USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1053 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 130 THR OG1 : rot 180:sc= -0.231 USER MOD Set 1.2: A 135 LYS NZ :NH3+ 171:sc= 0.344 (180deg=0.286) USER MOD Set 2.1: A 111 LYS NZ :NH3+ -164:sc= 0 (180deg=0) USER MOD Set 2.2: A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 86 CYS SG : rot 82:sc= -1.05! USER MOD Set 3.2: A 90 THR OG1 : rot 92:sc= 1.01 USER MOD Set 4.1: A 80 TYR OH : rot 170:sc= -0.618 USER MOD Set 4.2: A 89 GLN : amide:sc= -1.59! C(o=-2.2!,f=-6.8!) USER MOD Set 5.1: A 34 GLN : amide:sc= -1.5 K(o=-2.4,f=-0.52) USER MOD Set 5.2: A 37 GLN : amide:sc= -0.876 K(o=-2.4,f=-0.52) USER MOD Single : A 10 MET CE :methyl 148:sc= -1.29! (180deg=-1.55) USER MOD Single : A 19 CYS SG : rot 12:sc= 1.3 USER MOD Single : A 20 TYR OH : rot 130:sc= -1.11 USER MOD Single : A 21 CYS SG : rot -76:sc= -3.11! USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -1.65 K(o=-1.6,f=-0.96) USER MOD Single : A 31 MET CE :methyl -150:sc= -1.86 (180deg=-4.39!) USER MOD Single : A 43 LYS NZ :NH3+ 151:sc= 1.56 (180deg=0.754) USER MOD Single : A 45 CYS SG : rot -34:sc= -2.9 USER MOD Single : A 47 SER OG : rot 63:sc= 0.0324 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0.0339 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot 150:sc= -0.0721 USER MOD Single : A 72 MET CE :methyl 142:sc= -0.394 (180deg=-3.12!) USER MOD Single : A 77 SER OG : rot 157:sc= 0.0903 USER MOD Single : A 82 GLN : amide:sc= -0.509 K(o=-0.51,f=-1.5!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -35:sc= 0.979 USER MOD Single : A 97 SER OG : rot 180:sc= -0.525 USER MOD Single : A 101 HIS : no HE2:sc= -0.324 K(o=-0.32,f=-1.2) USER MOD Single : A 102 GLN : amide:sc= -1.22 X(o=-1.2,f=-1.4) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ -162:sc= -0.275 (180deg=-0.593) USER MOD Single : A 110 TYR OH : rot -62:sc= 1.02 USER MOD Single : A 113 MET CE :methyl 137:sc= -4.96! (180deg=-12.5!) USER MOD Single : A 115 LYS NZ :NH3+ 161:sc= -2.01 (180deg=-3.26) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 CYS SG : rot 85:sc= 0.209 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 133 CYS SG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N MET A 10 -6.476 -11.244 -12.857 1.00 0.00 N ATOM 20 CA MET A 10 -6.312 -11.566 -11.443 1.00 0.00 C ATOM 21 C MET A 10 -5.549 -12.875 -11.267 1.00 0.00 C ATOM 22 O MET A 10 -6.149 -13.926 -11.041 1.00 0.00 O ATOM 23 CB MET A 10 -7.678 -11.661 -10.760 1.00 0.00 C ATOM 24 CG MET A 10 -7.593 -11.899 -9.261 1.00 0.00 C ATOM 25 SD MET A 10 -9.145 -12.495 -8.564 1.00 0.00 S ATOM 26 CE MET A 10 -9.822 -10.978 -7.896 1.00 0.00 C ATOM 0 HA MET A 10 -5.735 -10.767 -10.978 1.00 0.00 H new ATOM 0 HB2 MET A 10 -8.231 -10.740 -10.942 1.00 0.00 H new ATOM 0 HB3 MET A 10 -8.248 -12.470 -11.216 1.00 0.00 H new ATOM 0 HG2 MET A 10 -6.805 -12.624 -9.056 1.00 0.00 H new ATOM 0 HG3 MET A 10 -7.309 -10.971 -8.765 1.00 0.00 H new ATOM 0 HE1 MET A 10 -10.910 -11.009 -7.954 1.00 0.00 H new ATOM 0 HE2 MET A 10 -9.517 -10.871 -6.855 1.00 0.00 H new ATOM 0 HE3 MET A 10 -9.452 -10.130 -8.472 1.00 0.00 H new ATOM 36 N PRO A 11 -4.210 -12.831 -11.369 1.00 0.00 N ATOM 37 CA PRO A 11 -3.367 -14.020 -11.218 1.00 0.00 C ATOM 38 C PRO A 11 -3.475 -14.633 -9.825 1.00 0.00 C ATOM 39 O PRO A 11 -4.220 -14.141 -8.978 1.00 0.00 O ATOM 40 CB PRO A 11 -1.946 -13.497 -11.461 1.00 0.00 C ATOM 41 CG PRO A 11 -2.028 -12.027 -11.221 1.00 0.00 C ATOM 42 CD PRO A 11 -3.413 -11.620 -11.636 1.00 0.00 C ATOM 0 HA PRO A 11 -3.663 -14.812 -11.906 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -1.232 -13.968 -10.786 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -1.614 -13.713 -12.477 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -1.849 -11.792 -10.172 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -1.274 -11.494 -11.800 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -3.772 -10.766 -11.061 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -3.452 -11.335 -12.687 1.00 0.00 H new ATOM 50 N GLU A 12 -2.729 -15.707 -9.598 1.00 0.00 N ATOM 51 CA GLU A 12 -2.742 -16.389 -8.308 1.00 0.00 C ATOM 52 C GLU A 12 -1.721 -15.773 -7.357 1.00 0.00 C ATOM 53 O GLU A 12 -1.946 -15.703 -6.148 1.00 0.00 O ATOM 54 CB GLU A 12 -2.451 -17.878 -8.491 1.00 0.00 C ATOM 55 CG GLU A 12 -3.277 -18.529 -9.589 1.00 0.00 C ATOM 56 CD GLU A 12 -2.573 -19.711 -10.225 1.00 0.00 C ATOM 57 OE1 GLU A 12 -1.686 -20.298 -9.570 1.00 0.00 O ATOM 58 OE2 GLU A 12 -2.907 -20.049 -11.381 1.00 0.00 O ATOM 0 H GLU A 12 -2.107 -16.125 -10.290 1.00 0.00 H new ATOM 0 HA GLU A 12 -3.735 -16.271 -7.873 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -1.393 -18.008 -8.719 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -2.640 -18.395 -7.550 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.230 -18.858 -9.175 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -3.502 -17.789 -10.357 1.00 0.00 H new ATOM 65 N ARG A 13 -0.598 -15.329 -7.911 1.00 0.00 N ATOM 66 CA ARG A 13 0.459 -14.720 -7.111 1.00 0.00 C ATOM 67 C ARG A 13 0.530 -13.217 -7.359 1.00 0.00 C ATOM 68 O ARG A 13 0.603 -12.767 -8.502 1.00 0.00 O ATOM 69 CB ARG A 13 1.808 -15.365 -7.435 1.00 0.00 C ATOM 70 CG ARG A 13 1.757 -16.883 -7.503 1.00 0.00 C ATOM 71 CD ARG A 13 1.764 -17.380 -8.941 1.00 0.00 C ATOM 72 NE ARG A 13 2.943 -18.190 -9.233 1.00 0.00 N ATOM 73 CZ ARG A 13 3.174 -18.765 -10.410 1.00 0.00 C ATOM 74 NH1 ARG A 13 2.309 -18.623 -11.408 1.00 0.00 N ATOM 75 NH2 ARG A 13 4.274 -19.485 -10.593 1.00 0.00 N ATOM 0 H ARG A 13 -0.396 -15.379 -8.910 1.00 0.00 H new ATOM 0 HA ARG A 13 0.227 -14.887 -6.059 1.00 0.00 H new ATOM 0 HB2 ARG A 13 2.166 -14.979 -8.389 1.00 0.00 H new ATOM 0 HB3 ARG A 13 2.534 -15.068 -6.678 1.00 0.00 H new ATOM 0 HG2 ARG A 13 2.611 -17.301 -6.969 1.00 0.00 H new ATOM 0 HG3 ARG A 13 0.859 -17.240 -6.998 1.00 0.00 H new ATOM 0 HD2 ARG A 13 0.865 -17.968 -9.126 1.00 0.00 H new ATOM 0 HD3 ARG A 13 1.732 -16.528 -9.620 1.00 0.00 H new ATOM 0 HE ARG A 13 3.630 -18.323 -8.491 1.00 0.00 H new ATOM 0 HH11 ARG A 13 1.462 -18.071 -11.274 1.00 0.00 H new ATOM 0 HH12 ARG A 13 2.492 -19.066 -12.308 1.00 0.00 H new ATOM 0 HH21 ARG A 13 4.943 -19.598 -9.831 1.00 0.00 H new ATOM 0 HH22 ARG A 13 4.451 -19.926 -11.496 1.00 0.00 H new ATOM 89 N PHE A 14 0.508 -12.442 -6.278 1.00 0.00 N ATOM 90 CA PHE A 14 0.570 -10.990 -6.376 1.00 0.00 C ATOM 91 C PHE A 14 1.769 -10.445 -5.609 1.00 0.00 C ATOM 92 O PHE A 14 2.453 -11.186 -4.901 1.00 0.00 O ATOM 93 CB PHE A 14 -0.720 -10.367 -5.845 1.00 0.00 C ATOM 94 CG PHE A 14 -1.942 -10.787 -6.610 1.00 0.00 C ATOM 95 CD1 PHE A 14 -2.358 -10.075 -7.723 1.00 0.00 C ATOM 96 CD2 PHE A 14 -2.673 -11.895 -6.217 1.00 0.00 C ATOM 97 CE1 PHE A 14 -3.481 -10.460 -8.430 1.00 0.00 C ATOM 98 CE2 PHE A 14 -3.798 -12.286 -6.920 1.00 0.00 C ATOM 99 CZ PHE A 14 -4.202 -11.566 -8.028 1.00 0.00 C ATOM 0 H PHE A 14 0.448 -12.798 -5.324 1.00 0.00 H new ATOM 0 HA PHE A 14 0.685 -10.725 -7.427 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -0.844 -10.642 -4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -0.633 -9.281 -5.881 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -1.798 -9.208 -8.042 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.361 -12.461 -5.351 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -3.794 -9.896 -9.296 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -4.360 -13.152 -6.604 1.00 0.00 H new ATOM 0 HZ PHE A 14 -5.081 -11.868 -8.579 1.00 0.00 H new ATOM 109 N ASP A 15 2.024 -9.152 -5.760 1.00 0.00 N ATOM 110 CA ASP A 15 3.147 -8.514 -5.084 1.00 0.00 C ATOM 111 C ASP A 15 2.687 -7.762 -3.840 1.00 0.00 C ATOM 112 O ASP A 15 3.051 -8.118 -2.719 1.00 0.00 O ATOM 113 CB ASP A 15 3.866 -7.557 -6.036 1.00 0.00 C ATOM 114 CG ASP A 15 4.838 -8.275 -6.953 1.00 0.00 C ATOM 115 OD1 ASP A 15 4.691 -9.503 -7.129 1.00 0.00 O ATOM 116 OD2 ASP A 15 5.745 -7.608 -7.494 1.00 0.00 O ATOM 0 H ASP A 15 1.470 -8.525 -6.343 1.00 0.00 H new ATOM 0 HA ASP