 51 -0.827 -7.342 10.763 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.993 -6.948 10.734 1.00 0.00 O ATOM 764 NE2 GLN A 51 -0.159 -7.517 11.899 1.00 0.00 N ATOM 0 H GLN A 51 2.173 -5.103 10.721 1.00 0.00 H new ATOM 0 HA GLN A 51 2.334 -7.921 10.185 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.646 -5.648 9.517 1.00 0.00 H new ATOM 0 HB3 GLN A 51 1.048 -6.530 8.057 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -0.798 -7.728 8.659 1.00 0.00 H new ATOM 0 HG3 GLN A 51 0.391 -8.636 9.572 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.806 -7.845 11.878 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -0.612 -7.323 12.792 1.00 0.00 H new ATOM 773 N CYS A 52 4.027 -5.836 8.320 1.00 0.00 N ATOM 774 CA CYS A 52 5.028 -5.749 7.256 1.00 0.00 C ATOM 775 C CYS A 52 6.359 -6.378 7.682 1.00 0.00 C ATOM 776 O CYS A 52 7.330 -5.672 7.962 1.00 0.00 O ATOM 777 CB CYS A 52 5.238 -4.288 6.844 1.00 0.00 C ATOM 778 SG CYS A 52 4.157 -3.739 5.503 1.00 0.00 S ATOM 0 H CYS A 52 3.871 -4.963 8.825 1.00 0.00 H new ATOM 0 HA CYS A 52 4.654 -6.311 6.400 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.075 -3.649 7.712 1.00 0.00 H new ATOM 0 HB3 CYS A 52 6.276 -4.153 6.539 1.00 0.00 H new ATOM 0 HG CYS A 52 3.583 -2.622 5.838 1.00 0.00 H new ATOM 784 N THR A 53 6.395 -7.709 7.717 1.00 0.00 N ATOM 785 CA THR A 53 7.603 -8.445 8.095 1.00 0.00 C ATOM 786 C THR A 53 8.327 -8.966 6.854 1.00 0.00 C ATOM 787 O THR A 53 7.689 -9.343 5.868 1.00 0.00 O ATOM 788 CB THR A 53 7.250 -9.611 9.025 1.00 0.00 C ATOM 789 OG1 THR A 53 6.005 -10.184 8.661 1.00 0.00 O ATOM 790 CG2 THR A 53 7.163 -9.209 10.482 1.00 0.00 C ATOM 0 H THR A 53 5.598 -8.303 7.487 1.00 0.00 H new ATOM 0 HA THR A 53 8.267 -7.761 8.624 1.00 0.00 H new ATOM 0 HB THR A 53 8.063 -10.328 8.911 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.798 -10.927 9.265 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.910 -10.081 11.085 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.123 -8.809 10.807 1.00 0.00 H new ATOM 0 HG23 THR A 53 6.393 -8.447 10.604 1.00 0.00 H new ATOM 798 N ASP A 54 9.660 -8.977 6.903 1.00 0.00 N ATOM 799 CA ASP A 54 10.473 -9.440 5.781 1.00 0.00 C ATOM 800 C ASP A 54 10.473 -10.969 5.676 1.00 0.00 C ATOM 801 O ASP A 54 11.510 -11.614 5.844 1.00 0.00 O ATOM 802 CB ASP A 54 11.911 -8.917 5.918 1.00 0.00 C ATOM 803 CG ASP A 54 12.506 -9.172 7.294 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.097 -8.488 8.255 1.00 0.00 O ATOM 805 OD2 ASP A 54 13.383 -10.053 7.407 1.00 0.00 O ATOM 0 H ASP A 54 10.200 -8.669 7.712 1.00 0.00 H new ATOM 0 HA ASP A 54 10.032 -9.045 4.866 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.538 -9.392 5.163 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.923 -7.846 5.715 1.00 0.00 H new ATOM 810 N ASP A 55 9.305 -11.547 5.393 1.00 0.00 N ATOM 811 CA ASP A 55 9.174 -13.000 5.265 1.00 0.00 C ATOM 812 C ASP A 55 7.821 -13.376 4.665 1.00 0.00 C ATOM 813 O ASP A 55 7.154 -14.293 5.145 1.00 0.00 O ATOM 814 CB ASP A 55 9.343 -13.659 6.637 1.00 0.00 C ATOM 815 CG ASP A 55 10.056 -14.997 6.567 1.00 0.00 C ATOM 816 OD1 ASP A 55 9.555 -15.904 5.870 1.00 0.00 O ATOM 817 OD2 ASP A 55 11.118 -15.135 7.212 1.00 0.00 O ATOM 0 H ASP A 55 8.436 -11.032 5.248 1.00 0.00 H new ATOM 0 HA ASP A 55 9.954 -13.359 4.594 1.00 0.00 H new ATOM 0 HB2 ASP A 55 9.902 -12.989 7.290 1.00 0.00 H new ATOM 0 HB3 ASP A 55 8.362 -13.799 7.090 1.00 0.00 H new ATOM 822 N VAL A 56 7.424 -12.659 3.612 1.00 0.00 N ATOM 823 CA VAL A 56 6.142 -12.902 2.937 1.00 0.00 C ATOM 824 C VAL A 56 5.890 -11.854 1.854 1.00 0.00 C ATOM 825 O VAL A 56 6.736 -10.999 1.604 1.00 0.00 O ATOM 826 CB VAL A 56 4.939 -12.886 3.924 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.550 -14.301 4.330 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.237 -12.034 5.153 1.00 0.00 C ATOM 0 H VAL A 56 7.973 -11.902 3.205 1.00 0.00 H new ATOM 0 HA VAL A 56 6.217 -13.895 2.493 1.00 0.00 H new ATOM 0 HB VAL A 56 4.094 -12.435 3.404 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.707 -14.263 5.020 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.268 -14.869 3.444 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.396 -14.785 4.817 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.376 -12.045 5.821 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.105 -12.438 5.674 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.443 -11.009 4.844 1.00 0.00 H new ATOM 838 N ARG A 57 4.720 -11.919 1.221 1.00 0.00 N ATOM 839 CA ARG A 57 4.355 -10.967 0.176 1.00 0.00 C ATOM 840 C ARG A 57 2.883 -10.578 0.299 1.00 0.00 C ATOM 841 O ARG A 57 1.993 -11.407 0.102 1.00 0.00 O ATOM 842 CB ARG A 57 4.641 -11.552 -1.213 1.00 0.00 C ATOM 843 CG ARG A 57 3.972 -12.896 -1.473 1.00 0.00 C ATOM 844 CD ARG A 57 4.784 -14.048 -0.900 1.00 0.00 C ATOM 845 NE ARG A 57 3.998 -14.881 0.012 1.00 0.00 N ATOM 846 CZ ARG A 57 4.462 -15.983 0.604 1.00 0.00 C ATOM 847 NH1 ARG A 57 5.707 -16.393 0.383 1.00 0.00 N ATOM 848 NH2 ARG A 57 3.679 -16.676 1.423 1.00 0.00 N ATOM 0 H ARG A 57 4.008 -12.623 1.415 1.00 0.00 H new ATOM 0 HA ARG A 57 4.962 -10.070 0.302 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.310 -10.841 -1.970 1.00 0.00 H new ATOM 0 HB3 ARG A 57 5.718 -11.666 -1.333 1.00 0.00 H new ATOM 0 HG2 ARG A 57 2.975 -12.898 -1.032 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.845 -13.038 -2.546 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.163 -14.664 -1.716 1.00 0.00 H new ATOM 0 HD3 ARG A 57 5.650 -13.651 -0.371 1.00 0.00 H new ATOM 0 HE ARG A 57 3.037 -14.602 0.207 1.00 0.00 H new ATOM 0 HH11 ARG A 57 6.315 -15.864 -0.243 1.00 0.00 H new ATOM 0 HH12 ARG A 57 6.055 -17.236 0.839 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.723 -16.366 1.599 1.00 0.00 H new ATOM 0 HH22 ARG A 57 4.033 -17.519 1.876 1.00 0.00 H new ATOM 862 N LEU A 58 2.630 -9.317 0.641 1.00 0.00 N ATOM 863 CA LEU A 58 1.261 -8.833 0.803 1.00 0.00 C ATOM 864 C LEU A 58 1.129 -7.376 0.370 1.00 0.00 C ATOM 865 O LEU A 58 1.999 -6.549 0.653 1.00 0.00 O ATOM 866 CB LEU A 58 0.810 -8.992 2.259 1.00 0.00 C ATOM 867 CG LEU A 58 1.823 -8.533 3.314 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.201 -7.496 4.237 1.00 0.00 C ATOM 869 CD2 LEU A 58 2.337 -9.722 4.113 1.00 0.00 C ATOM 0 H LEU A 58 3.350 -8.615 0.811 1.00 0.00 H new ATOM 0 HA LEU A 58 0.618 -9.434 0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.114 -8.431 2.399 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.576 -10.042 2.437 1.00 0.00 H new ATOM 0 HG LEU A 58 2.668 -8.072 2.802 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.935 -7.182 4.979 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.884 -6.632 3.653 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.338 -7.929 4.742 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.055 -9.377 4.857 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.502 -10.212 4.614 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.823 -10.430 3.441 1.00 0.00 H new ATOM 881 N PHE A 59 0.025 -7.074 -0.307 1.00 0.00 N ATOM 882 CA PHE A 59 -0.249 -5.720 -0.777 1.00 0.00 C ATOM 883 C PHE A 59 -0.926 -4.912 0.321 1.00 0.00 C ATOM 884 O PHE A 59 -1.761 -5.436 1.058 1.00 0.00 O ATOM 885 CB PHE A 59 -1.143 -5.756 -2.021 1.00 0.00 C ATOM 886 CG PHE A 59 -0.559 -6.530 -3.170 1.00 0.00 C ATOM 887 CD1 PHE A 59 -0.599 -7.916 -3.182 1.00 0.00 C ATOM 888 CD2 PHE A 59 0.031 -5.872 -4.236 1.00 0.00 C ATOM 889 CE1 PHE A 59 -0.061 -8.629 -4.238 1.00 0.00 C ATOM 890 CE2 PHE A 59 0.569 -6.579 -5.293 1.00 0.00 C ATOM 891 CZ PHE A 59 0.523 -7.960 -5.294 1.00 0.00 C ATOM 0 H PHE A 59 -0.698 -7.753 -0.543 1.00 0.00 H new ATOM 0 HA PHE A 59 0.697 -5.246 -1.038 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -2.105 -6.194 -1.753 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.338 -4.734 -2.346 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -1.055 -8.444 -2.358 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.071 -4.793 -4.241 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -0.098 -9.708 -4.236 1.00 0.00 H new ATOM 0 HE2 PHE A 59 1.025 -6.053 -6.118 1.00 0.00 H new ATOM 0 HZ PHE A 59 0.943 -8.515 -6.120 1.00 0.00 H new ATOM 901 N ALA A 60 -0.568 -3.638 0.437 1.00 0.00 N ATOM 902 CA ALA A 60 -1.157 -2.776 1.455 1.00 0.00 C ATOM 903 C ALA A 60 -0.977 -1.306 1.103 1.00 0.00 C ATOM 904 O ALA A 60 0.143 -0.794 1.086 1.00 0.00 O ATOM 905 CB ALA A 60 -0.556 -3.082 2.821 1.00 0.00 C ATOM 0 H ALA A 60 0.123 -3.181 -0.158 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.227 -2.979 1.493 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.006 -2.431 3.570 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.752 -4.122 3.080 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.520 -2.912 2.791 1.00 0.00 H new ATOM 911 N PHE A 61 -2.088 -0.630 0.823 1.00 0.00 N ATOM 912 CA PHE A 61 -2.052 0.785 0.473 1.00 0.00 C ATOM 913 C PHE A 61 -2.787 1.619 1.519 1.00 0.00 C ATOM 914 O PHE A 61 -3.653 1.114 2.237 1.00 0.00 O ATOM 915 CB PHE A 61 -2.654 1.009 -0.921 1.00 0.00 C ATOM 916 CG PHE A 61 -4.157 1.003 -0.959 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.870 2.174 -0.753 1.00 0.00 C ATOM 918 CD2 PHE A 61 -4.856 -0.167 -1.203 1.00 0.00 C ATOM 919 CE1 PHE A 61 -6.249 2.179 -0.788 1.00 0.00 C ATOM 920 CE2 PHE A 61 -6.238 -0.170 -1.240 1.00 0.00 C ATOM 921 CZ PHE A 61 -6.935 1.004 -1.032 1.00 0.00 C ATOM 0 H PHE A 61 -3.022 -1.039 0.832 1.00 0.00 H new ATOM 0 HA PHE A 61 -1.011 1.107 0.453 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.297 1.963 -1.308 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.283 0.234 -1.592 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.339 3.095 -0.563 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.316 -1.088 -1.366 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.791 3.099 -0.625 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.772 -1.089 -1.431 1.00 0.00 H new ATOM 0 HZ PHE A 61 -8.015 1.004 -1.060 1.00 0.00 H new ATOM 931 N VAL A 62 -2.429 2.896 1.604 1.00 0.00 N ATOM 932 CA VAL A 62 -3.044 3.804 2.564 1.00 0.00 C ATOM 933 C VAL A 62 -3.334 5.162 1.928 1.00 0.00 C ATOM 934 O VAL A 62 -2.621 5.598 1.019 1.00 0.00 O ATOM 935 CB VAL A 62 -2.145 3.992 3.808 1.00 0.00 C ATOM 936 CG1 VAL A 62 -0.815 4.628 3.429 1.00 0.00 C ATOM 937 CG2 VAL A 62 -2.853 4.820 4.870 1.00 0.00 C ATOM 0 H VAL A 62 -1.714 3.326 1.017 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.986 3.355 2.877 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.942 3.006 4.225 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.202 4.749 4.322 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.295 3.988 2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.994 5.604 2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.200 4.938 5.735 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.097 5.801 4.463 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -3.770 4.315 5.174 1.00 0.00 H new ATOM 947 N ARG A 63 -4.381 5.827 2.412 1.00 0.00 N ATOM 948 CA ARG A 63 -4.767 7.137 