A 15 3.839 -9.297 -4.773 1.00 0.00 H new ATOM 0 HB2 ASP A 15 3.129 -7.025 -6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 15 4.404 -6.808 -5.456 1.00 0.00 H new ATOM 121 N ALA A 16 1.895 -6.712 -4.042 1.00 0.00 N ATOM 122 CA ALA A 16 1.406 -5.910 -2.925 1.00 0.00 C ATOM 123 C ALA A 16 -0.044 -5.480 -3.119 1.00 0.00 C ATOM 124 O ALA A 16 -0.625 -5.666 -4.188 1.00 0.00 O ATOM 125 CB ALA A 16 2.291 -4.686 -2.733 1.00 0.00 C ATOM 0 H ALA A 16 1.581 -6.399 -4.960 1.00 0.00 H new ATOM 0 HA ALA A 16 1.446 -6.535 -2.033 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.917 -4.094 -1.897 1.00 0.00 H new ATOM 0 HB2 ALA A 16 3.312 -5.005 -2.524 1.00 0.00 H new ATOM 0 HB3 ALA A 16 2.278 -4.082 -3.640 1.00 0.00 H new ATOM 131 N PHE A 17 -0.613 -4.891 -2.070 1.00 0.00 N ATOM 132 CA PHE A 17 -1.989 -4.412 -2.105 1.00 0.00 C ATOM 133 C PHE A 17 -2.043 -2.925 -1.756 1.00 0.00 C ATOM 134 O PHE A 17 -1.168 -2.414 -1.061 1.00 0.00 O ATOM 135 CB PHE A 17 -2.858 -5.207 -1.131 1.00 0.00 C ATOM 136 CG PHE A 17 -4.316 -4.854 -1.200 1.00 0.00 C ATOM 137 CD1 PHE A 17 -5.155 -5.496 -2.095 1.00 0.00 C ATOM 138 CD2 PHE A 17 -4.845 -3.879 -0.369 1.00 0.00 C ATOM 139 CE1 PHE A 17 -6.496 -5.172 -2.162 1.00 0.00 C ATOM 140 CE2 PHE A 17 -6.186 -3.552 -0.432 1.00 0.00 C ATOM 141 CZ PHE A 17 -7.013 -4.199 -1.329 1.00 0.00 C ATOM 0 H PHE A 17 -0.138 -4.734 -1.181 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.375 -4.553 -3.115 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -2.740 -6.271 -1.337 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -2.499 -5.038 -0.116 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -4.757 -6.258 -2.748 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.203 -3.370 0.335 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -7.140 -5.679 -2.865 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -6.587 -2.790 0.220 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.061 -3.945 -1.379 1.00 0.00 H new ATOM 151 N ILE A 18 -3.068 -2.235 -2.246 1.00 0.00 N ATOM 152 CA ILE A 18 -3.218 -0.808 -1.980 1.00 0.00 C ATOM 153 C ILE A 18 -4.402 -0.536 -1.056 1.00 0.00 C ATOM 154 O ILE A 18 -5.547 -0.843 -1.391 1.00 0.00 O ATOM 155 CB ILE A 18 -3.408 -0.004 -3.283 1.00 0.00 C ATOM 156 CG1 ILE A 18 -2.298 -0.339 -4.282 1.00 0.00 C ATOM 157 CG2 ILE A 18 -3.428 1.490 -2.986 1.00 0.00 C ATOM 158 CD1 ILE A 18 -0.912 0.012 -3.790 1.00 0.00 C ATOM 0 H ILE A 18 -3.804 -2.638 -2.826 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.298 -0.486 -1.493 1.00 0.00 H new ATOM 0 HB ILE A 18 -4.365 -0.280 -3.726 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -2.335 -1.405 -4.509 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.488 0.192 -5.215 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -3.563 2.044 -3.915 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -4.250 1.715 -2.307 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -2.485 1.782 -2.523 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -0.178 -0.254 -4.551 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -0.857 1.082 -3.591 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.701 -0.539 -2.874 1.00 0.00 H new ATOM 170 N CYS A 19 -4.119 0.042 0.108 1.00 0.00 N ATOM 171 CA CYS A 19 -5.162 0.355 1.079 1.00 0.00 C ATOM 172 C CYS A 19 -5.313 1.867 1.258 1.00 0.00 C ATOM 173 O CYS A 19 -4.573 2.490 2.022 1.00 0.00 O ATOM 174 CB CYS A 19 -4.845 -0.298 2.426 1.00 0.00 C ATOM 175 SG CYS A 19 -5.158 -2.078 2.473 1.00 0.00 S ATOM 0 H CYS A 19 -3.177 0.303 0.401 1.00 0.00 H new ATOM 0 HA CYS A 19 -6.104 -0.042 0.700 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -3.798 -0.117 2.668 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -5.439 0.186 3.201 1.00 0.00 H new ATOM 0 HG CYS A 19 -5.355 -2.516 1.265 1.00 0.00 H new ATOM 181 N TYR A 20 -6.281 2.449 0.551 1.00 0.00 N ATOM 182 CA TYR A 20 -6.533 3.885 0.637 1.00 0.00 C ATOM 183 C TYR A 20 -8.022 4.196 0.485 1.00 0.00 C ATOM 184 O TYR A 20 -8.803 3.346 0.058 1.00 0.00 O ATOM 185 CB TYR A 20 -5.731 4.633 -0.428 1.00 0.00 C ATOM 186 CG TYR A 20 -5.678 6.130 -0.206 1.00 0.00 C ATOM 187 CD1 TYR A 20 -5.448 6.659 1.058 1.00 0.00 C ATOM 188 CD2 TYR A 20 -5.861 7.011 -1.261 1.00 0.00 C ATOM 189 CE1 TYR A 20 -5.399 8.024 1.263 1.00 0.00 C ATOM 190 CE2 TYR A 20 -5.813 8.379 -1.065 1.00 0.00 C ATOM 191 CZ TYR A 20 -5.582 8.880 0.197 1.00 0.00 C ATOM 192 OH TYR A 20 -5.536 10.240 0.394 1.00 0.00 O ATOM 0 H TYR A 20 -6.901 1.949 -0.086 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.213 4.220 1.624 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.714 4.241 -0.448 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.168 4.434 -1.407 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -5.305 5.991 1.895 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -6.044 6.622 -2.252 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -5.218 8.419 2.252 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.956 9.052 -1.898 1.00 0.00 H new ATOM 0 HH TYR A 20 -4.930 10.645 -0.261 1.00 0.00 H new ATOM 202 N CYS A 21 -8.404 5.423 0.835 1.00 0.00 N ATOM 203 CA CYS A 21 -9.793 5.858 0.738 1.00 0.00 C ATOM 204 C CYS A 21 -10.107 6.378 -0.667 1.00 0.00 C ATOM 205 O CYS A 21 -9.220 6.858 -1.371 1.00 0.00 O ATOM 206 CB CYS A 21 -10.078 6.950 1.775 1.00 0.00 C ATOM 207 SG CYS A 21 -11.450 6.572 2.892 1.00 0.00 S ATOM 0 H CYS A 21 -7.766 6.135 1.190 1.00 0.00 H new ATOM 0 HA CYS A 21 -10.433 4.998 0.937 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -9.178 7.117 2.367 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -10.295 7.883 1.254 1.00 0.00 H new ATOM 0 HG CYS A 21 -12.577 6.743 2.268 1.00 0.00 H new ATOM 213 N PRO A 22 -11.382 6.284 -1.092 1.00 0.00 N ATOM 214 CA PRO A 22 -11.812 6.743 -2.418 1.00 0.00 C ATOM 215 C PRO A 22 -11.963 8.261 -2.510 1.00 0.00 C ATOM 216 O PRO A 22 -12.376 8.788 -3.543 1.00 0.00 O ATOM 217 CB PRO A 22 -13.168 6.064 -2.593 1.00 0.00 C ATOM 218 CG PRO A 22 -13.699 5.925 -1.210 1.00 0.00 C ATOM 219 CD PRO A 22 -12.504 5.720 -0.316 1.00 0.00 C ATOM 0 HA PRO A 22 -11.080 6.494 -3.186 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -13.834 6.662 -3.215 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -13.066 5.093 -3.078 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -14.256 6.815 -0.916 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -14.386 5.081 -1.140 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -12.627 6.231 0.639 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -12.346 4.664 -0.095 1.00 0.00 H new ATOM 227 N SER A 23 -11.628 8.966 -1.431 1.00 0.00 N ATOM 228 CA SER A 23 -11.732 10.419 -1.408 1.00 0.00 C ATOM 229 C SER A 23 -10.672 11.035 -2.306 1.00 0.00 C ATOM 230 O SER A 23 -10.928 12.008 -3.013 1.00 0.00 O ATOM 231 CB SER A 23 -11.579 10.943 0.021 1.00 0.00 C ATOM 232 OG SER A 23 -12.803 10.854 0.730 1.00 0.00 O ATOM 0 H SER A 23 -11.283 8.553 -0.564 1.00 0.00 H new ATOM 0 HA SER A 23 -12.717 10.702 -1.779 1.00 0.00 H new ATOM 0 HB2 SER A 23 -10.811 10.371 0.541 1.00 0.00 H new ATOM 0 HB3 SER A 23 -11.243 11.980 -0.002 1.00 0.00 H new ATOM 0 HG SER A 23 -12.679 11.193 1.641 1.00 0.00 H new ATOM 238 N ASP A 24 -9.479 10.454 -2.275 1.00 0.00 N ATOM 239 CA ASP A 24 -8.378 10.937 -3.093 1.00 0.00 C ATOM 240 C ASP A 24 -7.589 9.774 -3.683 1.00 0.00 C ATOM 241 O ASP A 24 -6.383 9.876 -3.908 1.00 0.00 O ATOM 242 CB ASP A 24 -7.454 11.837 -2.271 1.00 0.00 C ATOM 243 CG ASP A 24 -6.730 12.856 -3.126 1.00 0.00 C ATOM 244 OD1 ASP A 24 -6.463 12.556 -4.309 1.00 0.00 O ATOM 245 OD2 ASP A 24 -6.426 13.954 -2.615 1.00 0.00 O ATOM 0 H ASP A 24 -9.251 9.649 -1.692 1.00 0.00 H new ATOM 0 HA ASP A 24 -8.797 11.520 -3.913 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -8.038 12.355 -1.510 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.723 11.221 -1.747 1.00 0.00 H new ATOM 250 N ILE A 25 -8.281 8.666 -3.929 1.00 0.00 N ATOM 251 CA ILE A 25 -7.653 7.476 -4.489 1.00 0.00 C ATOM 252 C ILE A 25 -7.017 7.766 -5.846 1.00 0.00 C ATOM 253 O ILE A 25 -5.938 7.260 -6.154 1.00 0.00 O ATOM 254 CB ILE A 25 -8.673 6.326 -4.631 1.00 0.00 C ATOM 255 CG1 ILE A 25 -7.953 5.001 -4.907 1.00 0.00 C ATOM 256 CG2 ILE A 25 -9.689 6.637 -5.723 1.00 0.00 C ATOM 257 CD1 ILE A 25 -7.415 4.869 -6.317 1.00 0.00 C ATOM 0 H ILE A 25 -9.280 8.568 -3.748 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.869 7.172 -3.796 1.00 0.00 H new ATOM 0 HB ILE A 25 -9.215 6.227 -3.690 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -7.127 4.896 -4.204 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -8.642 4.179 -4.715 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -10.398 5.813 -5.806 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -10.224 7.553 -5.472 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -9.173 6.768 -6.674 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.921 3.904 -6.429 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.238 4.940 -7.028 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -6.699 5.668 -6.510 1.00 0.00 H new ATOM 269 N GLN A 26 -7.697 8.575 -6.654 1.00 0.00 N ATOM 270 CA GLN A 26 -7.208 8.935 -7.985 1.00 0.00 C ATOM 271 C GLN A 26 -5.709 9.229 -7.969 1.00 0.00 C ATOM 272 O GLN A 26 -4.981 8.859 -8.892 1.00 0.00 O ATOM 273 CB GLN A 26 -7.969 10.151 -8.518 1.00 0.00 C ATOM 274 CG GLN A 26 -9.316 9.806 -9.127 1.00 0.00 C ATOM 275 CD GLN A 26 -9.612 10.606 -10.380 1.00 0.00 C ATOM 276 OE1 GLN A 26 -10.223 11.672 -10.320 1.00 0.00 O ATOM 277 NE2 GLN A 26 -9.179 10.092 -11.527 1.00 0.00 N ATOM 0 H GLN A 26 -8.593 8.996 -6.410 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.380 8.083 -8.643 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -8.119 10.861 -7.704 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -7.358 10.651 -9.269 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.341 8.743 -9.365 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.100 9.987 -8.392 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -8.676 9.205 -11.531 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -9.350 10.585 -12.403 1.00 0.00 H new ATOM 286 N PHE A 27 -5.255 9.891 -6.912 1.00 0.00 N ATOM 287 CA PHE A 27 -3.843 10.231 -6.773 1.00 0.00 C ATOM 288 C PHE A 27 -2.999 8.973 -6.599 1.00 0.00 C ATOM 289 O PHE A 27 -2.025 8.761 -7.322 1.00 0.00 O ATOM 290 CB PHE A 27 -3.637 11.167 -5.580 1.00 0.00 C ATOM 291 CG PHE A 27 -2.412 12.027 -5.697 1.00 0.00 C ATOM 292 CD1 PHE A 27 -1.173 11.550 -5.298 1.00 0.00 C ATOM 293 CD2 PHE A 27 -2.499 13.314 -6.207 1.00 0.00 C ATOM 294 CE1 PHE A 27 -0.044 12.341 -5.406 1.00 0.00 C ATOM 295 CE2 PHE A 27 -1.373 14.107 -6.316 1.00 0.00 C ATOM 296 CZ PHE A 27 -0.144 13.621 -5.915 1.00 0.00 C ATOM 0 H PHE A 27 -5.843 10.203 -6.139 1.00 0.00 H new ATOM 0 HA PHE A 27 -3.524 10.740 -7.683 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.512 11.808 -5.476 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.568 10.572 -4.669 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.089 10.550 -4.899 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -3.457 13.700 -6.522 1.00 0.00 H new ATOM 0 HE1 PHE A 27 0.916 11.958 -5.092 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -1.454 15.107 -6.715 1.00 0.00 H new ATOM 0 HZ PHE A 27 0.737 14.240 -5.999 1.00 0.00 H new ATOM 306 N VAL A 28 -3.382 8.138 -5.639 1.00 0.00 N ATOM 307 CA VAL A 28 -2.661 6.900 -5.372 1.00 0.00 C ATOM 308 C VAL A 28 -2.596 6.021 -6.614 1.00 0.00 C ATOM 309 O VAL A 28 -1.512 5.665 -7.075 1.00 0.00 O ATOM 310 CB VAL A 28 -3.312 6.108 -4.223 1.00 0.00 C ATOM 311 CG1 VAL A 28 -2.496 4.867 -3.895 1.00 0.00 C ATOM 312 CG2 VAL A 28 -3.465 6.992 -2.995 1.00 0.00 C ATOM 0 H VAL A 28 -4.187 8.296 -5.033 1.00 0.00 H new ATOM 0 HA VAL A 28 -1.649 7.180 -5.080 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.303 5.785 -4.543 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.974 4.322 -3.081 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -2.438 4.227 -4.775 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -1.491 5.162 -3.594 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.926 6.420 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.484 7.343 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -4.094 7.848 -3.239 1.00 0.00 H new ATOM 322 N GLN A 29 -3.759 5.674 -7.161 1.00 0.00 N ATOM 323 CA GLN A 29 -3.820 4.840 -8.350 1.00 0.00 C ATOM 324 C GLN A 29 -2.891 5.374 -9.433 1.00 0.00 C ATOM 325 O GLN A 29 -2.271 4.604 -10.165 1.00 0.00 O ATOM 326 CB GLN A 29 -5.254 4.768 -8.872 1.00 0.00 C ATOM 327 CG GLN A 29 -5.866 6.125 -9.178 1.00 0.00 C ATOM 328 CD GLN A 29 -7.012 6.036 -10.169 1.00 0.00 C ATOM 329 OE1 GLN A 29 -6.798 5.840 -11.365 1.00 0.00 O ATOM 330 NE2 GLN A 29 -8.235 6.181 -9.674 1.00 0.00 N ATOM 0 H GLN A 29 -4.668 5.959 -6.797 1.00 0.00 H new ATOM 0 HA GLN A 29 -3.492 3.836 -8.081 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.271 4.160 -9.777 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -5.874 4.259 -8.134 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.225 6.575 -8.252 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.096 6.786 -9.576 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -8.365 6.342 -8.675 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -9.045 6.131 -10.292 1.00 0.00 H new ATOM 339 N GLU A 30 -2.787 6.698 -9.521 1.00 0.00 N ATOM 340 CA GLU A 30 -1.919 7.327 -10.507 1.00 0.00 C ATOM 341 C GLU A 30 -0.472 6.897 -10.293 1.00 0.00 C ATOM 342 O GLU A 30 0.235 6.557 -11.243 1.00 0.00 O ATOM 343 CB GLU A 30 -2.036 8.853 -10.426 1.00 0.00 C ATOM 344 CG GLU A 30 -2.946 9.449 -11.488 1.00 0.00 C ATOM 345 CD GLU A 30 -2.174 10.115 -12.610 1.00 0.00 C ATOM 346 OE1 GLU A 30 -1.073 10.641 -12.343 1.00 0.00 O ATOM 347 OE2 GLU A 30 -2.672 10.112 -13.756 1.00 0.00 O ATOM 0 H GLU A 30 -3.292 7.352 -8.923 1.00 0.00 H new ATOM 0 HA GLU A 30 -2.235 7.006 -11.500 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -2.412 9.129 -9.441 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -1.043 9.291 -10.523 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -3.577 8.663 -11.903 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -3.609 10.179 -11.025 1.00 0.00 H new ATOM 354 N MET A 31 -0.039 6.898 -9.035 1.00 0.00 N ATOM 355 CA MET A 31 1.321 6.491 -8.700 1.00 0.00 C ATOM 356 C MET A 31 1.482 4.988 -8.890 1.00 0.00 C ATOM 357 O MET A 31 2.380 4.530 -9.598 1.00 0.00 O ATOM 358 CB MET A 31 1.663 6.855 -7.252 1.00 0.00 C ATOM 359 CG MET A 31 1.135 8.210 -6.806 1.00 0.00 C ATOM 360 SD MET A 31 1.414 8.518 -5.049 1.00 0.00 S ATOM 361 CE MET A 31 0.978 6.928 -4.346 1.00 0.00 C ATOM 0 H MET A 31 -0.608 7.175 -8.235 1.00 0.00 H new ATOM 0 HA MET A 31 2.002 7.021 -9.366 1.00 0.00 H new ATOM 0 HB2 MET A 31 1.261 6.086 -6.592 1.00 0.00 H new ATOM 0 HB3 MET A 31 2.746 6.843 -7.133 1.00 0.00 H new ATOM 0 HG2 MET A 31 1.617 8.994 -7.390 1.00 0.00 H new ATOM 0 HG3 MET A 31 0.067 8.267 -7.016 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.585 7.071 -3.339 1.00 0.00 H new ATOM 0 HE2 MET A 31 0.220 6.451 -4.967 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.864 6.294 -4.303 1.00 0.00 H new ATOM 371 N ILE A 32 0.601 4.227 -8.248 1.00 0.00 N ATOM 372 CA ILE A 32 0.630 2.772 -8.332 1.00 0.00 C ATOM 373 C ILE A 32 0.645 2.304 -9.788 1.00 0.00 C ATOM 374 O ILE A 32 1.560 1.599 -10.208 1.00 0.00 O ATOM 375 CB ILE A 32 -0.577 2.151 -7.585 1.00 0.00 C ATOM 376 CG1 ILE A 32 -0.311 2.122 -6.078 1.00 0.00 C ATOM 377 CG2 ILE A 32 -0.878 0.746 -8.090 1.00 0.00 C ATOM 378 CD1 ILE A 32 -0.007 3.481 -5.488 1.00 0.00 C ATOM 0 H ILE A 32 -0.146 4.597 -7.661 1.00 0.00 H new ATOM 0 HA ILE A 32 1.548 2.433 -7.852 1.00 0.00 H new ATOM 0 HB ILE A 32 -1.449 2.775 -7.782 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -1.181 1.703 -5.572 1.00 0.00 H new ATOM 0 HG13 ILE A 32 0.527 1.454 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.730 0.338 -7.546 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.112 0.784 -9.154 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -0.008 0.109 -7.932 1.00 0.00 H new ATOM 0 HD11 ILE A 32 0.170 3.381 -4.417 1.00 0.00 H new ATOM 0 HD12 ILE A 32 0.881 3.895 -5.966 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -0.853 4.148 -5.655 1.00 0.00 H new ATOM 390 N ARG A 33 -0.367 2.704 -10.555 1.00 0.00 N ATOM 391 CA ARG A 33 -0.452 2.324 -11.955 1.00 0.00 C ATOM 392 C ARG A 33 0.813 2.740 -12.702 1.00 0.00 C ATOM 393 O ARG A 33 1.271 2.043 -13.608 1.00 0.00 O ATOM 394 CB ARG A 33 -1.683 2.964 -12.600 1.00 0.00 C ATOM 395 CG ARG A 33 -1.580 4.473 -12.765 1.00 0.00 C ATOM 396 CD ARG A 33 -1.031 4.851 -14.131 1.00 0.00 C ATOM 397 NE ARG A 33 -1.138 6.286 -14.384 1.00 0.00 N ATOM 398 CZ ARG A 33 -0.399 6.940 -15.278 1.00 0.00 C ATOM 399 NH1 ARG A 33 0.496 6.291 -16.013 1.00 0.00 N ATOM 400 NH2 ARG A 33 -0.557 8.247 -15.438 1.00 0.00 N ATOM 0 H ARG A 33 -1.135 3.289 -10.228 1.00 0.00 H new ATOM 0 HA ARG A 33 -0.546 1.240 -12.015 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -1.844 2.512 -13.579 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -2.559 2.734 -11.994 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -2.564 4.922 -12.631 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.935 4.881 -11.987 1.00 0.00 H new ATOM 0 HD2 ARG A 33 0.014 4.547 -14.199 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.572 4.305 -14.904 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.820 6.819 -13.843 1.00 0.00 H new ATOM 0 HH11 ARG A 33 0.621 5.286 -15.895 1.00 0.00 H new ATOM 0 HH12 ARG A 33 1.059 6.798 -16.696 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -1.244 8.750 -14.877 1.00 0.00 H new ATOM 0 HH22 ARG A 33 0.009 8.749 -16.122 1.00 0.00 H new ATOM 414 N GLN A 34 1.380 3.875 -12.301 1.00 0.00 N ATOM 415 CA GLN A 34 2.598 4.381 -12.917 1.00 0.00 C ATOM 416 C GLN A 34 3.811 3.606 -12.412 1.00 0.00 C ATOM 417 O GLN A 34 4.857 3.574 -13.061 1.00 0.00 O ATOM 418 CB GLN A 34 2.765 5.871 -12.614 1.00 0.00 C ATOM 419 CG GLN A 34 3.988 6.492 -13.273 1.00 0.00 C ATOM 420 CD GLN A 34 3.625 7.454 -14.387 1.00 0.00 C ATOM 421 OE1 GLN A 34 3.732 8.671 -14.232 1.00 0.00 O ATOM 422 NE2 GLN A 34 3.194 6.913 -15.520 1.00 0.00 N ATOM 0 H GLN A 34 1.013 4.461 -11.551 1.00 0.00 H new ATOM 0 HA GLN A 34 2.521 4.247 -13.996 1.00 0.00 H new ATOM 0 HB2 GLN A 34 1.874 6.403 -12.946 1.00 0.00 H new ATOM 0 HB3 GLN A 34 2.835 6.008 -11.535 1.00 0.00 H new ATOM 0 HG2 GLN A 34 4.574 7.019 -12.520 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.621 5.701 -13.674 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.121 5.899 -15.606 1.00 0.00 H new ATOM 0 HE22 GLN A 34 2.936 7.511 -16.305 1.00 0.00 H new ATOM 431 N LEU A 35 3.661 2.981 -11.247 1.00 0.00 N ATOM 432 CA LEU A 35 4.737 2.207 -10.646 1.00 0.00 C ATOM 433 C LEU A 35 4.776 0.791 -11.213 1.00 0.00 C ATOM 434 O LEU A 35 5.846 0.254 -11.499 1.00 0.00 O ATOM 435 CB LEU A 35 4.556 2.153 -9.129 1.00 0.00 C ATOM 436 CG LEU A 35 5.007 3.404 -8.375 1.00 0.00 C ATOM 437 CD1 LEU A 35 4.856 3.208 -6.876 1.00 0.00 C ATOM 438 CD2 LEU A 35 6.445 3.747 -8.727 1.00 0.00 C ATOM 0 H LEU A 35 2.800 2.997 -10.701 1.00 0.00 H new ATOM 0 HA LEU A 35 5.682 2.697 -10.882 1.00 0.00 H new ATOM 0 HB2 LEU A 35 3.503 1.977 -8.911 1.00 0.00 H new ATOM 0 HB3 LEU A 35 5.109 1.297 -8.743 1.00 0.00 H new ATOM 0 HG LEU A 35 4.371 4.236 -8.677 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.182 4.109 -6.357 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.811 3.010 -6.638 1.00 0.00 H new ATOM 0 HD13 LEU A 35 5.467 2.364 -6.556 1.00 0.00 H new ATOM 0 HD21 LEU A 35 6.750 4.640 -8.182 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.095 2.915 -8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.523 3.932 -9.798 1.00 0.00 H new ATOM 450 N GLU A 36 3.600 0.189 -11.369 1.00 0.00 N ATOM 451 CA GLU A 36 3.498 -1.168 -11.894 1.00 0.00 C ATOM 452 C GLU A 36 3.924 -1.227 -13.356 1.00 0.00 C ATOM 453 O GLU A 36 4.580 -2.178 -13.783 1.00 0.00 O ATOM 454 CB GLU A 36 2.068 -1.691 -11.745 1.00 0.00 C ATOM 455 CG GLU A 36 1.029 -0.838 -12.455 1.00 0.00 C ATOM 456 CD GLU A 36 0.887 -1.189 -13.923 1.00 0.00 C ATOM 457 OE1 GLU A 36 0.645 -2.376 -14.229 1.00 0.00 O ATOM 458 OE2 GLU A 36 1.021 -0.279 -14.768 1.00 0.00 O ATOM 0 H GLU A 36 2.705 0.620 -11.139 1.00 0.00 H new ATOM 0 HA GLU A 36 4.172 -1.801 -11.316 1.00 0.00 H new ATOM 0 HB2 GLU A 36 2.020 -2.707 -12.136 1.00 0.00 H new ATOM 0 HB3 GLU A 36 1.819 -1.745 -10.685 1.00 0.00 H new ATOM 0 HG2 GLU A 36 0.065 -0.961 -11.961 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.303 0.213 -12.362 1.00 0.00 H new ATOM 465 N GLN A 37 3.547 -0.211 -14.121 1.00 0.00 N ATOM 466 CA GLN A 37 3.891 -0.150 -15.533 1.00 0.00 C ATOM 467 C GLN A 37 5.402 -0.183 -15.730 1.00 0.00 C ATOM 468 O GLN A 37 5.897 -0.707 -16.727 1.00 0.00 O ATOM 469 CB GLN A 37 3.310 1.119 -16.150 1.00 0.00 C ATOM 470 CG GLN A 37 3.777 2.393 -15.466 1.00 0.00 C ATOM 471 CD GLN A 37 3.636 3.616 -16.351 1.00 0.00 C ATOM 472 OE1 GLN A 37 4.605 4.334 -16.596 1.00 0.00 O ATOM 473 NE2 GLN A 37 2.424 3.859 -16.835 1.00 0.00 N ATOM 0 H GLN A 37 3.002 0.583 -13.785 1.00 0.00 H new ATOM 0 HA GLN A 37 3.466 -1.022 -16.030 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.585 1.160 -17.204 1.00 0.00 H new ATOM 0 HB3 GLN A 37 2.222 1.070 -16.106 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.202 2.542 -14.552 1.00 0.00 H new ATOM 0 HG3 GLN A 37 4.820 2.281 -15.171 1.00 0.00 H new ATOM 0 HE21 GLN A 37 1.649 3.237 -16.606 1.00 0.00 H new ATOM 0 HE22 GLN A 37 2.268 4.668 -17.436 1.00 0.00 H new ATOM 555 N LEU A 42 6.089 -5.768 -10.996 1.00 0.00 N ATOM 556 CA LEU A 42 5.339 -5.262 -9.853 1.00 0.00 C ATOM 557 C LEU A 42 3.839 -5.435 -10.070 1.00 0.00 C ATOM 558 O LEU A 42 3.264 -4.856 -10.991 1.00 0.00 O ATOM 559 CB LEU A 42 5.665 -3.787 -9.614 1.00 0.00 C ATOM 560 CG LEU A 42 5.269 -3.252 -8.237 1.00 0.00 C ATOM 561 CD1 LEU A 42 6.465 -3.265 -7.297 1.00 0.00 C ATOM 562 CD2 LEU A 42 4.688 -1.848 -8.353 1.00 0.00 C ATOM 0 HA LEU A 42 5.631 -5.837 -8.974 1.00 0.00 H new ATOM 0 HB2 LEU A 42 6.737 -3.641 -9.749 1.00 0.00 H new ATOM 0 HB3 LEU A 42 5.163 -3.191 -10.377 1.00 0.00 H new ATOM 0 HG LEU A 42 4.500 -3.904 -7.822 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.165 -2.881 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.831 -4.286 -7.188 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.256 -2.637 -7.706 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.413 -1.485 -7.363 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.432 -1.181 -8.790 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.804 -1.872 -8.990 1.00 0.00 H new ATOM 574 N LYS A 43 3.212 -6.236 -9.214 1.00 0.00 N ATOM 575 CA LYS A 43 1.779 -6.488 -9.313 1.00 0.00 C ATOM 576 C LYS A 43 1.053 -6.005 -8.063 1.00 0.00 C ATOM 577 O LYS A 43 0.983 -6.713 -7.057 1.00 0.00 O ATOM 578 CB LYS A 43 1.518 -7.980 -9.528 1.00 0.00 C ATOM 579 CG LYS A 43 2.096 -8.515 -10.828 1.00 0.00 C ATOM 580 CD LYS A 43 1.355 -7.966 -12.038 1.00 0.00 C ATOM 581 CE LYS A 43 2.277 -7.167 -12.948 1.00 0.00 C ATOM 582 NZ LYS A 43 1.758 -7.098 -14.341 1.00 0.00 N ATOM 0 H LYS A 43 3.674 -6.721 -8.445 1.00 0.00 H new ATOM 0 HA LYS A 43 1.395 -5.932 -10.168 1.00 0.00 H new ATOM 0 HB2 LYS A 43 1.942 -8.539 -8.694 1.00 0.00 H new ATOM 0 HB3 LYS A 43 0.443 -8.158 -9.517 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.151 -8.248 -10.895 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.042 -9.604 -10.830 1.00 0.00 H new ATOM 0 HD2 LYS A 43 0.914 -8.790 -12.599 1.00 0.00 H new ATOM 0 HD3 LYS A 43 0.534 -7.332 -11.705 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.392 -6.158 -12.553 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.267 -7.622 -12.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 2.079 -6.216 -14.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 2.113 -7.911 -14.