1.894 1.00 0.00 C ATOM 949 C ARG A 63 -4.436 8.235 2.902 1.00 0.00 C ATOM 950 O ARG A 63 -5.039 8.308 3.975 1.00 0.00 O ATOM 951 CB ARG A 63 -6.263 7.162 1.562 1.00 0.00 C ATOM 952 CG ARG A 63 -6.709 6.016 0.666 1.00 0.00 C ATOM 953 CD ARG A 63 -8.016 6.338 -0.043 1.00 0.00 C ATOM 954 NE ARG A 63 -8.606 5.155 -0.669 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.445 5.195 -1.707 1.00 0.00 C ATOM 956 NH1 ARG A 63 -9.811 6.360 -2.237 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.926 4.065 -2.213 1.00 0.00 N ATOM 0 H ARG A 63 -4.978 5.479 3.163 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.201 7.322 0.981 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.833 7.129 2.491 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.502 8.107 1.075 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.935 5.808 -0.073 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.831 5.112 1.263 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.722 6.760 0.672 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -7.838 7.099 -0.802 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.361 4.241 -0.288 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.450 7.232 -1.850 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -10.452 6.381 -3.030 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -9.654 3.169 -1.809 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -10.567 4.093 -3.006 1.00 0.00 H new ATOM 971 N PHE A 64 -3.474 9.087 2.550 1.00 0.00 N ATOM 972 CA PHE A 64 -3.059 10.184 3.421 1.00 0.00 C ATOM 973 C PHE A 64 -3.455 11.530 2.827 1.00 0.00 C ATOM 974 O PHE A 64 -3.297 11.756 1.626 1.00 0.00 O ATOM 975 CB PHE A 64 -1.543 10.152 3.646 1.00 0.00 C ATOM 976 CG PHE A 64 -1.070 9.011 4.506 1.00 0.00 C ATOM 977 CD1 PHE A 64 -1.779 8.628 5.635 1.00 0.00 C ATOM 978 CD2 PHE A 64 0.090 8.326 4.185 1.00 0.00 C ATOM 979 CE1 PHE A 64 -1.339 7.584 6.425 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.535 7.280 4.971 1.00 0.00 C ATOM 981 CZ PHE A 64 -0.180 6.909 6.093 1.00 0.00 C ATOM 0 H PHE A 64 -2.967 9.038 1.666 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.566 10.057 4.377 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.045 10.093 2.678 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.236 11.091 4.107 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.686 9.152 5.899 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.654 8.613 3.310 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -1.900 7.296 7.301 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.441 6.753 4.708 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.166 6.093 6.710 1.00 0.00 H new ATOM 991 N THR A 65 -3.958 12.424 3.673 1.00 0.00 N ATOM 992 CA THR A 65 -4.364 13.754 3.229 1.00 0.00 C ATOM 993 C THR A 65 -3.220 14.752 3.411 1.00 0.00 C ATOM 994 O THR A 65 -2.600 14.813 4.474 1.00 0.00 O ATOM 995 CB THR A 65 -5.609 14.223 3.996 1.00 0.00 C ATOM 996 OG1 THR A 65 -6.072 15.470 3.499 1.00 0.00 O ATOM 997 CG2 THR A 65 -5.387 14.371 5.489 1.00 0.00 C ATOM 0 H THR A 65 -4.094 12.252 4.669 1.00 0.00 H new ATOM 0 HA THR A 65 -4.612 13.700 2.169 1.00 0.00 H new ATOM 0 HB THR A 65 -6.348 13.438 3.838 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.866 15.748 4.001 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.310 14.705 5.963 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.090 13.410 5.910 1.00 0.00 H new ATOM 0 HG23 THR A 65 -4.601 15.104 5.669 1.00 0.00 H new ATOM 1005 N THR A 66 -2.947 15.531 2.366 1.00 0.00 N ATOM 1006 CA THR A 66 -1.879 16.525 2.412 1.00 0.00 C ATOM 1007 C THR A 66 -2.355 17.853 1.829 1.00 0.00 C ATOM 1008 O THR A 66 -2.696 17.936 0.649 1.00 0.00 O ATOM 1009 CB THR A 66 -0.641 16.026 1.655 1.00 0.00 C ATOM 1010 OG1 THR A 66 -0.959 15.710 0.310 1.00 0.00 O ATOM 1011 CG2 THR A 66 -0.017 14.796 2.278 1.00 0.00 C ATOM 0 H THR A 66 -3.450 15.493 1.479 1.00 0.00 H new ATOM 0 HA THR A 66 -1.607 16.682 3.456 1.00 0.00 H new ATOM 0 HB THR A 66 0.074 16.847 1.706 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.733 16.239 0.024 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.853 14.495 1.695 1.00 0.00 H new ATOM 0 HG22 THR A 66 0.291 15.022 3.299 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.745 13.985 2.289 1.00 0.00 H new ATOM 1019 N GLY A 67 -2.382 18.887 2.669 1.00 0.00 N ATOM 1020 CA GLY A 67 -2.824 20.197 2.225 1.00 0.00 C ATOM 1021 C GLY A 67 -2.123 21.325 2.952 1.00 0.00 C ATOM 1022 O GLY A 67 -1.848 21.226 4.149 1.00 0.00 O ATOM 0 H GLY A 67 -2.105 18.839 3.650 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.645 20.293 1.154 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -3.900 20.284 2.377 1.00 0.00 H new ATOM 1026 N ASP A 68 -1.825 22.397 2.222 1.00 0.00 N ATOM 1027 CA ASP A 68 -1.145 23.555 2.788 1.00 0.00 C ATOM 1028 C ASP A 68 -1.892 24.849 2.459 1.00 0.00 C ATOM 1029 O ASP A 68 -1.507 25.583 1.548 1.00 0.00 O ATOM 1030 CB ASP A 68 0.293 23.628 2.263 1.00 0.00 C ATOM 1031 CG ASP A 68 0.497 22.851 0.974 1.00 0.00 C ATOM 1032 OD1 ASP A 68 0.108 23.363 -0.097 1.00 0.00 O ATOM 1033 OD2 ASP A 68 1.043 21.729 1.038 1.00 0.00 O ATOM 0 H ASP A 68 -2.046 22.486 1.230 1.00 0.00 H new ATOM 0 HA ASP A 68 -1.126 23.442 3.872 1.00 0.00 H new ATOM 0 HB2 ASP A 68 0.560 24.672 2.097 1.00 0.00 H new ATOM 0 HB3 ASP A 68 0.971 23.242 3.024 1.00 0.00 H new ATOM 1038 N ALA A 69 -2.962 25.115 3.220 1.00 0.00 N ATOM 1039 CA ALA A 69 -3.790 26.317 3.040 1.00 0.00 C ATOM 1040 C ALA A 69 -3.827 26.783 1.589 1.00 0.00 C ATOM 1041 O ALA A 69 -3.492 27.928 1.272 1.00 0.00 O ATOM 1042 CB ALA A 69 -3.301 27.432 3.939 1.00 0.00 C ATOM 0 H ALA A 69 -3.278 24.506 3.975 1.00 0.00 H new ATOM 0 HA ALA A 69 -4.810 26.051 3.319 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -3.923 28.315 3.795 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.360 27.113 4.980 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.267 27.672 3.691 1.00 0.00 H new ATOM 1048 N MET A 70 -4.233 25.876 0.722 1.00 0.00 N ATOM 1049 CA MET A 70 -4.323 26.148 -0.710 1.00 0.00 C ATOM 1050 C MET A 70 -5.054 25.013 -1.423 1.00 0.00 C ATOM 1051 O MET A 70 -5.951 25.252 -2.234 1.00 0.00 O ATOM 1052 CB MET A 70 -2.918 26.323 -1.301 1.00 0.00 C ATOM 1053 CG MET A 70 -2.901 26.567 -2.802 1.00 0.00 C ATOM 1054 SD MET A 70 -2.071 28.106 -3.247 1.00 0.00 S ATOM 1055 CE MET A 70 -1.123 27.584 -4.674 1.00 0.00 C ATOM 0 H MET A 70 -4.511 24.930 0.984 1.00 0.00 H new ATOM 0 HA MET A 70 -4.886 27.070 -0.855 1.00 0.00 H new ATOM 0 HB2 MET A 70 -2.427 27.159 -0.802 1.00 0.00 H new ATOM 0 HB3 MET A 70 -2.330 25.432 -1.082 1.00 0.00 H new ATOM 0 HG2 MET A 70 -2.402 25.734 -3.296 1.00 0.00 H new ATOM 0 HG3 MET A 70 -3.925 26.591 -3.174 1.00 0.00 H new ATOM 0 HE1 MET A 70 -0.555 28.429 -5.062 1.00 0.00 H new ATOM 0 HE2 MET A 70 -0.437 26.788 -4.384 1.00 0.00 H new ATOM 0 HE3 MET A 70 -1.799 27.216 -5.446 1.00 0.00 H new ATOM 1065 N SER A 71 -4.663 23.779 -1.107 1.00 0.00 N ATOM 1066 CA SER A 71 -5.275 22.598 -1.709 1.00 0.00 C ATOM 1067 C SER A 71 -5.151 21.388 -0.785 1.00 0.00 C ATOM 1068 O SER A 71 -4.229 20.581 -0.920 1.00 0.00 O ATOM 1069 CB SER A 71 -4.631 22.289 -3.067 1.00 0.00 C ATOM 1070 OG SER A 71 -4.843 23.344 -3.992 1.00 0.00 O ATOM 0 H SER A 71 -3.923 23.572 -0.436 1.00 0.00 H new ATOM 0 HA SER A 71 -6.333 22.810 -1.861 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.561 22.128 -2.936 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.046 21.364 -3.466 1.00 0.00 H new ATOM 0 HG SER A 71 -4.420 23.119 -4.847 1.00 0.00 H new ATOM 1076 N LYS A 72 -6.089 21.268 0.151 1.00 0.00 N ATOM 1077 CA LYS A 72 -6.091 20.154 1.093 1.00 0.00 C ATOM 1078 C LYS A 72 -7.047 19.059 0.624 1.00 0.00 C ATOM 1079 O LYS A 72 -8.246 19.298 0.462 1.00 0.00 O ATOM 1080 CB LYS A 72 -6.474 20.633 2.499 1.00 0.00 C ATOM 1081 CG LYS A 72 -7.889 21.185 2.599 1.00 0.00 C ATOM 1082 CD LYS A 72 -8.066 22.050 3.837 1.00 0.00 C ATOM 1083 CE LYS A 72 -8.088 23.531 3.488 1.00 0.00 C ATOM 1084 NZ LYS A 72 -9.458 24.000 3.138 1.00 0.00 N ATOM 0 H LYS A 72 -6.856 21.928 0.277 1.00 0.00 H new ATOM 0 HA LYS A 72 -5.083 19.740 1.135 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -6.369 19.802 3.196 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -5.771 21.404 2.813 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.115 21.772 1.709 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -8.601 20.360 2.626 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -8.995 21.780 4.340 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.255 21.853 4.538 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -7.712 24.108 4.332 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -7.416 23.716 2.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -9.429 25.014 2.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.808 23.467 2.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.094 23.847 3.946 1.00 0.00 H new ATOM 1098 N ARG A 73 -6.511 17.861 0.397 1.00 0.00 N ATOM 1099 CA ARG A 73 -7.321 16.736 -0.064 1.00 0.00 C ATOM 1100 C ARG A 73 -6.636 15.400 0.223 1.00 0.00 C ATOM 1101 O ARG A 73 -5.454 15.358 0.573 1.00 0.00 O ATOM 1102 CB ARG A 73 -7.601 16.869 -1.564 1.00 0.00 C ATOM 1103 CG ARG A 73 -9.042 16.568 -1.943 1.00 0.00 C ATOM 1104 CD ARG A 73 -9.140 15.988 -3.346 1.00 0.00 C ATOM 1105 NE ARG A 73 -10.211 14.998 -3.457 1.00 0.00 N ATOM 1106 CZ ARG A 73 -11.502 15.304 -3.603 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -11.895 16.574 -3.648 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -12.403 14.333 -3.700 1.00 0.00 N ATOM 0 H ARG A 73 -5.522 17.645 0.524 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.263 16.756 0.483 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.354 17.882 -1.883 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -6.942 16.194 -2.109 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.468 15.865 -1.227 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.633 17.482 -1.884 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.315 16.793 -4.060 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -8.190 15.526 -3.614 1.00 0.00 H new ATOM 0 HE ARG A 73 -9.955 14.011 -3.421 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -11.208 17.324 -3.571 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.884 16.798 -3.760 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.107 13.357 -3.663 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.390 14.563 -3.812 1.00 0.00 H new ATOM 1122 N SER A 74 -7.389 14.312 0.070 1.00 0.00 N ATOM 1123 CA SER A 74 -6.868 12.968 0.311 1.00 0.00 C ATOM 1124 C SER A 74 -6.052 12.471 -0.883 1.00 0.00 C ATOM 1125 O SER A 74 -6.426 12.686 -2.037 1.00 0.00 O ATOM 1126 CB SER A 74 -8.015 11.990 0.601 1.00 0.00 C ATOM 1127 OG SER A 74 -9.219 12.401 -0.026 1.00 0.00 O ATOM 0 H SER A 74 -8.366 14.336 -0.221 1.00 0.00 H new ATOM 0 HA SER A 74 -6.213 13.017 1.181 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.743 10.994 0.251 1.00 0.00 H new ATOM 0 HB3 SER A 74 -8.170 11.918 1.678 1.00 0.00 H new ATOM 0 HG SER A 74 -9.929 11.757 0.176 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.936 11.803 -0.590 1.00 0.00 N ATOM 1134 CA LYS A 75 -4.058 11.265 -1.628 1.00 0.00 C ATOM 1135 C LYS A 75 -3.967 9.744 -1.520 1.00 0.00 C ATOM 1136 O LYS A 75 -3.928 9.195 -0.417 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.658 11.877 -1.515 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.519 13.225 -2.206 1.00 0.00 C ATOM 1139 CD LYS A 75 -2.421 13.072 -3.717 1.00 0.00 C ATOM 1140 CE LYS A 75 -1.249 13.859 -4.286 1.00 0.00 C ATOM 1141 NZ LYS A 75 -0.059 12.996 -4.523 1.00 0.00 N ATOM 0 H LYS A 75 -4.618 11.621 0.362 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.481 11.524 -2.598 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.406 11.992 -0.461 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.933 11.184 -1.942 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.376 13.852 -1.958 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.631 13.736 -1.833 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -2.309 12.018 -3.970 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.347 13.414 -4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.549 14.328 -5.223 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -0.983 14.662 -3.