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 0.718 -7.120 -14.326 1.00 0.00 H new ATOM 596 N LEU A 44 0.508 -4.796 -8.134 1.00 0.00 N ATOM 597 CA LEU A 44 -0.218 -4.218 -7.010 1.00 0.00 C ATOM 598 C LEU A 44 -1.715 -4.469 -7.155 1.00 0.00 C ATOM 599 O LEU A 44 -2.209 -4.706 -8.258 1.00 0.00 O ATOM 600 CB LEU A 44 0.066 -2.718 -6.909 1.00 0.00 C ATOM 601 CG LEU A 44 1.291 -2.357 -6.066 1.00 0.00 C ATOM 602 CD1 LEU A 44 1.627 -0.881 -6.204 1.00 0.00 C ATOM 603 CD2 LEU A 44 1.050 -2.717 -4.610 1.00 0.00 C ATOM 0 H LEU A 44 0.555 -4.197 -8.958 1.00 0.00 H new ATOM 0 HA LEU A 44 0.124 -4.698 -6.093 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.203 -2.319 -7.914 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.808 -2.224 -6.486 1.00 0.00 H new ATOM 0 HG LEU A 44 2.142 -2.931 -6.431 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.501 -0.648 -5.596 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.840 -0.652 -7.248 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.781 -0.282 -5.867 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.929 -2.455 -4.020 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.186 -2.167 -4.237 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.862 -3.787 -4.526 1.00 0.00 H new ATOM 615 N CYS A 45 -2.432 -4.431 -6.037 1.00 0.00 N ATOM 616 CA CYS A 45 -3.871 -4.670 -6.049 1.00 0.00 C ATOM 617 C CYS A 45 -4.621 -3.598 -5.267 1.00 0.00 C ATOM 618 O CYS A 45 -4.020 -2.813 -4.535 1.00 0.00 O ATOM 619 CB CYS A 45 -4.174 -6.047 -5.462 1.00 0.00 C ATOM 620 SG CYS A 45 -3.483 -7.433 -6.420 1.00 0.00 S ATOM 0 H CYS A 45 -2.042 -4.238 -5.114 1.00 0.00 H new ATOM 0 HA CYS A 45 -4.209 -4.631 -7.084 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -3.782 -6.091 -4.446 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -5.255 -6.171 -5.393 1.00 0.00 H new ATOM 0 HG CYS A 45 -3.496 -7.135 -7.685 1.00 0.00 H new ATOM 625 N VAL A 46 -5.941 -3.576 -5.424 1.00 0.00 N ATOM 626 CA VAL A 46 -6.777 -2.603 -4.730 1.00 0.00 C ATOM 627 C VAL A 46 -8.068 -3.246 -4.229 1.00 0.00 C ATOM 628 O VAL A 46 -8.262 -4.454 -4.359 1.00 0.00 O ATOM 629 CB VAL A 46 -7.121 -1.402 -5.633 1.00 0.00 C ATOM 630 CG1 VAL A 46 -5.851 -0.724 -6.122 1.00 0.00 C ATOM 631 CG2 VAL A 46 -7.986 -1.837 -6.808 1.00 0.00 C ATOM 0 H VAL A 46 -6.454 -4.220 -6.025 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.201 -2.244 -3.877 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.690 -0.683 -5.044 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.112 0.122 -6.758 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -5.275 -0.371 -5.267 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.255 -1.436 -6.692 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -8.216 -0.972 -7.431 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -7.449 -2.578 -7.400 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.913 -2.272 -6.436 1.00 0.00 H new ATOM 641 N SER A 47 -8.950 -2.429 -3.660 1.00 0.00 N ATOM 642 CA SER A 47 -10.223 -2.918 -3.145 1.00 0.00 C ATOM 643 C SER A 47 -11.369 -2.531 -4.072 1.00 0.00 C ATOM 644 O SER A 47 -11.514 -1.367 -4.444 1.00 0.00 O ATOM 645 CB SER A 47 -10.477 -2.362 -1.741 1.00 0.00 C ATOM 646 OG SER A 47 -11.116 -3.324 -0.919 1.00 0.00 O ATOM 0 H SER A 47 -8.806 -1.426 -3.544 1.00 0.00 H new ATOM 0 HA SER A 47 -10.172 -4.006 -3.094 1.00 0.00 H new ATOM 0 HB2 SER A 47 -9.532 -2.063 -1.288 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.096 -1.467 -1.807 1.00 0.00 H new ATOM 0 HG SER A 47 -10.527 -4.099 -0.804 1.00 0.00 H new ATOM 781 N VAL A 57 -7.965 -1.060 -14.509 1.00 0.00 N ATOM 782 CA VAL A 57 -7.040 -0.998 -13.383 1.00 0.00 C ATOM 783 C VAL A 57 -6.788 -2.384 -12.797 1.00 0.00 C ATOM 784 O VAL A 57 -7.428 -3.360 -13.188 1.00 0.00 O ATOM 785 CB VAL A 57 -7.570 -0.073 -12.272 1.00 0.00 C ATOM 786 CG1 VAL A 57 -7.492 1.383 -12.706 1.00 0.00 C ATOM 787 CG2 VAL A 57 -8.996 -0.449 -11.899 1.00 0.00 C ATOM 0 HA VAL A 57 -6.103 -0.595 -13.767 1.00 0.00 H new ATOM 0 HB VAL A 57 -6.942 -0.199 -11.390 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.871 2.021 -11.908 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -6.455 1.644 -12.918 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.094 1.528 -13.603 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.354 0.216 -11.112 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.638 -0.354 -12.774 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.019 -1.479 -11.542 1.00 0.00 H new ATOM 797 N TRP A 58 -5.855 -2.459 -11.856 1.00 0.00 N ATOM 798 CA TRP A 58 -5.515 -3.716 -11.212 1.00 0.00 C ATOM 799 C TRP A 58 -6.186 -3.810 -9.844 1.00 0.00 C ATOM 800 O TRP A 58 -5.899 -3.014 -8.950 1.00 0.00 O ATOM 801 CB TRP A 58 -3.998 -3.821 -11.058 1.00 0.00 C ATOM 802 CG TRP A 58 -3.498 -5.229 -11.034 1.00 0.00 C ATOM 803 CD1 TRP A 58 -3.705 -6.144 -10.050 1.00 0.00 C ATOM 804 CD2 TRP A 58 -2.710 -5.879 -12.036 1.00 0.00 C ATOM 805 NE1 TRP A 58 -3.088 -7.330 -10.372 1.00 0.00 N ATOM 806 CE2 TRP A 58 -2.472 -7.192 -11.589 1.00 0.00 C ATOM 807 CE3 TRP A 58 -2.181 -5.481 -13.267 1.00 0.00 C ATOM 808 CZ2 TRP A 58 -1.730 -8.108 -12.330 1.00 0.00 C ATOM 809 CZ3 TRP A 58 -1.444 -6.391 -14.002 1.00 0.00 C ATOM 810 CH2 TRP A 58 -1.224 -7.691 -13.531 1.00 0.00 C ATOM 0 H TRP A 58 -5.319 -1.658 -11.522 1.00 0.00 H new ATOM 0 HA TRP A 58 -5.872 -4.539 -11.832 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -3.519 -3.288 -11.879 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -3.699 -3.322 -10.136 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -4.271 -5.966 -9.148 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -3.089 -8.174 -9.799 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -2.345 -4.480 -13.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -1.560 -9.112 -11.970 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -1.031 -6.094 -14.955 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -0.643 -8.379 -14.128 1.00 0.00 H new ATOM 821 N SER A 59 -7.083 -4.778 -9.690 1.00 0.00 N ATOM 822 CA SER A 59 -7.796 -4.959 -8.429 1.00 0.00 C ATOM 823 C SER A 59 -7.793 -6.420 -7.994 1.00 0.00 C ATOM 824 O SER A 59 -7.483 -7.314 -8.779 1.00 0.00 O ATOM 825 CB SER A 59 -9.235 -4.458 -8.559 1.00 0.00 C ATOM 826 OG SER A 59 -9.355 -3.511 -9.605 1.00 0.00 O ATOM 0 H SER A 59 -7.333 -5.447 -10.418 1.00 0.00 H new ATOM 0 HA SER A 59 -7.278 -4.377 -7.667 1.00 0.00 H new ATOM 0 HB2 SER A 59 -9.900 -5.300 -8.749 1.00 0.00 H new ATOM 0 HB3 SER A 59 -9.552 -4.007 -7.619 1.00 0.00 H new ATOM 0 HG SER A 59 -10.285 -3.209 -9.667 1.00 0.00 H new ATOM 832 N ILE A 60 -8.146 -6.652 -6.731 1.00 0.00 N ATOM 833 CA ILE A 60 -8.189 -8.000 -6.184 1.00 0.00 C ATOM 834 C ILE A 60 -9.089 -8.067 -4.951 1.00 0.00 C ATOM 835 O ILE A 60 -9.238 -7.081 -4.227 1.00 0.00 O ATOM 836 CB ILE A 60 -6.777 -8.504 -5.804 1.00 0.00 C ATOM 837 CG1 ILE A 60 -6.701 -10.028 -5.943 1.00 0.00 C ATOM 838 CG2 ILE A 60 -6.408 -8.071 -4.387 1.00 0.00 C ATOM 839 CD1 ILE A 60 -5.576 -10.662 -5.149 1.00 0.00 C ATOM 0 H ILE A 60 -8.406 -5.921 -6.069 1.00 0.00 H new ATOM 0 HA ILE A 60 -8.597 -8.642 -6.965 1.00 0.00 H new ATOM 0 HB ILE A 60 -6.057 -8.058 -6.490 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -7.648 -10.460 -5.621 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -6.577 -10.281 -6.996 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -5.411 -8.437 -4.143 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -6.420 -6.983 -4.324 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -7.129 -8.483 -3.681 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -5.588 -11.742 -5.299 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -4.621 -10.260 -5.486 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -5.709 -10.441 -4.090 1.00 0.00 H new ATOM 851 N ALA A 61 -9.673 -9.233 -4.708 1.00 0.00 N ATOM 852 CA ALA A 61 -10.535 -9.420 -3.550 1.00 0.00 C ATOM 853 C ALA A 61 -9.734 -9.239 -2.264 1.00 0.00 C ATOM 854 O ALA A 61 -8.591 -9.687 -2.169 1.00 0.00 O ATOM 855 CB ALA A 61 -11.184 -10.797 -3.585 