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.794 13.589 -4.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.041 12.319 -3.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.179 12.476 -5.416 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.931 9.068 -2.668 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.843 7.609 -2.695 1.00 0.00 C ATOM 1157 C PHE A 76 -2.412 7.158 -2.978 1.00 0.00 C ATOM 1158 O PHE A 76 -1.727 7.740 -3.820 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.789 7.021 -3.752 1.00 0.00 C ATOM 1160 CG PHE A 76 -6.079 7.777 -3.924 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.761 8.282 -2.827 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.609 7.983 -5.189 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.946 8.975 -2.989 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.792 8.675 -5.356 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.461 9.172 -4.255 1.00 0.00 C ATOM 0 H PHE A 76 -3.961 9.506 -3.589 1.00 0.00 H new ATOM 0 HA PHE A 76 -4.143 7.242 -1.713 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.270 6.991 -4.710 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -5.020 5.990 -3.482 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -6.362 8.132 -1.835 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.090 7.597 -6.054 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.468 9.362 -2.127 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.194 8.827 -6.347 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.386 9.714 -4.384 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.969 6.121 -2.271 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.620 5.597 -2.450 1.00 0.00 C ATOM 1177 C ALA A 77 -0.576 4.089 -2.224 1.00 0.00 C ATOM 1178 O ALA A 77 -0.898 3.606 -1.137 1.00 0.00 O ATOM 1179 CB ALA A 77 0.349 6.301 -1.511 1.00 0.00 C ATOM 0 H ALA A 77 -2.524 5.629 -1.571 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.319 5.790 -3.480 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.352 5.900 -1.656 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.351 7.370 -1.725 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.038 6.138 -0.479 1.00 0.00 H new ATOM 1185 N LEU A 78 -0.170 3.353 -3.256 1.00 0.00 N ATOM 1186 CA LEU A 78 -0.075 1.899 -3.174 1.00 0.00 C ATOM 1187 C LEU A 78 1.331 1.477 -2.762 1.00 0.00 C ATOM 1188 O LEU A 78 2.303 1.760 -3.466 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.441 1.260 -4.515 1.00 0.00 C ATOM 1190 CG LEU A 78 -1.940 1.063 -4.755 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -2.510 2.220 -5.562 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -2.198 -0.260 -5.461 1.00 0.00 C ATOM 0 H LEU A 78 0.099 3.741 -4.160 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.780 1.554 -2.418 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.039 1.880 -5.316 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.052 0.291 -4.584 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.442 1.040 -3.788 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.576 2.061 -5.722 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.359 3.152 -5.018 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.003 2.276 -6.525 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.269 -0.383 -5.623 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.682 -0.267 -6.421 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.828 -1.079 -4.845 1.00 0.00 H new ATOM 1204 N ILE A 79 1.436 0.803 -1.618 1.00 0.00 N ATOM 1205 CA ILE A 79 2.730 0.351 -1.120 1.00 0.00 C ATOM 1206 C ILE A 79 2.807 -1.172 -1.096 1.00 0.00 C ATOM 1207 O ILE A 79 2.297 -1.819 -0.179 1.00 0.00 O ATOM 1208 CB ILE A 79 3.024 0.904 0.293 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.804 2.421 0.335 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.447 0.563 0.713 1.00 0.00 C ATOM 1211 CD1 ILE A 79 2.106 2.896 1.590 1.00 0.00 C ATOM 0 H ILE A 79 0.644 0.560 -1.023 1.00 0.00 H new ATOM 0 HA ILE A 79 3.484 0.737 -1.806 1.00 0.00 H new ATOM 0 HB ILE A 79 2.334 0.436 0.995 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.769 2.922 0.254 1.00 0.00 H new ATOM 0 HG13 ILE A 79 2.216 2.719 -0.533 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.637 0.960 1.710 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.574 -0.520 0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.150 1.004 0.007 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.984 3.978 1.551 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.127 2.423 1.663 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.704 2.629 2.462 1.00 0.00 H new ATOM 1223 N THR A 80 3.454 -1.737 -2.110 1.00 0.00 N ATOM 1224 CA THR A 80 3.611 -3.183 -2.212 1.00 0.00 C ATOM 1225 C THR A 80 4.748 -3.659 -1.314 1.00 0.00 C ATOM 1226 O THR A 80 5.892 -3.221 -1.463 1.00 0.00 O ATOM 1227 CB THR A 80 3.879 -3.593 -3.664 1.00 0.00 C ATOM 1228 OG1 THR A 80 4.391 -2.501 -4.411 1.00 0.00 O ATOM 1229 CG2 THR A 80 2.644 -4.098 -4.376 1.00 0.00 C ATOM 0 H THR A 80 3.879 -1.213 -2.875 1.00 0.00 H new ATOM 0 HA THR A 80 2.684 -3.653 -1.883 1.00 0.00 H new ATOM 0 HB THR A 80 4.606 -4.403 -3.607 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.992 -2.502 -5.306 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.900 -4.372 -5.399 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.254 -4.972 -3.853 1.00 0.00 H new ATOM 0 HG23 THR A 80 1.886 -3.315 -4.389 1.00 0.00 H new ATOM 1237 N TRP A 81 4.427 -4.548 -0.376 1.00 0.00 N ATOM 1238 CA TRP A 81 5.423 -5.073 0.551 1.00 0.00 C ATOM 1239 C TRP A 81 5.926 -6.443 0.103 1.00 0.00 C ATOM 1240 O TRP A 81 5.134 -7.339 -0.196 1.00 0.00 O ATOM 1241 CB TRP A 81 4.843 -5.161 1.966 1.00 0.00 C ATOM 1242 CG TRP A 81 5.794 -5.761 2.956 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.656 -6.954 3.605 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.032 -5.198 3.402 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.734 -7.167 4.429 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.594 -6.104 4.322 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.722 -4.018 3.110 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.811 -5.863 4.954 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.930 -3.780 3.740 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.464 -4.700 4.649 1.00 0.00 C ATOM 0 H TRP A 81 3.486 -4.918 -0.239 1.00 0.00 H new ATOM 0 HA TRP A 81 6.269 -4.386 0.557 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.563 -4.162 2.300 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.930 -5.756 1.941 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.822 -7.630 3.488 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.873 -7.984 5.024 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.319 -3.305 2.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.225 -6.569 5.659 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.470 -2.869 3.527 1.00 0.00 H new ATOM 0 HH2 TRP A 81 10.412 -4.487 5.120 1.00 0.00 H new ATOM 1261 N ILE A 82 7.250 -6.596 0.063 1.00 0.00 N ATOM 1262 CA ILE A 82 7.868 -7.851 -0.344 1.00 0.00 C ATOM 1263 C ILE A 82 8.925 -8.299 0.669 1.00 0.00 C ATOM 1264 O ILE A 82 10.076 -7.865 0.618 1.00 0.00 O ATOM 1265 CB ILE A 82 8.503 -7.732 -1.752 1.00 0.00 C ATOM 1266 CG1 ILE A 82 9.218 -9.034 -2.129 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.469 -6.554 -1.819 1.00 0.00 C ATOM 1268 CD1 ILE A 82 9.134 -9.375 -3.603 1.00 0.00 C ATOM 0 H ILE A 82 7.914 -5.862 0.309 1.00 0.00 H new ATOM 0 HA ILE A 82 7.080 -8.603 -0.381 1.00 0.00 H new ATOM 0 HB ILE A 82 7.702 -7.553 -2.470 1.00 0.00 H new ATOM 0 HG12 ILE A 82 10.267 -8.957 -1.843 1.00 0.00 H new ATOM 0 HG13 ILE A 82 8.789 -9.853 -1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.900 -6.494 -2.818 1.00 0.00 H new ATOM 0 HG22 ILE A 82 8.933 -5.631 -1.599 1.00 0.00 H new ATOM 0 HG23 ILE A 82 10.265 -6.694 -1.088 1.00 0.00 H new ATOM 0 HD11 ILE A 82 9.663 -10.309 -3.791 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.089 -9.486 -3.892 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.589 -8.576 -4.188 1.00 0.00 H new ATOM 1280 N GLY A 83 8.523 -9.183 1.582 1.00 0.00 N ATOM 1281 CA GLY A 83 9.444 -9.690 2.587 1.00 0.00 C ATOM 1282 C GLY A 83 10.501 -10.590 1.979 1.00 0.00 C ATOM 1283 O GLY A 83 10.193 -11.703 1.541 1.00 0.00 O ATOM 0 H GLY A 83 7.576 -9.557 1.643 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.926 -8.854 3.093 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.888 -10.243 3.344 1.00 0.00 H new ATOM 1287 N GLU A 84 11.739 -10.081 1.935 1.00 0.00 N ATOM 1288 CA GLU A 84 12.890 -10.789 1.351 1.00 0.00 C ATOM 1289 C GLU A 84 12.846 -12.298 1.552 1.00 0.00 C ATOM 1290 O GLU A 84 13.218 -13.048 0.646 1.00 0.00 O ATOM 1291 CB GLU A 84 14.196 -10.269 1.929 1.00 0.00 C ATOM 1292 CG GLU A 84 14.664 -8.955 1.318 1.00 0.00 C ATOM 1293 CD GLU A 84 15.631 -9.157 0.165 1.00 0.00 C ATOM 1294 OE1 GLU A 84 15.252 -9.829 -0.819 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.766 -8.641 0.245 1.00 0.00 O ATOM 0 H GLU A 84 11.974 -9.160 2.306 1.00 0.00 H new ATOM 0 HA GLU A 84 12.833 -10.591 0.281 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.078 -10.136 3.004 1.00 0.00 H new ATOM 0 HB3 GLU A 84 14.971 -11.022 1.784 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.798 -8.394 0.967 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.144 -8.351 2.088 1.00 0.00 H new ATOM 1302 N ASN A 85 12.403 -12.753 2.724 1.00 0.00 N ATOM 1303 CA ASN A 85 12.332 -14.186 3.005 1.00 0.00 C ATOM 1304 C ASN A 85 11.184 -14.847 2.243 1.00 0.00 C ATOM 1305 O ASN A 85 10.454 -15.683 2.780 1.00 0.00 O ATOM 1306 CB ASN A 85 12.194 -14.423 4.507 1.00 0.00 C ATOM 1307 CG ASN A 85 13.509 -14.246 5.227 1.00 0.00 C ATOM 1308 OD1 ASN A 85 14.127 -15.214 5.664 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.939 -12.998 5.357 1.00 0.00 N ATOM 0 H ASN A 85 12.090 -12.155 3.489 1.00 0.00 H new ATOM 0 HA ASN A 85 13.259 -14.645 2.662 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.459 -13.731 4.918 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.816 -15.430 4.683 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.819 -12.809 5.837 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.390 -12.227 4.977 1.00 0.00 H new ATOM 1316 N VAL A 86 11.050 -14.471 0.976 1.00 0.00 N ATOM 1317 CA VAL A 86 10.019 -15.019 0.102 1.00 0.00 C ATOM 1318 C VAL A 86 10.614 -16.087 -0.818 1.00 0.00 C ATOM 1319 O VAL A 86 11.699 -15.905 -1.377 1.00 0.00 O ATOM 1320 CB VAL A 86 9.353 -13.910 -0.751 1.00 0.00 C ATOM 1321 CG1 VAL A 86 10.379 -13.205 -1.630 1.00 0.00 C ATOM 1322 CG2 VAL A 86 8.222 -14.477 -1.599 1.00 0.00 C ATOM 0 H VAL A 86 11.651 -13.780 0.527 1.00 0.00 H new ATOM 0 HA VAL A 86 9.255 -15.470 0.736 1.00 0.00 H new ATOM 0 HB VAL A 86 8.930 -13.175 -0.066 1.00 0.00 H new ATOM 0 HG11 VAL A 86 9.884 -12.432 -2.218 1.00 0.00 H new ATOM 0 HG12 VAL A 86 11.145 -12.749 -1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 86 10.843 -13.929 -2.300 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.772 -13.677 -2.187 1.00 0.00 H new ATOM 0 HG22 VAL A 86 8.617 -15.242 -2.268 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.466 -14.918 -0.949 1.00 0.00 H new ATOM 1332 N SER A 87 9.905 -17.205 -0.968 1.00 0.00 N ATOM 1333 CA SER A 87 10.376 -18.296 -1.817 1.00 0.00 C ATOM 1334 C SER A 87 10.401 -17.880 -3.289 1.00 0.00 C ATOM 1335 O SER A 87 9.668 -16.980 -3.703 1.00 0.00 O ATOM 1336 CB SER A 87 9.496 -19.535 -1.638 1.00 0.00 C ATOM 1337 OG SER A 87 9.827 -20.233 -0.449 1.00 0.00 O ATOM 0 H SER A 87 9.008 -17.378 -0.515 1.00 0.00 H new ATOM 0 HA SER A 87 11.394 -18.538 -1.512 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.448 -19.238 -1.608 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.616 -20.196 -2.496 1.00 0.00 H new ATOM 0 HG SER A 87 9.248 -21.019 -0.359 1.00 0.00 H new ATOM 1343 N GLY A 88 11.254 -18.543 -4.071 1.00 0.00 N ATOM 1344 CA GLY A 88 11.371 -18.236 -5.489 1.00 0.00 C ATOM 1345 C GLY A 88 10.047 -18.324 -6.228 1.00 0.00 C ATOM 1346 O GLY A 88 9.649 -17.376 -6.905 1.00 0.00 O ATOM 0 H GLY A 88 11.868 -19.290 -3.746 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.779 -17.232 -5.605 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.082 -18.924 -5.946 1.00 0.00 H new ATOM 1350 N LEU A 89 9.364 -19.463 -6.095 1.00 0.00 N ATOM 1351 CA LEU A 89 8.074 -19.668 -6.755 1.00 0.00 C ATOM 1352 C LEU A 89 7.076 -18.581 -6.353 1.00 0.00 C ATOM 1353 O LEU A 89 6.361 -18.040 -7.200 1.00 0.00 O ATOM 1354 CB LEU A 89 7.512 -21.050 -6.411 1.00 0.00 C ATOM 1355 CG LEU A 89 6.217 -21.424 -7.139 1.00 0.00 C ATOM 1356 CD1 LEU A 89 6.257 -22.873 -7.601 1.00 0.00 C ATOM 1357 CD2 LEU A 89 5.013 -21.183 -6.240 1.00 0.00 C ATOM 0 H LEU A 89 9.682 -20.256 -5.537 1.00 0.00 H new ATOM 0 HA LEU A 89 8.232 -19.609 -7.832 1.00 0.00 H new ATOM 0 HB2 LEU A 89 8.269 -21.800 -6.640 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.333 -21.095 -5.337 1.00 0.00 H new ATOM 0 HG LEU A 89 6.124 -20.789 -8.020 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.327 -23.117 -8.115 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.096 -23.015 -8.282 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.376 -23.527 -6.737 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.101 -21.454 -6.773 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.103 -21.792 -5.341 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.972 -20.130 -5.962 1.00 0.00 H new ATOM 1369 N GLN A 90 7.042 -18.263 -5.059 1.00 0.00 N ATOM 1370 CA GLN A 90 6.145 -17.239 -4.540 1.00 0.00 C ATOM 1371 C GLN A 90 6.471 -15.874 -5.146 1.00 0.00 C ATOM 1372 O GLN A 90 5.569 -15.096 -5.459 1.00 0.00 O ATOM 1373 CB GLN A 90 6.254 -17.174 -3.016 1.00 0.00 C ATOM 1374 CG GLN A 90 5.961 -18.497 -2.324 1.00 0.00 C ATOM 1375 CD GLN A 90 4.475 -18.753 -2.155 1.00 0.00 C ATOM 1376 OE1 GLN A 90 3.911 -18.497 -1.093 1.00 0.00 O ATOM 1377 NE2 GLN A 90 3.832 -19.259 -3.203 1.00 0.00 N ATOM 0 H GLN A 90 7.629 -18.704 -4.351 1.00 0.00 H new ATOM 0 HA GLN A 90 5.124 -17.503 -4.817 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.258 -16.848 -2.746 1.00 0.00 H new ATOM 0 HB3 GLN A 90 5.563 -16.418 -2.643 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.402 -19.310 -2.901 1.00 0.00 H new ATOM 0 HG3 GLN A 90 6.440 -18.504 -1.345 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.339 -19.457 -4.066 1.00 0.00 H new ATOM 0 HE22 GLN A 90 2.832 -19.450 -3.144 1.00 0.00 H new ATOM 1386 N ARG A 91 7.768 -15.600 -5.308 1.00 0.00 N ATOM 1387 CA ARG A 91 8.235 -14.335 -5.878 1.00 0.00 C ATOM 1388 C ARG A 91 7.583 -14.069 -7.237 1.00 0.00 C ATOM 1389 O ARG A 91 7.060 -12.978 -7.477 1.00 0.00 O ATOM 1390 CB ARG A 91 9.760 -14.352 -6.023 1.00 0.00 C ATOM 1391 CG ARG A 91 10.422 -13.023 -5.695 1.00 0.00 C ATOM 1392 CD ARG A 91 10.781 -12.252 -6.955 1.00 0.00 C ATOM 1393 NE ARG A 91 11.876 -11.310 -6.727 1.00 0.00 N ATOM 1394 CZ ARG A 91 13.165 -11.652 -6.689 1.00 0.00 C ATOM 1395 NH1 ARG A 91 13.534 -12.919 -6.859 1.00 0.00 N ATOM 1396 NH2 ARG A 91 14.091 -10.723 -6.474 1.00 0.00 N ATOM 0 H ARG A 91 8.517 -16.242 -5.050 1.00 0.00 H new ATOM 0 HA ARG A 91 7.948 -13.532 -5.199 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.169 -15.122 -5.369 1.00 0.00 H new ATOM 0 HB3 ARG A 91 10.015 -14.632 -7.045 1.00 0.00 H new ATOM 0 HG2 ARG A 91 9.751 -12.424 -5.079 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.322 -13.200 -5.107 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.063 -12.953 -7.741 1.00 0.00 H new ATOM 0 HD3 ARG A 91 9.905 -11.710 -7.311 1.00 0.00 H new ATOM 0 HE ARG A 91 11.639 -10.328 -6.588 1.00 0.00 H new ATOM 0 HH11 ARG A 91 12.829 -13.638 -7.020 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.522 -13.171 -6.828 1.00 0.00 H new ATOM 0 HH21 ARG A 91 13.816 -9.750 -6.338 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.077 -10.983 -6.445 1.00 0.00 H new ATOM 1410 N ALA A 92 7.613 -15.073 -8.118 1.00 0.00 N ATOM 1411 CA ALA A 92 7.016 -14.949 -9.448 1.00 0.00 C ATOM 1412 C ALA A 92 5.520 -14.660 -9.350 1.00 0.00 C ATOM 1413 O ALA A 92 4.993 -13.817 -10.078 1.00 0.00 O ATOM 1414 CB ALA A 92 7.262 -16.212 -10.259 1.00 0.00 C ATOM 0 H ALA A 92 8.044 -15.979 -7.933 1.00 0.00 H new ATOM 0 HA ALA A 92 7.490 -14.110 -9.957 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.812 -16.104 -11.246 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.335 -16.373 -10.365 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.816 -17.065 -9.748 1.00 0.00 H new ATOM 1420 N LYS A 93 4.845 -15.360 -8.435 1.00 0.00 N ATOM 1421 CA LYS A 93 3.411 -15.174 -8.227 1.00 0.00 C ATOM 1422 C LYS A 93 3.096 -13.720 -7.880 1.00 0.00 C ATOM 1423 O LYS A 93 2.121 -13.154 -8.378 1.00 0.00 O ATOM 1424 CB LYS A 93 2.908 -16.097 -7.113 1.00 0.00 C ATOM 1425 CG LYS A 93 1.527 -16.678 -7.372 1.00 0.00 C ATOM 1426 CD LYS A 93 1.486 -18.172 -7.085 1.00 0.00 C ATOM 1427 CE LYS A 93 1.397 -18.456 -5.591 1.00 0.00 C ATOM 1428 NZ LYS A 93 1.205 -19.907 -5.309 1.00 0.00 N ATOM 0 H LYS A 93 5.270 -16.060 -7.827 1.00 0.00 H new ATOM 0 HA LYS A 93 2.900 -15.428 -9.156 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.617 -16.915 -6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.888 -15.541 -6.175 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.794 -16.167 -6.749 1.00 0.00 H new ATOM 0 HG3 LYS A 93 1.244 -16.498 -8.409 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.629 -18.617 -7.592 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.379 -18.646 -7.493 1.00 0.00 H new ATOM 0 HE2 LYS A 93 2.307 -18.109 -5.101 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.569 -17.891 -5.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.150 -20.057 -4.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.324 -20.234 -5.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.008 -20.445 -5.694 1.00 0.00 H new ATOM 1442 N THR A 94 3.932 -13.122 -7.026 1.00 0.00 N ATOM 1443 CA THR A 94 3.751 -11.731 -6.612 1.00 0.00 C ATOM 1444 C THR A 94 3.781 -10.796 -7.820 1.00 0.00 C ATOM 1445 O THR A 94 2.952 -9.892 -7.932 1.00 0.00 O ATOM 1446 CB THR A 94 4.835 -11.323 -5.604 1.00 0.00 C ATOM 1447 OG1 THR A 94 5.156 -12.403 -4.743 1.00 0.00 O ATOM 1448 CG2 THR A 94 4.437 -10.147 -4.735 1.00 0.00 C ATOM 0 H THR A 94 4.741 -13.582 -6.608 1.00 0.00 H new ATOM 0 HA THR A 94 2.776 -11.647 -6.133 1.00 0.00 H new ATOM 0 HB THR A 94 5.693 -11.032 -6.210 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.814 -12.984 -5.178 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.249 -9.912 -4.046 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.234 -9.281 -5.365 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.542 -10.401 -4.167 1.00 0.00 H new ATOM 1456 N GLY A 95 4.735 -11.026 -8.726 1.00 0.00 N ATOM 1457 CA GLY A 95 4.845 -10.202 -9.917 1.00 0.00 C ATOM 1458 C GLY A 95 3.550 -10.164 -10.706 1.00 0.00 C ATOM 1459 O GLY A 95 3.073 -9.089 -11.076 1.00 0.00 O ATOM 0 H GLY A 95 5.431 -11.768 -8.653 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.125 -9.188 -9.631 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.644 -10.587 -10.551 1.00 0.00 H new ATOM 1463 N THR A 96 2.972 -11.341 -10.954 1.00 0.00 N ATOM 1464 CA THR A 96 1.715 -11.442 -11.692 1.00 0.00 C ATOM 1465 C THR A 96 0.563 -10.845 -10.882 1.00 0.00 C ATOM 1466 O THR A 96 -0.329 -10.204 -11.440 1.00 0.00 O ATOM 1467 CB THR A 96 1.406 -12.902 -12.033 1.00 0.00 C ATOM 1468 OG1 THR A 96 2.571 -13.575 -12.480 1.00 0.00 O ATOM 1469 CG2 THR A 96 0.349 -13.056 -13.106 1.00 0.00 C ATOM 0 H THR A 96 3.356 -12.237 -10.654 1.00 0.00 H new ATOM 0 HA THR A 96 1.823 -10.878 -12.618 1.00 0.00 H new ATOM 0 HB THR A 96 1.030 -13.338 -11.107 1.00 0.00 H new ATOM 0 HG1 THR A 96 2.350 -14.506 -12.690 1.00 0.00 H new ATOM 0 HG21 THR A 96 0.178 -14.115 -13.299 1.00 0.00 H new ATOM 0 HG22 THR A 96 -0.580 -12.594 -12.771 1.00 0.00 H new ATOM 0 HG23 THR A 96 0.686 -12.570 -14.021 1.00 0.00 H new ATOM 1477 N ASP A 97 0.592 -11.063 -9.563 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.447 -10.550 -8.668 1.00 0.00 C ATOM 1479 C ASP A 97 -0.564 -9.029 -8.769 1.00 0.00 C ATOM 1480 O ASP A 97 -1.671 -8.486 -8.800 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.154 -10.963 -7.219 1.00 0.00 C ATOM 1482 CG ASP A 97 -1.414 -11.107 -6.384 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -2.061 -10.076 -6.100 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.751 -12.250 -6.010 1.00 0.00 O ATOM 0 H ASP A 97 1.326 -11.592 -9.092 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.398 -10.984 -8.976 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.388 -11.909 -7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.499 -10.221 -6.759 1.00 0.00 H new ATOM 1489 N LYS A 98 0.581 -8.346 -8.832 1.00 0.00 N ATOM 1490 CA LYS A 98 0.606 -6.887 -8.942 1.00 0.00 C ATOM 1491 C LYS A 98 -0.118 -6.413 -10.203 1.00 0.00 C ATOM 1492 O LYS A 98 -0.691 -5.323 -10.224 1.00 0.00 O ATOM 1493 CB LYS A 98 2.048 -6.377 -8.953 1.00 0.00 C ATOM 1494 CG LYS A 98 2.195 -4.959 -8.426 1.00 0.00 C ATOM 1495 CD LYS A 98 3.447 -4.288 -8.968 1.00 0.00 C ATOM 1496 CE LYS A 98 4.591 -4.346 -7.966 1.00 0.00 C ATOM 1497 NZ LYS A 98 5.880 -4.730 -8.608 1.00 0.00 N ATOM 0 H LYS A 98 1.503 -8.781 -8.809 1.00 0.00 H new ATOM 0 HA LYS A 98 0.087 -6.481 -8.074 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.666 -7.045 -8.352 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.432 -6.419 -9.972 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.318 -4.374 -8.704 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.234 -4.977 -7.337 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.749 -4.775 -9.895 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.227 -3.248 -9.211 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.701 -3.374 -7.486 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.349 -5.063 -7.