1.00 0.00 C ATOM 0 H ALA A 61 -9.566 -10.060 -5.295 1.00 0.00 H new ATOM 0 HA ALA A 61 -11.324 -8.669 -3.578 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -11.825 -10.919 -2.712 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.782 -10.894 -4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.410 -11.564 -3.577 1.00 0.00 H new ATOM 861 N SER A 62 -10.331 -8.574 -1.284 1.00 0.00 N ATOM 862 CA SER A 62 -9.660 -8.327 -0.012 1.00 0.00 C ATOM 863 C SER A 62 -9.361 -9.627 0.733 1.00 0.00 C ATOM 864 O SER A 62 -8.588 -9.635 1.691 1.00 0.00 O ATOM 865 CB SER A 62 -10.510 -7.408 0.866 1.00 0.00 C ATOM 866 OG SER A 62 -10.646 -6.125 0.281 1.00 0.00 O ATOM 0 H SER A 62 -11.277 -8.196 -1.344 1.00 0.00 H new ATOM 0 HA SER A 62 -8.709 -7.841 -0.232 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.495 -7.850 1.013 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.052 -7.315 1.851 1.00 0.00 H new ATOM 0 HG SER A 62 -11.195 -5.557 0.861 1.00 0.00 H new ATOM 872 N GLU A 63 -9.973 -10.723 0.294 1.00 0.00 N ATOM 873 CA GLU A 63 -9.759 -12.017 0.932 1.00 0.00 C ATOM 874 C GLU A 63 -8.534 -12.723 0.356 1.00 0.00 C ATOM 875 O GLU A 63 -8.018 -13.670 0.951 1.00 0.00 O ATOM 876 CB GLU A 63 -10.997 -12.905 0.768 1.00 0.00 C ATOM 877 CG GLU A 63 -11.597 -12.869 -0.629 1.00 0.00 C ATOM 878 CD GLU A 63 -12.375 -14.126 -0.962 1.00 0.00 C ATOM 879 OE1 GLU A 63 -12.030 -15.199 -0.424 1.00 0.00 O ATOM 880 OE2 GLU A 63 -13.332 -14.038 -1.759 1.00 0.00 O ATOM 0 H GLU A 63 -10.617 -10.741 -0.496 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.584 -11.839 1.993 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.730 -13.933 1.012 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.755 -12.593 1.487 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.256 -12.005 -0.715 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.799 -12.736 -1.360 1.00 0.00 H new ATOM 887 N LEU A 64 -8.068 -12.262 -0.803 1.00 0.00 N ATOM 888 CA LEU A 64 -6.910 -12.856 -1.449 1.00 0.00 C ATOM 889 C LEU A 64 -5.629 -12.094 -1.112 1.00 0.00 C ATOM 890 O LEU A 64 -4.547 -12.455 -1.573 1.00 0.00 O ATOM 891 CB LEU A 64 -7.106 -12.885 -2.964 1.00 0.00 C ATOM 892 CG LEU A 64 -8.558 -12.834 -3.442 1.00 0.00 C ATOM 893 CD1 LEU A 64 -8.621 -12.819 -4.963 1.00 0.00 C ATOM 894 CD2 LEU A 64 -9.338 -14.012 -2.885 1.00 0.00 C ATOM 0 H LEU A 64 -8.478 -11.478 -1.311 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.810 -13.875 -1.075 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.569 -12.042 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.645 -13.792 -3.355 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.012 -11.914 -3.074 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.662 -12.783 -5.284 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -8.094 -11.943 -5.340 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.152 -13.721 -5.356 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -10.370 -13.963 -3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -8.884 -14.943 -3.226 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -9.321 -13.977 -1.796 1.00 0.00 H new ATOM 906 N ILE A 65 -5.751 -11.035 -0.315 1.00 0.00 N ATOM 907 CA ILE A 65 -4.595 -10.234 0.060 1.00 0.00 C ATOM 908 C ILE A 65 -3.689 -10.988 1.029 1.00 0.00 C ATOM 909 O ILE A 65 -2.544 -11.304 0.708 1.00 0.00 O ATOM 910 CB ILE A 65 -5.014 -8.900 0.706 1.00 0.00 C ATOM 911 CG1 ILE A 65 -6.088 -8.210 -0.139 1.00 0.00 C ATOM 912 CG2 ILE A 65 -3.804 -7.994 0.876 1.00 0.00 C ATOM 913 CD1 ILE A 65 -6.521 -6.869 0.412 1.00 0.00 C ATOM 0 H ILE A 65 -6.635 -10.715 0.080 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.049 -10.028 -0.861 1.00 0.00 H new ATOM 0 HB ILE A 65 -5.433 -9.106 1.691 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.709 -8.072 -1.152 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.958 -8.863 -0.210 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -4.114 -7.055 1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -3.070 -8.484 1.515 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -3.360 -7.793 -0.099 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.283 -6.438 -0.237 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.930 -7.002 1.414 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.662 -6.200 0.457 1.00 0.00 H new ATOM 925 N GLU A 66 -4.210 -11.268 2.219 1.00 0.00 N ATOM 926 CA GLU A 66 -3.453 -11.977 3.238 1.00 0.00 C ATOM 927 C GLU A 66 -3.072 -13.385 2.781 1.00 0.00 C ATOM 928 O GLU A 66 -2.185 -14.012 3.360 1.00 0.00 O ATOM 929 CB GLU A 66 -4.269 -12.051 4.529 1.00 0.00 C ATOM 930 CG GLU A 66 -5.531 -12.891 4.405 1.00 0.00 C ATOM 931 CD GLU A 66 -6.524 -12.615 5.515 1.00 0.00 C ATOM 932 OE1 GLU A 66 -6.578 -11.461 5.991 1.00 0.00 O ATOM 933 OE2 GLU A 66 -7.251 -13.551 5.907 1.00 0.00 O ATOM 0 H GLU A 66 -5.157 -11.013 2.500 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.530 -11.425 3.416 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -3.644 -12.464 5.321 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -4.543 -11.041 4.834 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.003 -12.692 3.443 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -5.263 -13.947 4.416 1.00 0.00 H new ATOM 940 N LYS A 67 -3.746 -13.878 1.746 1.00 0.00 N ATOM 941 CA LYS A 67 -3.472 -15.214 1.229 1.00 0.00 C ATOM 942 C LYS A 67 -2.539 -15.161 0.021 1.00 0.00 C ATOM 943 O LYS A 67 -1.569 -15.916 -0.056 1.00 0.00 O ATOM 944 CB LYS A 67 -4.778 -15.912 0.847 1.00 0.00 C ATOM 945 CG LYS A 67 -5.785 -15.984 1.983 1.00 0.00 C ATOM 946 CD LYS A 67 -6.161 -17.422 2.308 1.00 0.00 C ATOM 947 CE LYS A 67 -7.168 -17.972 1.310 1.00 0.00 C ATOM 948 NZ LYS A 67 -6.870 -19.384 0.942 1.00 0.00 N ATOM 0 H LYS A 67 -4.482 -13.375 1.251 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.977 -15.782 2.017 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.229 -15.385 0.006 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.554 -16.923 0.507 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -5.368 -15.507 2.870 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -6.681 -15.425 1.712 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -5.266 -18.044 2.304 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.579 -17.472 3.314 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -8.170 -17.911 1.734 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -7.164 -17.354 0.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.579 -19.722 0.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -5.924 -19.439 0.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -6.899 -19.979 1.795 1.00 0.00 H new ATOM 962 N ARG A 68 -2.842 -14.276 -0.923 1.00 0.00 N ATOM 963 CA ARG A 68 -2.030 -14.140 -2.129 1.00 0.00 C ATOM 964 C ARG A 68 -1.005 -13.019 -1.984 1.00 0.00 C ATOM 965 O ARG A 68 0.200 -13.259 -2.048 1.00 0.00 O ATOM 966 CB ARG A 68 -2.923 -13.882 -3.343 1.00 0.00 C ATOM 967 CG ARG A 68 -4.170 -14.752 -3.379 1.00 0.00 C ATOM 968 CD ARG A 68 -4.812 -14.749 -4.757 1.00 0.00 C ATOM 969 NE ARG A 68 -5.785 -15.827 -4.909 1.00 0.00 N ATOM 970 CZ ARG A 68 -6.676 -15.887 -5.897 1.00 0.00 C ATOM 971 NH1 ARG A 68 -6.720 -14.933 -6.819 1.00 0.00 N ATOM 972 NH2 ARG A 68 -7.526 -16.904 -5.963 1.00 0.00 N ATOM 0 H ARG A 68 -3.641 -13.644 -0.878 1.00 0.00 H new ATOM 0 HA ARG A 68 -1.489 -15.075 -2.275 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -3.222 -12.834 -3.347 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -2.345 -14.053 -4.251 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -3.911 -15.773 -3.100 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -4.887 -14.392 -2.641 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -5.303 -13.791 -4.926 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -4.038 -14.849 -5.518 1.00 0.00 H new ATOM 0 HE ARG A 68 -5.782 -16.578 -4.218 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -6.069 -14.149 -6.773 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -7.405 -14.984 -7.573 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -7.497 -17.640 -5.257 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -8.208 -16.950 -6.720 1.00 0.00 H new ATOM 986 N CYS A 69 -1.488 -11.794 -1.789 1.00 0.00 N ATOM 987 CA CYS A 69 -0.602 -10.642 -1.638 1.00 0.00 C ATOM 988 C CYS A 69 0.386 -10.863 -0.497 1.00 0.00 C ATOM 989 O CYS A 69 0.036 -11.432 0.536 1.00 0.00 O ATOM 990 CB CYS A 69 -1.416 -9.371 -1.386 1.00 0.00 C ATOM 991 SG CYS A 69 -2.335 -8.783 -2.828 1.00 0.00 S ATOM 0 H CYS A 69 -2.482 -11.574 -1.732 1.00 0.00 H new ATOM 0 HA CYS A 69 -0.040 -10.524 -2.565 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -2.118 -9.557 -0.573 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -0.743 -8.582 -1.051 1.00 0.00 H new ATOM 0 HG CYS A 69 -3.414 -8.174 -2.436 1.00 0.00 H new ATOM 997 N ARG A 70 1.623 -10.417 -0.694 1.00 0.00 N ATOM 998 CA ARG A 70 2.660 -10.578 0.318 1.00 0.00 C ATOM 999 C ARG A 70 2.826 -9.304 1.145 1.00 0.00 C ATOM 1000 O ARG A 70 2.908 -9.361 2.372 1.00 0.00 O ATOM 1001 CB ARG A 70 3.988 -10.955 -0.340 1.00 0.00 C ATOM 1002 CG ARG A 70 4.504 -12.326 0.076 1.00 0.00 C ATOM 1003 CD ARG A 70 5.740 -12.214 0.956 1.00 0.00 C ATOM 1004 NE ARG A 70 5.913 -13.388 1.809 1.00 0.00 N ATOM 1005 CZ ARG A 70 6.445 -14.534 1.393 1.00 0.00 C ATOM 1006 NH1 ARG A 70 6.853 -14.670 0.137 1.00 0.00 N ATOM 1007 NH2 ARG A 70 6.570 -15.552 2.234 1.00 0.00 N ATOM 0 H ARG A 70 1.931 -9.943 -1.543 1.00 0.00 H new ATOM 0 HA ARG A 70 2.354 -11.381 0.989 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.867 -10.934 -1.423 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.736 -10.203 -0.089 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.722 -12.863 0.613 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.741 -12.912 -0.812 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.622 -12.089 0.328 1.00 0.00 H new ATOM 0 HD3 ARG A 70 5.663 -11.322 1.578 1.00 0.00 H new ATOM 0 HE ARG A 70 5.608 -13.325 2.780 1.00 0.00 H new ATOM 0 HH11 ARG A 70 6.760 -13.893 -0.517 1.00 0.00 H new ATOM 0 HH12 ARG A 70 7.260 -15.552 -0.174 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.258 -15.456 3.200 1.00 0.00 H new ATOM 0 HH22 ARG A 70 6.978 -16.430 1.914 1.00 0.00 H new ATOM 1021 N ARG A 71 2.882 -8.160 0.470 1.00 0.00 N ATOM 1022 CA ARG A 71 3.049 -6.881 1.158 1.00 0.00 C ATOM 1023 C ARG A 71 1.843 -5.969 0.941 1.00 0.00 C ATOM 1024 O ARG A 71 1.021 -6.202 0.052 1.00 0.00 O ATOM 1025 CB ARG A 71 4.325 -6.180 0.685 1.00 0.00 C ATOM 1026 CG ARG A 71 4.614 -6.368 -0.794 1.00 0.00 C ATOM 1027 CD ARG A 71 5.585 -7.513 -1.030 1.00 0.00 C ATOM 1028 NE ARG A 71 6.838 -7.328 -0.301 1.00 0.00 N ATOM 1029 CZ ARG A 71 7.745 -8.286 -0.131 1.00 0.00 C ATOM 1030 NH1 ARG A 71 7.546 -9.496 -0.638 1.00 0.00 N ATOM 1031 NH2 ARG A 71 8.857 -8.033 0.546 1.00 0.00 N ATOM 0 H ARG A 71 2.815 -8.090 -0.545 1.00 0.00 H new ATOM 0 HA ARG A 71 3.130 -7.089 2.225 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.243 -5.114 0.897 1.00 0.00 H new ATOM 0 HB3 ARG A 71 5.170 -6.556 1.262 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.683 -6.564 -1.326 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.028 -5.447 -1.205 1.00 0.00 H new ATOM 0 HD2 ARG A 71 5.122 -8.450 -0.722 1.00 0.00 H new ATOM 0 HD3 ARG A 71 5.795 -7.596 -2.096 1.00 0.00 H new ATOM 0 HE ARG A 71 7.028 -6.410 0.101 1.00 0.00 H new ATOM 0 HH11 ARG A 71 6.694 -9.696 -1.162 1.00 0.00 H new ATOM 0 HH12 ARG A 71 8.245 -10.226 -0.504 1.00 0.00 H new ATOM 0 HH21 ARG A 71 9.016 -7.104 0.936 1.00 0.00 H new ATOM 0 HH22 ARG A 71 9.553 -8.767 0.677 1.00 0.00 H new ATOM 1045 N MET A 72 1.745 -4.934 1.763 1.00 0.00 N ATOM 1046 CA MET A 72 0.645 -3.984 1.676 1.00 0.00 C ATOM 1047 C MET A 72 1.166 -2.559 1.505 1.00 0.00 C ATOM 1048 O MET A 72 2.271 -2.232 1.939 1.00 0.00 O ATOM 1049 CB MET A 72 -0.224 -4.077 2.930 1.00 0.00 C ATOM 1050 CG MET A 72 -1.445 -4.965 2.758 1.00 0.00 C ATOM 1051 SD MET A 72 -2.010 -5.679 4.315 1.00 0.00 S ATOM 1052 CE MET A 72 -2.149 -7.408 3.865 1.00 0.00 C ATOM 0 H MET A 72 2.418 -4.730 2.502 1.00 0.00 H new ATOM 0 HA MET A 72 0.044 -4.234 0.802 1.00 0.00 H new ATOM 0 HB2 MET A 72 0.380 -4.459 3.753 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.550 -3.076 3.212 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.253 -4.383 2.315 1.00 0.00 H new ATOM 0 HG3 MET A 72 -1.210 -5.768 2.059 1.00 0.00 H new ATOM 0 HE1 MET A 72 -1.823 -8.029 4.700 1.00 0.00 H new ATOM 0 HE2 MET A 72 -3.187 -7.639 3.625 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.522 -7.609 2.996 1.00 0.00 H new ATOM 1062 N VAL A 73 0.356 -1.715 0.879 1.00 0.00 N ATOM 1063 CA VAL A 73 0.723 -0.325 0.658 1.00 0.00 C ATOM 1064 C VAL A 73 -0.383 0.593 1.155 1.00 0.00 C ATOM 1065 O VAL A 73 -1.356 0.852 0.446 1.00 0.00 O ATOM 1066 CB VAL A 73 0.990 -0.038 -0.832 1.00 0.00 C ATOM 1067 CG1 VAL A 73 1.537 1.370 -1.014 1.00 0.00 C ATOM 1068 CG2 VAL A 73 1.948 -1.068 -1.410 1.00 0.00 C ATOM 0 H VAL A 73 -0.562 -1.971 0.515 1.00 0.00 H new ATOM 0 HA VAL A 73 1.641 -0.136 1.214 1.00 0.00 H new ATOM 0 HB VAL A 73 0.046 -0.110 -1.373 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.720 1.555 -2.072 1.00 0.00 H new ATOM 0 HG12 VAL A 73 0.813 2.093 -0.639 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.471 1.472 -0.461 1.00 0.00 H new ATOM 0 HG21 VAL A 73 2.125 -0.850 -2.463 1.00 0.00 H new ATOM 0 HG22 VAL A 73 2.893 -1.031 -0.868 1.00 0.00 H new ATOM 0 HG23 VAL A 73 1.514 -2.063 -1.314 1.00 0.00 H new ATOM 1078 N VAL A 74 -0.234 1.072 2.382 1.00 0.00 N ATOM 1079 CA VAL A 74 -1.229 1.949 2.981 1.00 0.00 C ATOM 1080 C VAL A 74 -0.904 3.412 2.716 1.00 0.00 C ATOM 1081 O VAL A 74 0.258 3.811 2.729 1.00 0.00 O ATOM 1082 CB VAL A 74 -1.334 1.725 4.503 1.00 0.00 C ATOM 1083 CG1 VAL A 74 -2.630 2.313 5.040 1.00 0.00 C ATOM 1084 CG2 VAL A 74 -1.236 0.243 4.836 1.00 0.00 C ATOM 0 H VAL A 74 0.566 0.868 2.981 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.185 1.703 2.518 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.500 2.237 4.984 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.687 2.146 6.116 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.655 3.384 4.837 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.478 1.831 4.552 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.312 0.107 5.915 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.046 -0.295 4.344 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -0.279 -0.146 4.488 1.00 0.00 H new ATOM 1094 N VAL A 75 -1.939 4.207 2.477 1.00 0.00 N ATOM 1095 CA VAL A 75 -1.761 5.629 2.216 1.00 0.00 C ATOM 1096 C VAL A 75 -2.467 6.465 3.281 1.00 0.00 C ATOM 1097 O VAL A 75 -3.672 6.701 3.199 1.00 0.00 O ATOM 1098 CB VAL A 75 -2.285 6.009 0.816 1.00 0.00 C ATOM 1099 CG1 VAL A 75 -2.217 7.515 0.599 1.00 0.00 C ATOM 1100 CG2 VAL A 75 -1.501 5.276 -0.262 1.00 0.00 C ATOM 0 H VAL A 75 -2.909 3.892 2.459 1.00 0.00 H new ATOM 0 HA VAL A 75 -0.692 5.840 2.252 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.330 5.706 0.750 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -2.592 7.757 -0.395 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -2.827 8.019 1.349 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -1.183 7.849 0.688 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.884 5.555 -1.244 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.447 5.546 -0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.610 4.200 -0.123 1.00 0.00 H new ATOM 1110 N VAL A 76 -1.709 6.904 4.283 1.00 0.00 N ATOM 1111 CA VAL A 76 -2.266 7.706 5.368 1.00 0.00 C ATOM 1112 C VAL A 76 -2.308 9.188 5.002 1.00 0.00 C ATOM 1113 O VAL A 76 -1.299 9.887 5.077 1.00 0.00 O ATOM 1114 CB VAL A 76 -1.455 7.526 6.669 1.00 0.00 C ATOM 1115 CG1 VAL A 76 -0.010 7.963 6.471 1.00 0.00 C ATOM 1116 CG2 VAL A 76 -2.100 8.291 7.817 1.00 0.00 C ATOM 0 H VAL A 76 -0.709 6.718 4.366 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.285 7.353 5.530 