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.493 -5.193 -7.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.695 -5.386 -9.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 6.353 -3.879 -8.973 1.00 0.00 H new ATOM 1511 N THR A 99 -0.091 -7.239 -11.251 1.00 0.00 N ATOM 1512 CA THR A 99 -0.748 -6.904 -12.512 1.00 0.00 C ATOM 1513 C THR A 99 -2.267 -6.959 -12.362 1.00 0.00 C ATOM 1514 O THR A 99 -2.982 -6.084 -12.855 1.00 0.00 O ATOM 1515 CB THR A 99 -0.286 -7.859 -13.618 1.00 0.00 C ATOM 1516 OG1 THR A 99 1.128 -7.868 -13.710 1.00 0.00 O ATOM 1517 CG2 THR A 99 -0.830 -7.510 -14.987 1.00 0.00 C ATOM 0 H THR A 99 0.379 -8.144 -11.249 1.00 0.00 H new ATOM 0 HA THR A 99 -0.469 -5.887 -12.787 1.00 0.00 H new ATOM 0 HB THR A 99 -0.675 -8.836 -13.332 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.406 -8.484 -14.420 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.461 -8.228 -15.719 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.919 -7.541 -14.965 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.502 -6.508 -15.264 1.00 0.00 H new ATOM 1525 N LEU A 100 -2.752 -7.992 -11.671 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.181 -8.168 -11.442 1.00 0.00 C ATOM 1527 C LEU A 100 -4.751 -7.015 -10.617 1.00 0.00 C ATOM 1528 O LEU A 100 -5.748 -6.399 -11.001 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.427 -9.500 -10.733 1.00 0.00 C ATOM 1530 CG LEU A 100 -3.879 -10.732 -11.460 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -3.610 -11.857 -10.476 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -4.848 -11.190 -12.539 1.00 0.00 C ATOM 0 H LEU A 100 -2.170 -8.721 -11.260 1.00 0.00 H new ATOM 0 HA LEU A 100 -4.689 -8.173 -12.406 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.979 -9.454 -9.740 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.501 -9.627 -10.593 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.937 -10.458 -11.936 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.221 -12.723 -11.011 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -2.878 -11.528 -9.738 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.537 -12.128 -9.971 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.442 -12.066 -13.045 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.805 -11.445 -12.084 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.992 -10.388 -13.263 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.105 -6.720 -9.486 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.541 -5.633 -8.610 1.00 0.00 C ATOM 1546 C VAL A 101 -4.527 -4.290 -9.350 1.00 0.00 C ATOM 1547 O VAL A 101 -5.332 -3.405 -9.055 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.662 -5.542 -7.338 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -2.227 -5.177 -7.692 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -4.244 -4.545 -6.344 1.00 0.00 C ATOM 0 H VAL A 101 -3.279 -7.219 -9.157 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.564 -5.857 -8.306 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.654 -6.525 -6.866 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -1.631 -5.120 -6.781 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -1.810 -5.938 -8.351 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -2.211 -4.211 -8.197 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.608 -4.500 -5.460 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.295 -3.559 -6.805 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -5.246 -4.862 -6.055 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.621 -4.151 -10.319 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.517 -2.926 -11.108 1.00 0.00 C ATOM 1562 C LYS A 102 -4.754 -2.745 -11.986 1.00 0.00 C ATOM 1563 O LYS A 102 -5.257 -1.632 -12.145 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.260 -2.958 -11.980 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.112 -2.139 -11.416 1.00 0.00 C ATOM 1566 CD LYS A 102 0.141 -2.278 -12.264 1.00 0.00 C ATOM 1567 CE LYS A 102 1.360 -1.693 -11.565 1.00 0.00 C ATOM 1568 NZ LYS A 102 2.632 -2.089 -12.234 1.00 0.00 N ATOM 0 H LYS A 102 -2.948 -4.874 -10.575 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.449 -2.083 -10.420 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -1.935 -3.992 -12.098 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.507 -2.586 -12.974 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.403 -1.090 -11.365 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.900 -2.461 -10.397 1.00 0.00 H new ATOM 0 HD2 LYS A 102 0.317 -3.331 -12.483 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.008 -1.774 -13.219 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.282 -0.606 -11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.377 -2.026 -10.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.437 -1.669 -11.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.720 -3.125 -12.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 2.628 -1.749 -13.217 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.238 -3.852 -12.548 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.419 -3.831 -13.406 1.00 0.00 C ATOM 1584 C GLU A 103 -7.656 -3.392 -12.624 1.00 0.00 C ATOM 1585 O GLU A 103 -8.533 -2.718 -13.166 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.656 -5.215 -14.017 1.00 0.00 C ATOM 1587 CG GLU A 103 -6.006 -5.401 -15.380 1.00 0.00 C ATOM 1588 CD GLU A 103 -6.970 -5.158 -16.525 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -7.753 -6.077 -16.848 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -6.942 -4.049 -17.099 1.00 0.00 O ATOM 0 H GLU A 103 -4.828 -4.777 -12.423 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.242 -3.111 -14.205 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.273 -5.974 -13.335 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.729 -5.382 -14.110 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.161 -4.719 -15.471 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.608 -6.413 -15.454 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.722 -3.782 -11.350 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.853 -3.430 -10.494 1.00 0.00 C ATOM 1599 C VAL A 104 -8.649 -2.067 -9.819 1.00 0.00 C ATOM 1600 O VAL A 104 -9.615 -1.344 -9.569 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.106 -4.518 -9.421 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -7.925 -4.631 -8.469 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -10.393 -4.238 -8.656 1.00 0.00 C ATOM 0 H VAL A 104 -7.005 -4.342 -10.889 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.729 -3.365 -11.139 1.00 0.00 H new ATOM 0 HB VAL A 104 -9.218 -5.474 -9.933 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -8.129 -5.402 -7.726 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.029 -4.896 -9.030 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -7.769 -3.676 -7.967 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.548 -5.016 -7.908 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.319 -3.269 -8.162 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.234 -4.228 -9.350 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.393 -1.717 -9.535 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.072 -0.438 -8.899 1.00 0.00 C ATOM 1615 C VAL A 105 -6.291 0.464 -9.853 1.00 0.00 C ATOM 1616 O VAL A 105 -5.076 0.326 -10.000 1.00 0.00 O ATOM 1617 CB VAL A 105 -6.258 -0.636 -7.600 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -6.032 0.693 -6.892 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -6.954 -1.623 -6.673 1.00 0.00 C ATOM 0 H VAL A 105 -6.581 -2.301 -9.735 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.019 0.038 -8.646 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.286 -1.046 -7.872 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.457 0.527 -5.981 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.483 1.367 -7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -6.994 1.138 -6.638 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -6.364 -1.748 -5.765 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -7.943 -1.244 -6.414 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.054 -2.585 -7.175 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.004 1.379 -10.508 1.00 0.00 N ATOM 1630 CA GLN A 106 -6.388 2.301 -11.461 1.00 0.00 C ATOM 1631 C GLN A 106 -6.355 3.733 -10.922 1.00 0.00 C ATOM 1632 O GLN A 106 -5.417 4.482 -11.197 1.00 0.00 O ATOM 1633 CB GLN A 106 -7.137 2.258 -12.795 1.00 0.00 C ATOM 1634 CG GLN A 106 -7.242 0.860 -13.389 1.00 0.00 C ATOM 1635 CD GLN A 106 -8.678 0.402 -13.556 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -9.249 -0.169 -12.500 1.00 0.00 O flip ATOM 1637 NE2 GLN A 106 -9.271 0.561 -14.623 1.00 0.00 N flip ATOM 0 H GLN A 106 -8.010 1.502 -10.396 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.358 1.980 -11.614 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.140 2.660 -12.652 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.631 2.910 -13.508 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -6.744 0.843 -14.359 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -6.713 0.156 -12.747 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.796 1.004 -15.409 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -10.237 0.250 -14.721 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.382 4.111 -10.157 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.459 5.455 -9.588 1.00 0.00 C ATOM 1648 C ASN A 107 -6.505 5.599 -8.404 1.00 0.00 C ATOM 1649 O ASN A 107 -6.901 5.442 -7.247 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.895 5.782 -9.159 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.466 6.977 -9.904 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.740 8.018 -9.308 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.650 6.833 -11.213 1.00 0.00 N ATOM 0 H ASN A 107 -8.168 3.506 -9.919 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.159 6.164 -10.359 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.530 4.913 -9.332 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.914 5.982 -8.088 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.032 7.603 -11.762 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.409 5.952 -11.668 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.245 5.899 -8.708 1.00 0.00 N ATOM 1661 CA PHE A 108 -4.221 6.071 -7.679 1.00 0.00 C ATOM 1662 C PHE A 108 -3.328 7.269 -7.997 1.00 0.00 C ATOM 1663 O PHE A 108 -3.328 7.774 -9.122 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.373 4.800 -7.543 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.839 4.271 -8.847 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.834 4.944 -9.528 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.337 3.097 -9.390 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.340 4.456 -10.721 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.845 2.605 -10.584 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.846 3.286 -11.250 1.00 0.00 C ATOM 0 H PHE A 108 -4.907 6.029 -9.662 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.724 6.258 -6.730 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.535 5.006 -6.877 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.974 4.025 -7.069 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -1.434 5.860 -9.120 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.119 2.560 -8.874 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.558 4.990 -11.240 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.242 1.689 -10.996 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.461 2.904 -12.184 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.566 7.718 -7.000 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.664 8.855 -7.175 1.00 0.00 C ATOM 1682 C ALA A 109 -0.232 8.385 -7.421 1.00 0.00 C ATOM 1683 O ALA A 109 0.433 8.857 -8.344 1.00 0.00 O ATOM 1684 CB ALA A 109 -1.722 9.771 -5.960 1.00 0.00 C ATOM 0 H ALA A 109 -2.556 7.312 -6.064 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.991 9.415 -8.051 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -1.045 10.613 -6.106 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.739 10.142 -5.832 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.424 9.215 -5.071 1.00 0.00 H new ATOM 1690 N LYS A 110 0.235 7.456 -6.588 1.00 0.00 N ATOM 1691 CA LYS A 110 1.588 6.924 -6.714 1.00 0.00 C ATOM 1692 C LYS A 110 1.689 5.540 -6.075 1.00 0.00 C ATOM 1693 O LYS A 110 1.125 5.296 -5.009 1.00 0.00 O ATOM 1694 CB LYS A 110 2.592 7.881 -6.068 1.00 0.00 C ATOM 1695 CG LYS A 110 3.999 7.770 -6.634 1.00 0.00 C ATOM 1696 CD LYS A 110 5.049 7.958 -5.552 1.00 0.00 C ATOM 1697 CE LYS A 110 5.698 9.332 -5.633 1.00 0.00 C ATOM 1698 NZ LYS A 110 6.558 9.615 -4.450 1.00 0.00 N ATOM 0 H LYS A 110 -0.304 7.057 -5.820 1.00 0.00 H new ATOM 0 HA LYS A 110 1.822 6.828 -7.774 1.00 0.00 H new ATOM 0 HB2 LYS A 110 2.239 8.904 -6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.626 7.688 -4.996 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.128 6.794 -7.103 1.00 0.00 H new ATOM 0 HG3 LYS A 110 4.139 8.519 -7.413 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.589 7.829 -4.572 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.814 7.188 -5.649 1.00 0.00 H new ATOM 0 HE2 LYS A 110 6.298 9.396 -6.541 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.923 10.095 -5.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 7.072 10.506 -4.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.964 9.697 -3.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 7.239 8.840 -4.323 1.00 0.00 H new ATOM 1712 N GLU A 111 2.412 4.639 -6.738 1.00 0.00 N ATOM 1713 CA GLU A 111 2.587 3.278 -6.242 1.00 0.00 C ATOM 1714 C GLU A 111 4.041 2.835 -6.376 1.00 0.00 C ATOM 1715 O GLU A 111 4.670 3.052 -7.414 1.00 0.00 O ATOM 1716 CB GLU A 111 1.673 2.312 -7.007 1.00 0.00 C ATOM 1717 CG GLU A 111 1.969 2.237 -8.499 1.00 0.00 C ATOM 1718 CD GLU A 111 1.324 1.038 -9.169 1.00 0.00 C ATOM 1719 OE1 GLU A 111 1.716 -0.106 -8.849 1.00 0.00 O ATOM 1720 OE2 GLU A 111 0.434 1.242 -10.021 1.00 0.00 O ATOM 0 H GLU A 111 2.886 4.829 -7.621 1.00 0.00 H new ATOM 0 HA GLU A 111 2.317 3.263 -5.186 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.771 1.316 -6.576 1.00 0.00 H new ATOM 0 HB3 GLU A 111 0.637 2.619 -6.867 1.00 0.00 H new ATOM 0 HG2 GLU A 111 1.617 3.149 -8.981 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.048 2.194 -8.649 1.00 0.00 H new ATOM 1727 N PHE A 112 4.572 2.212 -5.327 1.00 0.00 N ATOM 1728 CA PHE A 112 5.953 1.739 -5.346 1.00 0.00 C ATOM 1729 C PHE A 112 6.142 0.525 -4.440 1.00 0.00 C ATOM 1730 O PHE A 112 5.346 0.279 -3.529 1.00 0.00 O ATOM 1731 CB PHE A 112 6.923 2.857 -4.940 1.00 0.00 C ATOM 1732 CG PHE A 112 6.518 3.610 -3.705 1.00 0.00 C ATOM 1733 CD1 PHE A 112 6.756 3.082 -2.447 1.00 0.00 C ATOM 1734 CD2 PHE A 112 5.908 4.851 -3.804 1.00 0.00 C ATOM 1735 CE1 PHE A 112 6.392 3.776 -1.309 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.543 5.550 -2.669 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.785 5.012 -1.420 1.00 0.00 C ATOM 0 H PHE A 112 4.071 2.024 -4.459 1.00 0.00 H new ATOM 0 HA PHE A 112 6.176 1.437 -6.369 1.00 0.00 H new ATOM 0 HB2 PHE A 112 7.911 2.424 -4.780 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.014 3.561 -5.767 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.232 2.117 -2.354 1.00 0.00 H new ATOM 0 HD2 PHE A 112 5.716 5.276 -4.778 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.582 3.353 -0.334 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.069 6.516 -2.759 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.500 5.557 -0.532 1.00 0.00 H new ATOM 1747 N VAL A 113 7.210 -0.224 -4.701 1.00 0.00 N ATOM 1748 CA VAL A 113 7.535 -1.417 -3.926 1.00 0.00 C ATOM 1749 C VAL A 113 8.684 -1.131 -2.970 1.00 0.00 C ATOM 1750 O VAL A 113 9.639 -0.437 -3.328 1.00 0.00 O ATOM 1751 CB VAL A 113 7.925 -2.599 -4.844 1.00 0.00 C ATOM 1752 CG1 VAL A 113 7.973 -3.901 -4.055 1.00 0.00 C ATOM 1753 CG2 VAL A 113 6.962 -2.718 -6.019 1.00 0.00 C ATOM 0 H VAL A 113 7.871 -0.022 -5.451 1.00 0.00 H new ATOM 0 HA VAL A 113 6.644 -1.691 -3.362 1.00 0.00 H new ATOM 0 HB VAL A 113 8.921 -2.402 -5.242 1.00 0.00 H new ATOM 0 HG11 VAL A 113 8.249 -4.719 -4.720 1.00 0.00 H new ATOM 0 HG12 VAL A 113 8.711 -3.816 -3.258 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.993 -4.100 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 113 7.259 -3.557 -6.649 1.00 0.00 H new ATOM 0 HG22 VAL A 113 5.951 -2.884 -5.646 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.986 -1.799 -6.604 1.00 0.00 H new ATOM 1763 N ILE A 114 8.591 -1.660 -1.753 1.00 0.00 N ATOM 1764 CA ILE A 114 9.630 -1.451 -0.752 1.00 0.00 C ATOM 1765 C ILE A 114 9.987 -2.751 -0.037 1.00 0.00 C ATOM 1766 O ILE A 114 9.146 -3.637 0.130 1.00 0.00 O ATOM 1767 CB ILE A 114 9.206 -0.394 0.292 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.863 0.928 -0.399 1.00 0.00 C ATOM 1769 CG2 ILE A 114 10.302 -0.182 1.327 1.00 0.00 C ATOM 1770 CD1 ILE A 114 10.033 1.563 -1.122 1.00 0.00 C ATOM 0 H ILE A 114 7.809 -2.234 -1.438 1.00 0.00 H new ATOM 0 HA ILE A 114 10.508 -1.088 -1.286 1.00 0.00 H new ATOM 0 HB ILE A 114 8.319 -0.761 0.807 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.057 0.756 -1.113 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.485 1.629 0.345 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.979 0.567 2.051 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.503 -1.121 1.842 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.210 0.161 0.831 1.00 0.00 H new ATOM 0 HD11 ILE A 114 9.711 2.495 -1.586 1.00 0.00 H new ATOM 0 HD12 ILE A 114 10.832 1.769 -0.410 1.00 0.00 H new ATOM 0 HD13 ILE A 114 10.398 0.882 -1.891 1.00 0.00 H new ATOM 1782 N SER A 115 11.247 -2.849 0.378 1.00 0.00 N ATOM 1783 CA SER A 115 11.745 -4.030 1.079 1.00 0.00 C ATOM 1784 C SER A 115 12.243 -3.680 2.484 1.00 0.00 C ATOM 1785 O SER A 115 12.251 -4.533 3.372 1.00 0.00 O ATOM 1786 CB SER A 115 12.870 -4.684 0.273 1.00 0.00 C ATOM 1787 OG SER A 115 13.157 -5.985 0.757 1.00 0.00 O ATOM 0 H SER A 115 11.946 -2.120 0.240 1.00 0.00 H new ATOM 0 HA SER A 115 10.917 -4.732 1.181 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.584 -4.739 -0.777 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.767 -4.067 0.328 1.00 0.00 H new ATOM 0 HG SER A 115 13.976 -6.318 0.335 1.00 0.00 H new ATOM 1793 N ASP A 116 12.658 -2.425 2.684 1.00 0.00 N ATOM 1794 CA ASP A 116 13.155 -1.981 3.984 1.00 0.00 C ATOM 1795 C ASP A 116 12.012 -1.468 4.858 1.00 0.00 C ATOM 1796 O ASP A 116 11.045 -0.887 4.360 1.00 0.00 O ATOM 1797 CB ASP A 116 14.220 -0.894 3.811 1.00 0.00 C ATOM 1798 CG ASP A 116 14.802 -0.433 5.134 1.00 0.00 C ATOM 1799 OD1 ASP A 116 15.446 -1.255 5.823 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.609 0.748 5.484 1.00 0.00 O ATOM 0 H ASP A 116 12.659 -1.703 1.963 1.00 0.00 H new ATOM 0 HA ASP A 116 13.609 -2.838 4.482 1.00 0.00 H new ATOM 0 HB2 ASP A 116 15.022 -1.274 3.178 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.782 -0.040 3.294 1.00 0.00 H new ATOM 1805 N ARG A 117 12.137 -1.691 6.165 1.00 0.00 N ATOM 1806 CA ARG A 117 11.125 -1.262 7.125 1.00 0.00 C ATOM 1807 C ARG A 117 11.086 0.262 7.262 1.00 0.00 C ATOM 1808 O ARG A 117 10.036 0.840 7.548 1.00 0.00 O ATOM 1809 CB ARG A 117 11.387 -1.906 8.489 1.00 0.00 C ATOM 1810 CG ARG A 117 12.825 -1.781 8.965 1.00 0.00 C ATOM 1811 CD ARG A 117 12.899 -1.644 10.478 1.00 0.00 C ATOM 1812 NE ARG A 117 13.453 -0.354 10.884 1.00 0.00 N ATOM 1813 CZ ARG A 117 14.751 -0.047 10.832 1.00 0.00 C ATOM 1814 NH1 ARG A 117 15.638 -0.934 10.391 1.00 0.00 N ATOM 1815 NH2 ARG A 117 15.161 1.156 11.219 1.00 0.00 N ATOM 0 H ARG A 117 12.935 -2.169 6.584 1.00 0.00 H new ATOM 0 HA ARG A 117 10.154 -1.587 6.752 1.00 0.00 H new ATOM 0 HB2 ARG A 117 10.729 -1.448 9.228 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.122 -2.962 8.438 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.392 -2.657 8.649 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.291 -0.914 8.496 1.00 0.00 H new ATOM 0 HD2 ARG A 117 11.901 -1.760 10.902 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.514 -2.447 10.885 1.00 0.00 H new ATOM 0 HE ARG A 117 12.807 0.356 11.229 1.00 0.00 H new ATOM 0 HH11 ARG A 117 15.329 -1.858 10.089 1.00 0.00 H new ATOM 0 HH12 ARG A 117 16.628 -0.691 10.355 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.485 1.842 11.555 1.00 0.00 H new ATOM 0 HH22 ARG A 117 16.152 1.394 11.181 1.00 0.00 H new ATOM 1829 N LYS A 118 12.232 0.913 7.055 1.00 0.00 N ATOM 1830 CA LYS A 118 12.313 2.369 7.154 1.00 0.00 C ATOM 1831 C LYS A 118 11.779 3.042 5.886 1.00 0.00 C ATOM 1832 O LYS A 118 11.205 4.130 5.951 1.00 0.00 O ATOM 1833 CB LYS A 118 13.756 2.808 7.416 1.00 0.00 C ATOM 1834 CG LYS A 118 13.875 4.209 7.995 1.00 0.00 C ATOM 1835 CD LYS A 118 14.803 5.078 7.158 1.00 0.00 C ATOM 1836 CE LYS A 118 14.303 6.513 7.071 1.00 0.00 C ATOM 1837 NZ LYS A 118 15.180 7.357 6.208 1.00 0.00 N ATOM 0 H LYS A 118 13.113 0.456 6.819 1.00 0.00 H new ATOM 0 HA LYS A 118 11.690 2.681 7.992 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.222 2.101 8.102 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.315 2.762 6.482 1.00 0.00 H new ATOM 0 HG2 LYS A 118 12.888 4.669 8.044 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.251 4.152 9.017 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.803 5.067 7.592 1.00 0.00 H new ATOM 0 HD3 LYS A 118 14.887 4.660 6.155 1.00 0.00 H new ATOM 0 HE2 LYS A 118 13.288 6.520 6.674 1.00 0.00 H new ATOM 0 HE3 LYS A 118 14.257 6.943 8.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 14.805 8.327 6.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 16.143 7.371 6.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 15.204 6.962 5.246 1.00 0.00 H new ATOM 1851 N GLU A 119 11.972 2.387 4.736 1.00 0.00 N ATOM 1852 CA GLU A 119 11.511 2.921 3.452 1.00 0.00 C ATOM 1853 C GLU A 119 9.998 2.771 3.290 1.00 0.00 C ATOM 1854 O GLU A 119 9.364 3.573 2.602 1.00 0.00 O ATOM 1855 CB GLU A 119 12.223 2.218 2.292 1.00 0.00 C ATOM 1856 CG GLU A 119 13.483 2.931 1.831 1.00 0.00 C ATOM 1857 CD GLU A 119 14.579 2.904 2.879 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.480 3.674 3.862 1.00 0.00 O ATOM 1859 OE2 GLU A 119 15.530 2.109 2.722 1.00 0.00 O ATOM 0 H GLU A 119 12.445 1.486 4.669 1.00 0.00 H new ATOM 0 HA GLU A 119 11.753 3.984 3.437 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.480 1.203 2.596 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.534 2.134 1.451 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.847 2.464 0.916 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.243 3.966 1.587 1.00 0.00 H new ATOM 1866 N LEU A 120 9.420 1.743 3.915 1.00 0.00 N ATOM 1867 CA LEU A 120 7.980 1.511 3.817 1.00 0.00 C ATOM 1868 C LEU A 120 7.226 2.116 5.009 1.00 0.00 C ATOM 1869 O LEU A 120 6.003 2.248 4.966 1.00 0.00 O ATOM 1870 CB LEU A 120 7.686 0.003 3.645 1.00 0.00 C ATOM 1871 CG LEU A 120 7.213 -0.779 4.883 1.00 0.00 C ATOM 1872 CD1 LEU A 120 8.096 -0.497 6.085 1.00 0.00 C ATOM 1873 CD2 LEU A 120 5.753 -0.479 5.198 1.00 0.00 C ATOM 0 H LEU A 120 9.922 1.065 4.488 1.00 0.00 H new ATOM 0 HA LEU A 120 7.612 2.024 2.928 1.00 0.00 H new ATOM 0 HB2 LEU A 120 6.927 -0.105 2.870 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.592 -0.475 3.272 1.00 0.00 H new ATOM 0 HG LEU A 120 7.296 -1.841 4.652 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.735 -1.065 6.943 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.121 -0.791 5.860 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.067 0.568 6.316 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.447 -1.046 6.077 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.635 0.587 5.394 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.132 -0.763 4.349 1.00 0.00 H new ATOM 1885 N GLU A 121 7.957 2.498 6.064 1.00 0.00 N ATOM 1886 CA GLU A 121 7.354 3.094 7.246 1.00 0.00 C ATOM 1887 C GLU A 121 6.484 4.299 6.887 1.00 0.00 C ATOM 1888 O GLU A 121 6.705 4.965 5.876 1.00 0.00 O ATOM 1889 CB GLU A 121 8.445 3.518 8.228 1.00 0.00 C ATOM 1890 CG GLU A 121 7.994 3.530 9.674 1.00 0.00 C ATOM 1891 CD GLU A 121 7.994 2.147 10.297 1.00 0.00 C ATOM 1892 OE1 GLU A 121 7.396 1.225 9.700 1.00 0.00 O ATOM 1893 OE2 GLU A 121 8.595 1.982 11.380 1.00 0.00 O ATOM 0 H GLU A 121 8.971 2.401 6.115 1.00 0.00 H new ATOM 0 HA GLU A 121 6.714 2.343 7.709 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.294 2.842 8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.797 4.514 7.958 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.649 4.184 10.250 1.00 0.00 H new ATOM 0 HG3 GLU A 121 6.991 3.951 9.734 1.00 0.00 H new ATOM 1900 N GLU A 122 5.496 4.560 7.736 1.00 0.00 N ATOM 1901 CA GLU A 122 4.565 5.674 7.546 1.00 0.00 C ATOM 1902 C GLU A 122 5.296 7.007 7.387 1.00 0.00 C ATOM 1903 O GLU A 122 4.882 7.854 6.592 1.00 0.00 O ATOM 1904 CB GLU A 122 3.590 5.754 8.726 1.00 0.00 C ATOM 1905 CG GLU A 122 2.464 6.753 8.520 1.00 0.00 C ATOM 1906 CD GLU A 122 2.207 7.602 9.749 1.00 0.00 C ATOM 1907 OE1 GLU A 122 1.400 7.180 10.602 1.00 0.00 O ATOM 1908 OE2 GLU A 122 2.812 8.689 9.856 1.00 0.00 O ATOM 0 H GLU A 122 5.315 4.008 8.575 1.00 0.00 H new ATOM 0 HA GLU A 122 4.012 5.485 6.626 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.161 4.767 8.899 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.143 6.024 9.626 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.708 7.402 7.679 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.552 6.218 8.255 1.00 0.00 H new ATOM 1915 N ASN A 123 6.385 7.188 8.135 1.00 0.00 N ATOM 1916 CA ASN A 123 7.168 8.421 8.062 1.00 0.00 C ATOM 1917 C ASN A 123 7.698 8.625 6.648 1.00 0.00 C ATOM 1918 O ASN A 123 7.672 9.737 6.118 1.00 0.00 O ATOM 1919 CB ASN A 123 8.331 8.378 9.057 1.00 0.00 C ATOM 1920 CG ASN A 123 8.312 9.543 10.028 1.00 0.00 C ATOM 1921 OD1 ASN A 123 9.248 10.341 10.072 1.00 0.00 O ATOM 1922 ND2 ASN A 123 7.247 9.647 10.816 1.00 0.00 N ATOM 0 H ASN A 123 6.744 6.499 8.796 1.00 0.00 H new ATOM 0 HA ASN A 123 6.519 9.258 8.321 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.291 7.443 9.616 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.273 8.382 8.509 1.00 0.00 H new ATOM 0 HD21 ASN A 123 7.184 10.410 11.490 1.00 0.00 H new ATOM 0 HD22 ASN A 123 6.493 8.964 10.747 1.00 0.00 H new ATOM 1929 N PHE A 124 8.170 7.537 6.044 1.00 0.00 N ATOM 1930 CA PHE A 124 8.701 7.577 4.691 1.00 0.00 C ATOM 1931 C PHE A 124 7.585 7.801 3.671 1.00 0.00 C ATOM 1932 O PHE A 124 7.749 8.571 2.724 1.00 0.00 O ATOM 1933 CB PHE A 124 9.444 6.277 4.383 1.00 0.00 C ATOM 1934 CG PHE A 124 10.330 6.368 3.174 1.00 0.00 C ATOM 1935 CD1 PHE A 124 9.788 6.388 1.898 1.00 0.00 C ATOM 1936 CD2 PHE A 124 11.707 6.444 3.315 1.00 0.00 C ATOM 1937 CE1 PHE A 124 10.603 6.478 0.787 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.526 6.537 2.206 1.00 0.00 C ATOM 1939 CZ PHE A 124 11.973 6.554 0.941 1.00 0.00 C ATOM 0 H PHE A 124 8.194 6.613 6.476 1.00 0.00 H new ATOM 0 HA PHE A 124 9.397 8.413 4.621 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.048 5.999 5.247 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.717 5.479 4.232 1.00 0.00 H new ATOM 0 HD1 PHE A 124 8.717 6.333 1.772 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.144 6.430 4.302 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.169 6.489 -0.202 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.597 6.596 2.329 1.00 0.00 H new ATOM 0 HZ PHE A 124 12.611 6.627 0.073 1.00 0.00 H new ATOM 1949 N ILE A 125 6.454 7.124 3.873 1.00 0.00 N ATOM 1950 CA ILE A 125 5.308 7.245 2.972 1.00 0.00 C ATOM 1951 C ILE A 125 4.785 8.680 2.936 1.00 0.00 C ATOM 1952 O ILE A 125 4.720 9.298 1.873 1.00 0.00 O ATOM 1953 CB ILE A 125 4.155 6.301 3.388 1.00 0.00 C ATOM 1954 CG1 ILE A 125 4.657 4.862 3.530 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.017 6.368 2.379 1.00 0.00 C ATOM 1956 CD1 ILE A 125 3.781 4.003 4.416 1.00 0.00 C ATOM 0 H ILE A 125 6.307 6.485 4.654 1.00 0.00 H new ATOM 0 HA ILE A 125 5.658 6.961 1.980 1.00 0.00 H new ATOM 0 HB ILE A 125 3.779 6.631 4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 125 4.717 4.407 2.541 1.00 0.00 H new ATOM 0 HG13 ILE A 125 5.668 4.877 3.936 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.216 5.697 2.689 1.00 0.00 H new ATOM 0 HG22 ILE A 125 2.636 7.388 2.327 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.383 6.067 1.397 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.196 2.997 4.472 1.00 0.00 H new ATOM 0 HD12 ILE A 125 3.740 4.435 5.416 1.00 0.00 H new ATOM 0 HD13 ILE A 125 2.775 3.958 3.999 1.00 0.00 H new ATOM 1968 N LYS A 126 4.413 9.200 4.107 1.00 0.00 N ATOM 1969 CA LYS A 126 3.891 10.560 4.225 1.00 0.00 C ATOM 1970 C LYS A 126 4.887 11.589 3.688 1.00 0.00 C ATOM 1971 O LYS A 126 4.493 12.573 3.057 1.00 0.00 O ATOM 1972 CB LYS A 126 3.558 10.869 5.687 1.00 0.00 C ATOM 1973 CG LYS A 126 2.131 11.349 5.903 1.00 0.00 C ATOM 1974 CD LYS A 126 1.739 11.292 7.371 1.00 0.00 C ATOM 1975 CE LYS A 126 0.760 10.160 7.649 1.00 0.00 C ATOM 1976 NZ LYS A 126 -0.595 10.667 7.999 1.00 0.00 N ATOM 0 H LYS A 126 4.465 8.695 4.992 1.00 0.00 H new ATOM 0 HA LYS A 126 2.983 10.624 3.625 1.00 0.00 H new ATOM 0 HB2 LYS A 126 3.725 9.973 6.285 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.247 11.630 6.054 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.031 12.371 5.538 1.00 0.00 H new ATOM 0 HG3 LYS A 126 1.447 10.734 5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 126 2.632 11.159 7.981 1.00 0.00 H new ATOM 0 HD3 LYS A 126 1.291 12.241 7.665 1.00 0.00 H new ATOM 0 HE2 LYS A 126 0.691 9.517 6.772 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.139 9.545 8.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -0.778 10.500 9.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -0.646 11.687 7.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -1.310 10.169 7.431 1.00 0.00 H new ATOM 1990 N SER A 127 6.175 11.356 3.940 1.00 0.00 N ATOM 1991 CA SER A 127 7.222 12.265 3.479 1.00 0.00 C ATOM 1992 C SER A 127 7.381 12.192 1.961 1.00 0.00 C ATOM 1993 O SER A 127 7.412 13.221 1.289 1.00 0.00 O ATOM 1994 CB SER A 127 8.552 11.942 4.164 1.00 0.00 C ATOM 1995 OG SER A 127 9.504 12.966 3.938 1.00 0.00 O ATOM 0 H SER A 127 6.517 10.548 4.459 1.00 0.00 H new ATOM 0 HA SER A 127 6.926 13.280 3.744 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.392 11.820 5.235 1.00 0.00 H new ATOM 0 HB3 SER A 127 8.937 10.994 3.789 1.00 0.00 H new ATOM 0 HG SER A 127 10.344 12.736 4.387 1.00 0.00 H new ATOM 2001 N GLU A 128 7.477 10.971 1.427 1.00 0.00 N ATOM 2002 CA GLU A 128 7.629 10.770 -0.016 1.00 0.00 C ATOM 2003 C GLU A 128 6.409 11.288 -0.774 1.00 0.00 C ATOM 2004 O GLU A 128 6.544 11.961 -1.794 1.00 0.00 O ATOM 2005 CB GLU A 128 7.841 9.285 -0.329 1.00 0.00 C ATOM 2006 CG GLU A 128 8.284 9.021 -1.760 1.00 0.00 C ATOM 2007 CD GLU A 128 9.768 9.261 -1.968 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.203 10.428 -1.853 1.00 0.00 O ATOM 2009 OE2 GLU A 128 10.494 8.284 -2.248 1.00 0.00 O ATOM 0 H GLU A 128 7.452 10.109 1.971 1.00 0.00 H new ATOM 0 HA GLU A 128 8.503 11.334 -0.341 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.588 8.882 0.354 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.912 8.746 -0.140 1.00 0.00 H new ATOM 0 HG2 GLU A 128 8.046 7.991 -2.025 1.00 0.00 H new ATOM 0 HG3 GLU A 128 7.718 9.663 -2.435 1.00 0.00 H new ATOM 2016 N LEU A 129 5.220 10.967 -0.270 1.00 0.00 N ATOM 2017 CA LEU A 129 3.972 11.398 -0.897 1.00 0.00 C ATOM 2018 C LEU A 129 3.875 12.923 -0.967 1.00 0.00 C ATOM 2019 O LEU A 129 3.355 13.471 -1.941 1.00 0.00 O ATOM 2020 CB LEU A 129 2.772 10.844 -0.126 1.00 0.00 C ATOM 2021 CG LEU A 129 2.041 9.686 -0.811 1.00 0.00 C ATOM 2022 CD1 LEU A 129 2.158 8.414 0.015 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.580 10.042 -1.045 1.00 0.00 C ATOM 0 H LEU A 129 5.094 10.408 0.574 1.00 0.00 H new ATOM 0 HA LEU A 129 3.965 11.008 -1.915 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.112 10.510 0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.062 11.654 0.042 1.00 0.00 H new ATOM 0 HG LEU A 129 2.510 9.508 -1.779 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.632 7.603 -0.489 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.209 8.149 0.128 1.00 0.00 H new ATOM 0 HD13 LEU A 129 1.717 8.577 0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.076 9.208 -1.533 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.098 10.249 -0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.518 10.925 -1.681 1.00 0.00 H new ATOM 2035 N LYS A 130 4.361 13.603 0.074 1.00 0.00 N ATOM 2036 CA LYS A 130 4.312 15.062 0.130 1.00 0.00 C ATOM 2037 C LYS A 130 5.503 15.694 -0.590 1.00 0.00 C ATOM 2038 O LYS A 130 5.325 16.472 -1.529 1.00 0.00 O ATOM 2039 CB LYS A 130 4.271 15.537 1.585 1.00 0.00 C ATOM 2040 CG LYS A 130 4.121 17.042 1.730 1.00 0.00 C ATOM 2041 CD LYS A 130 3.449 17.412 3.042 1.00 0.00 C ATOM 2042 CE LYS A 130 3.325 18.920 3.193 1.00 0.00 C ATOM 2043 NZ LYS A 130 1.941 19.402 2.918 1.00 0.00 N ATOM 0 H LYS A 130 4.792 13.165 0.888 1.00 0.00 H new ATOM 0 HA LYS A 130 3.403 15.380 -0.380 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.442 15.047 2.095 1.00 0.00 H new ATOM 0 HB3 LYS A 130 5.185 15.221 2.087 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.103 17.513 1.677 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.535 17.432 0.898 1.00 0.00 H new ATOM 0 HD2 LYS A 130 2.459 16.957 3.087 1.00 0.00 H new ATOM 0 HD3 LYS A 130 4.024 17.007 3.875 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.614 19.207 4.204 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.021 19.410 2.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 1.979 20.215 2.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 1.387 18.637 2.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.490 19.691 3.810 1.00 0.00 H new ATOM 2057 N LYS A 131 6.713 15.366 -0.138 1.00 0.00 N ATOM 2058 CA LYS A 131 7.932 15.913 -0.732 1.00 0.00 C ATOM 2059 C LYS A 131 8.181 15.337 -2.125 1.00 0.00 C ATOM 2060 O LYS A 131 8.369 16.085 -3.086 1.00 0.00 O ATOM 2061 CB LYS A 131 9.137 15.636 0.172 1.00 0.00 C ATOM 2062 CG LYS A 131 9.364 16.706 1.229 1.00 0.00 C ATOM 2063 CD LYS A 131 8.693 16.348 2.547 1.00 0.00 C ATOM 2064 CE LYS A 131 9.318 17.098 3.712 1.00 0.00 C ATOM 2065 NZ LYS A 131 8.861 16.569 5.028 1.00 0.00 N ATOM 0 H LYS A 131 6.875 14.724 0.638 1.00 0.00 H new ATOM 0 HA LYS A 131 7.798 16.990 -0.830 1.00 0.00 H new ATOM 0 HB2 LYS A 131 8.997 14.674 0.665 1.00 0.00 H new ATOM 0 HB3 LYS A 131 10.032 15.551 -0.445 1.00 0.00 H new ATOM 0 HG2 LYS A 131 10.434 16.837 1.390 1.00 0.00 H new ATOM 0 HG3 LYS A 131 8.976 17.659 0.871 1.00 0.00 H new ATOM 0 HD2 LYS A 131 7.630 16.582 2.491 1.00 0.00 H new ATOM 0 HD3 LYS A 131 8.774 15.275 2.718 1.00 0.00 H new ATOM 0 HE2 LYS A 131 10.404 17.025 3.649 1.00 0.00 H new ATOM 0 HE3 LYS A 131 9.065 18.156 3.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 9.311 17.109 5.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 7.828 16.662 5.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 9.125 15.566 5.110 1.00 0.00 H new ATOM 2079 N ALA A 132 8.184 14.007 -2.226 1.00 0.00 N ATOM 2080 CA ALA A 132 8.413 13.320 -3.498 1.00 0.00 C ATOM 2081 C ALA A 132 9.770 13.691 -4.101 1.00 0.00 C ATOM 2082 O ALA A 132 9.916 13.771 -5.323 1.00 0.00 O ATOM 2083 CB ALA A 132 7.287 13.634 -4.478 1.00 0.00 C ATOM 0 H ALA A 132 8.029 13.380 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 132 8.422 12.248 -3.302 1.00 0.00 H new ATOM 0 HB1 ALA A 132 7.470 13.117 -5.420 1.00 0.00 H new ATOM 0 HB2 ALA A 132 6.337 13.301 -4.060 1.00 0.00 H new ATOM 0 HB3 ALA A 132 7.248 14.709 -4.656 1.00 0.00 H new ATOM 2089 N GLY A 133 10.762 13.915 -3.235 1.00 0.00 N ATOM 2090 CA GLY A 133 12.093 14.275 -3.698 1.00 0.00 C ATOM 2091 C GLY A 133 12.100 15.532 -4.551 1.00 0.00 C ATOM 2092 O GLY A 133 12.797 15.591 -5.566 1.00 0.00 O ATOM 0 H GLY A 133 10.665 13.853 -2.222 1.00 0.00 H new ATOM 0 HA2 GLY A 133 12.745 14.422 -2.837 1.00 0.00 H new ATOM 0 HA3 GLY A 133 12.508 13.448 -4.274 1.00 0.00 H new ATOM 2096 N GLY A 134 11.323 16.539 -4.141 1.00 0.00 N ATOM 2097 CA GLY A 134 11.256 17.784 -4.887 1.00 0.00 C ATOM 2098 C GLY A 134 12.275 18.802 -4.411 1.00 0.00 C ATOM 2099 O GLY A 134 11.917 19.775 -3.748 1.00 0.00 O ATOM 0 H GLY A 134 10.740 16.511 -3.305 1.00 0.00 H new ATOM 0 HA2 GLY A 134 11.419 17.579 -5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 134 10.255 18.206 -4.794 1.00 0.00 H new ATOM 2103 N ALA A 135 13.548 18.566 -4.743 1.00 0.00 N ATOM 2104 CA ALA A 135 14.645 19.455 -4.345 1.00 0.00 C ATOM 2105 C ALA A 135 15.069 19.197 -2.899 1.00 0.00 C ATOM 2106 O ALA A 135 15.699 20.044 -2.264 1.00 0.00 O ATOM 2107 CB ALA A 135 14.260 20.919 -4.540 1.00 0.00 C ATOM 0 H ALA A 135 13.846 17.759 -5.291 1.00 0.00 H new ATOM 0 HA ALA A 135 15.497 19.238 -4.989 1.00 0.00 H new ATOM 0 HB1 ALA A 135 15.090 21.557 -4.238 1.00 0.00 H new ATOM 0 HB2 ALA A 135 14.029 21.098 -5.590 1.00 0.00 H new ATOM 0 HB3 ALA A 135 13.385 21.149 -3.932 1.00 0.00 H new ATOM 2113 N ASN A 136 14.720 18.016 -2.392 1.00 0.00 N ATOM 2114 CA ASN A 136 15.057 17.624 -1.026 1.00 0.00 C ATOM 2115 C ASN A 136 15.018 16.101 -0.873 1.00 0.00 C ATOM 2116 O ASN A 136 14.750 15.587 0.215 1.00 0.00 O ATOM 2117 CB ASN A 136 14.091 18.278 -0.024 1.00 0.00 C ATOM 2118 CG ASN A 136 12.676 18.391 -0.560 1.00 0.00 C ATOM 2119 OD1 ASN A 136 12.185 19.489 -0.814 1.00 0.00 O ATOM 2120 ND2 ASN A 136 12.014 17.253 -0.738 1.00 0.00 N ATOM 0 H ASN A 136 14.200 17.309 -2.912 1.00 0.00 H new ATOM 0 HA ASN A 136 16.069 17.969 -0.816 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.080 17.695 0.897 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.458 19.272 0.232 1.00 0.00 H new ATOM 0 HD21 ASN A 136 11.060 17.269 -1.099 1.00 0.00 H new ATOM 0 HD22 ASN A 136 12.460 16.363 -0.514 1.00 0.00 H new ATOM 2127 N TYR A 137 15.284 15.384 -1.972 1.00 0.00 N ATOM 2128 CA TYR A 137 15.273 13.922 -1.955 1.00 0.00 C ATOM 2129 C TYR A 137 16.145 13.377 -0.829 1.00 0.00 C ATOM 2130 O TYR A 137 15.649 12.713 0.083 1.00 0.00 O ATOM 2131 CB TYR A 137 15.752 13.359 -3.296 1.00 0.00 C ATOM 2132 CG TYR A 137 15.138 12.023 -3.636 1.00 0.00 C ATOM 2133 CD1 TYR A 137 15.418 10.893 -2.876 1.00 0.00 C ATOM 2134 CD2 TYR A 137 14.269 11.891 -4.710 1.00 0.00 C ATOM 2135 CE1 TYR A 137 14.849 9.673 -3.177 1.00 0.00 C ATOM 2136 CE2 TYR A 137 13.697 10.674 -5.020 1.00 0.00 C ATOM 2137 CZ TYR A 137 13.989 9.567 -4.250 1.00 0.00 C ATOM 2138 OH TYR A 137 13.416 8.355 -4.552 1.00 0.00 O ATOM 0 H TYR A 137 15.508 15.793 -2.879 1.00 0.00 H new ATOM 0 HA TYR A 137 14.244 13.605 -1.783 1.00 0.00 H new ATOM 0 HB2 TYR A 137 15.516 14.071 -4.086 1.00 0.00 H new ATOM 0 HB3 TYR A 137 16.837 13.257 -3.273 1.00 0.00 H new ATOM 0 HD1 TYR A 137 16.092 10.972 -2.036 1.00 0.00 H new ATOM 0 HD2 TYR A 137 14.036 12.756 -5.314 1.00 0.00 H new ATOM 0 HE1 TYR A 137 15.076 8.805 -2.575 1.00 0.00 H new ATOM 0 HE2 TYR A 137 13.024 10.589 -5.861 1.00 0.00 H new ATOM 0 HH TYR A 137 12.836 8.454 -5.336 1.00 0.00 H new ATOM 2148 N ASP A 138 17.445 13.659 -0.897 1.00 0.00 N ATOM 2149 CA ASP A 138 18.386 13.200 0.116 1.00 0.00 C ATOM 2150 C ASP A 138 19.082 14.379 0.788 1.00 0.00 C ATOM 2151 O ASP A 138 19.305 15.418 0.165 1.00 0.00 O ATOM 2152 CB ASP A 138 19.426 12.265 -0.506 1.00 0.00 C ATOM 2153 CG ASP A 138 20.358 11.661 0.528 1.00 0.00 C ATOM 2154 OD1 ASP A 138 19.859 11.011 1.472 1.00 0.00 O ATOM 2155 OD2 ASP A 138 21.587 11.841 0.397 1.00 0.00 O ATOM 0 H ASP A 138 17.869 14.205 -1.647 1.00 0.00 H new ATOM 0 HA ASP A 138 17.825 12.653 0.874 1.00 0.00 H new ATOM 0 HB2 ASP A 138 18.916 11.465 -1.042 1.00 0.00 H new ATOM 0 HB3 ASP A 138 20.013 12.817 -1.241 1.00 0.00 H new ATOM 2160 N ALA A 139 19.424 14.201 2.062 1.00 0.00 N ATOM 2161 CA ALA A 139 20.102 15.241 2.836 1.00 0.00 C ATOM 2162 C ALA A 139 20.463 14.740 4.238 1.00 0.00 C ATOM 2163 O ALA A 139 20.449 15.505 5.205 1.00 0.00 O ATOM 2164 CB ALA A 139 19.231 16.490 2.919 1.00 0.00 C ATOM 0 H ALA A 139 19.242 13.343 2.583 1.00 0.00 H new ATOM 0 HA ALA A 139 21.030 15.495 2.324 1.00 0.00 H new ATOM 0 HB1 ALA A 139 19.747 17.256 3.498 1.00 0.00 H new ATOM 0 HB2 ALA A 139 19.035 16.865 1.914 1.00 0.00 H new ATOM 0 HB3 ALA A 139 18.287 16.244 3.405 1.00 0.00 H new ATOM 2170 N GLN A 140 20.794 13.452 4.338 1.00 0.00 N ATOM 2171 CA GLN A 140 21.164 12.843 5.615 1.00 0.00 C ATOM 2172 C GLN A 140 22.620 12.383 5.617 1.00 0.00 C ATOM 2173 O GLN A 140 23.048 11.645 6.505 1.00 0.00 O ATOM 2174 CB GLN A 140 20.248 11.657 5.913 1.00 0.00 C ATOM 2175 CG GLN A 140 18.860 12.053 6.389 1.00 0.00 C ATOM 2176 CD GLN A 140 17.858 12.185 5.254 1.00 0.00 C ATOM 2177 OE1 GLN A 140 18.226 12.192 4.077 1.00 0.00 O ATOM 2178 NE2 GLN A 140 16.581 12.294 5.601 1.00 0.00 N ATOM 0 H GLN A 140 20.813 12.809 3.547 1.00 0.00 H new ATOM 0 HA GLN A 140 21.048 13.600 6.390 1.00 0.00 H new ATOM 0 HB2 GLN A 140 20.153 11.049 5.013 1.00 0.00 H new ATOM 0 HB3 GLN A 140 20.717 11.031 6.672 1.00 0.00 H new ATOM 0 HG2 GLN A 140 18.500 11.309 7.100 1.00 0.00 H new ATOM 0 HG3 GLN A 140 18.922 13.001 6.924 1.00 0.00 H new ATOM 0 HE21 GLN A 140 16.318 12.284 6.586 1.00 0.00 H new ATOM 0 HE22 GLN A 140 15.863 12.388 4.882 1.00 0.00 H new ATOM 2187 N THR A 141 23.370 12.828 4.622 1.00 0.00 N ATOM 2188 CA THR A 141 24.783 12.476 4.494 1.00 0.00 C ATOM 2189 C THR A 141 25.546 13.558 3.728 1.00 0.00 C ATOM 2190 O THR A 141 26.630 13.970 4.141 1.00 0.00 O ATOM 2191 CB THR A 141 24.938 11.112 3.802 1.00 0.00 C ATOM 2192 OG1 THR A 141 26.307 10.786 3.622 1.00 0.00 O ATOM 2193 CG2 THR A 141 24.263 11.036 2.447 1.00 0.00 C ATOM 0 H THR A 141 23.024 13.440 3.883 1.00 0.00 H new ATOM 0 HA THR A 141 25.208 12.405 5.495 1.00 0.00 H new ATOM 0 HB THR A 141 24.449 10.402 4.469 1.00 0.00 H new ATOM 0 HG1 THR A 141 26.380 9.914 3.181 1.00 0.00 H new ATOM 0 HG21 THR A 141 24.415 10.045 2.020 1.00 0.00 H new ATOM 0 HG22 THR A 141 23.195 11.222 2.562 1.00 0.00 H new ATOM 0 HG23 THR A 141 24.693 11.787 1.784 1.00 0.00 H new ATOM 2201 N GLU A 142 24.969 14.017 2.615 1.00 0.00 N ATOM 2202 CA GLU A 142 25.590 15.055 1.797 1.00 0.00 C ATOM 2203 C GLU A 142 25.516 16.412 2.493 1.00 0.00 C ATOM 2204 O GLU A 142 26.487 17.188 2.376 1.00 0.00 O ATOM 2205 CB GLU A 142 24.909 15.137 0.427 1.00 0.00 C ATOM 2206 CG GLU A 142 25.400 14.092 -0.561 1.00 0.00 C ATOM 2207 CD GLU A 142 24.963 14.385 -1.985 1.00 0.00 C ATOM 2208 OE1 GLU A 142 25.458 15.372 -2.568 1.00 0.00 O ATOM 2209 OE2 GLU A 142 24.125 13.625 -2.517 1.00 0.00 O ATOM 0 H GLU A 142 24.072 13.684 2.261 1.00 0.00 H new ATOM 0 HA GLU A 142 26.638 14.791 1.658 1.00 0.00 H new ATOM 0 HB2 GLU A 142 23.833 15.023 0.558 1.00 0.00 H new ATOM 0 HB3 GLU A 142 25.076 16.129 0.007 1.00 0.00 H new ATOM 0 HG2 GLU A 142 26.488 14.043 -0.522 1.00 0.00 H new ATOM 0 HG3 GLU A 142 25.026 13.112 -0.264 1.00 0.00 H new TER 2216 GLU A 142