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.455 6.467 6.925 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.542 7.827 7.401 1.00 0.00 H new ATOM 0 HG12 VAL A 76 0.448 7.361 5.686 1.00 0.00 H new ATOM 0 HG13 VAL A 76 0.016 9.014 6.184 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -1.512 8.150 8.724 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.139 9.352 7.571 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.112 7.919 7.979 1.00 0.00 H new ATOM 1126 N SER A 77 -3.487 9.660 4.613 1.00 0.00 N ATOM 1127 CA SER A 77 -3.665 11.058 4.240 1.00 0.00 C ATOM 1128 C SER A 77 -4.854 11.670 4.973 1.00 0.00 C ATOM 1129 O SER A 77 -5.808 10.974 5.314 1.00 0.00 O ATOM 1130 CB SER A 77 -3.861 11.186 2.729 1.00 0.00 C ATOM 1131 OG SER A 77 -4.002 12.544 2.346 1.00 0.00 O ATOM 0 H SER A 77 -4.334 9.095 4.548 1.00 0.00 H new ATOM 0 HA SER A 77 -2.765 11.601 4.528 1.00 0.00 H new ATOM 0 HB2 SER A 77 -3.010 10.745 2.210 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.745 10.625 2.425 1.00 0.00 H new ATOM 0 HG SER A 77 -3.762 12.644 1.401 1.00 0.00 H new ATOM 1137 N ASP A 78 -4.788 12.978 5.209 1.00 0.00 N ATOM 1138 CA ASP A 78 -5.858 13.699 5.901 1.00 0.00 C ATOM 1139 C ASP A 78 -7.241 13.257 5.421 1.00 0.00 C ATOM 1140 O ASP A 78 -8.088 12.850 6.214 1.00 0.00 O ATOM 1141 CB ASP A 78 -5.699 15.204 5.675 1.00 0.00 C ATOM 1142 CG ASP A 78 -5.451 15.958 6.963 1.00 0.00 C ATOM 1143 OD1 ASP A 78 -4.581 15.523 7.744 1.00 0.00 O ATOM 1144 OD2 ASP A 78 -6.125 16.983 7.191 1.00 0.00 O ATOM 0 H ASP A 78 -4.001 13.564 4.930 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.779 13.469 6.964 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.870 15.380 4.989 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.597 15.594 5.196 1.00 0.00 H new ATOM 1149 N ASP A 79 -7.457 13.358 4.115 1.00 0.00 N ATOM 1150 CA ASP A 79 -8.733 12.989 3.508 1.00 0.00 C ATOM 1151 C ASP A 79 -9.107 11.534 3.800 1.00 0.00 C ATOM 1152 O ASP A 79 -10.265 11.146 3.654 1.00 0.00 O ATOM 1153 CB ASP A 79 -8.681 13.215 1.997 1.00 0.00 C ATOM 1154 CG ASP A 79 -9.058 14.632 1.611 1.00 0.00 C ATOM 1155 OD1 ASP A 79 -8.442 15.577 2.146 1.00 0.00 O ATOM 1156 OD2 ASP A 79 -9.970 14.795 0.773 1.00 0.00 O ATOM 0 H ASP A 79 -6.760 13.695 3.451 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.500 13.625 3.950 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -7.676 12.998 1.634 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.356 12.515 1.504 1.00 0.00 H new ATOM 1161 N TYR A 80 -8.128 10.732 4.207 1.00 0.00 N ATOM 1162 CA TYR A 80 -8.370 9.327 4.509 1.00 0.00 C ATOM 1163 C TYR A 80 -8.695 9.144 5.985 1.00 0.00 C ATOM 1164 O TYR A 80 -9.481 8.271 6.355 1.00 0.00 O ATOM 1165 CB TYR A 80 -7.146 8.487 4.127 1.00 0.00 C ATOM 1166 CG TYR A 80 -7.213 7.047 4.591 1.00 0.00 C ATOM 1167 CD1 TYR A 80 -8.428 6.377 4.668 1.00 0.00 C ATOM 1168 CD2 TYR A 80 -6.062 6.360 4.953 1.00 0.00 C ATOM 1169 CE1 TYR A 80 -8.493 5.063 5.091 1.00 0.00 C ATOM 1170 CE2 TYR A 80 -6.119 5.046 5.377 1.00 0.00 C ATOM 1171 CZ TYR A 80 -7.336 4.402 5.444 1.00 0.00 C ATOM 1172 OH TYR A 80 -7.397 3.095 5.866 1.00 0.00 O ATOM 0 H TYR A 80 -7.161 11.031 4.335 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.226 8.990 3.924 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -7.032 8.503 3.043 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -6.254 8.952 4.548 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.337 6.892 4.393 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -5.106 6.861 4.902 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -9.445 4.557 5.145 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -5.214 4.526 5.655 1.00 0.00 H new ATOM 0 HH TYR A 80 -6.490 2.727 5.924 1.00 0.00 H new ATOM 1182 N LEU A 81 -8.084 9.969 6.825 1.00 0.00 N ATOM 1183 CA LEU A 81 -8.299 9.900 8.256 1.00 0.00 C ATOM 1184 C LEU A 81 -9.617 10.557 8.642 1.00 0.00 C ATOM 1185 O LEU A 81 -10.276 10.139 9.593 1.00 0.00 O ATOM 1186 CB LEU A 81 -7.141 10.570 8.982 1.00 0.00 C ATOM 1187 CG LEU A 81 -5.790 9.896 8.779 1.00 0.00 C ATOM 1188 CD1 LEU A 81 -4.648 10.870 9.018 1.00 0.00 C ATOM 1189 CD2 LEU A 81 -5.671 8.705 9.698 1.00 0.00 C ATOM 0 H LEU A 81 -7.432 10.697 6.533 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.349 8.851 8.549 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.070 11.605 8.648 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.364 10.594 10.049 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.725 9.558 7.745 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.697 10.360 8.866 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.729 11.704 8.320 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.698 11.246 10.040 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.703 8.226 9.549 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.758 9.034 10.733 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.466 7.993 9.476 1.00 0.00 H new ATOM 1201 N GLN A 82 -9.998 11.585 7.894 1.00 0.00 N ATOM 1202 CA GLN A 82 -11.237 12.293 8.155 1.00 0.00 C ATOM 1203 C GLN A 82 -12.437 11.357 8.026 1.00 0.00 C ATOM 1204 O GLN A 82 -13.527 11.660 8.513 1.00 0.00 O ATOM 1205 CB GLN A 82 -11.378 13.471 7.191 1.00 0.00 C ATOM 1206 CG GLN A 82 -11.599 13.059 5.742 1.00 0.00 C ATOM 1207 CD GLN A 82 -12.260 14.149 4.923 1.00 0.00 C ATOM 1208 OE1 GLN A 82 -13.014 14.967 5.450 1.00 0.00 O ATOM 1209 NE2 GLN A 82 -11.982 14.165 3.624 1.00 0.00 N ATOM 0 H GLN A 82 -9.464 11.944 7.103 1.00 0.00 H new ATOM 0 HA GLN A 82 -11.210 12.670 9.177 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -12.213 14.093 7.513 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -10.480 14.086 7.251 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -10.641 12.801 5.291 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -12.217 12.162 5.713 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -11.351 13.468 3.229 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -12.399 14.875 3.022 1.00 0.00 H new ATOM 1218 N SER A 83 -12.232 10.217 7.366 1.00 0.00 N ATOM 1219 CA SER A 83 -13.301 9.245 7.175 1.00 0.00 C ATOM 1220 C SER A 83 -13.144 8.061 8.125 1.00 0.00 C ATOM 1221 O SER A 83 -12.041 7.760 8.583 1.00 0.00 O ATOM 1222 CB SER A 83 -13.317 8.753 5.727 1.00 0.00 C ATOM 1223 OG SER A 83 -14.155 9.564 4.922 1.00 0.00 O ATOM 0 H SER A 83 -11.337 9.947 6.957 1.00 0.00 H new ATOM 0 HA SER A 83 -14.247 9.738 7.396 1.00 0.00 H new ATOM 0 HB2 SER A 83 -12.304 8.761 5.326 1.00 0.00 H new ATOM 0 HB3 SER A 83 -13.665 7.720 5.694 1.00 0.00 H new ATOM 0 HG SER A 83 -14.147 9.230 4.001 1.00 0.00 H new ATOM 1229 N LYS A 84 -14.255 7.392 8.414 1.00 0.00 N ATOM 1230 CA LYS A 84 -14.249 6.241 9.305 1.00 0.00 C ATOM 1231 C LYS A 84 -13.636 5.023 8.622 1.00 0.00 C ATOM 1232 O LYS A 84 -13.170 4.097 9.288 1.00 0.00 O ATOM 1233 CB LYS A 84 -15.675 5.928 9.752 1.00 0.00 C ATOM 1234 CG LYS A 84 -16.295 7.015 10.615 1.00 0.00 C ATOM 1235 CD LYS A 84 -17.079 8.015 9.776 1.00 0.00 C ATOM 1236 CE LYS A 84 -16.563 9.433 9.970 1.00 0.00 C ATOM 1237 NZ LYS A 84 -17.430 10.436 9.291 1.00 0.00 N ATOM 0 H LYS A 84 -15.174 7.630 8.041 1.00 0.00 H new ATOM 0 HA LYS A 84 -13.640 6.483 10.176 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -16.298 5.776 8.871 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -15.675 4.990 10.308 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -16.956 6.562 11.354 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -15.511 7.536 11.165 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -17.008 7.742 8.723 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -18.134 7.971 10.047 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -16.512 9.659 11.035 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -15.548 9.507 9.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -17.045 11.390 9.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -17.458 10.236 8.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -18.393 10.383 9.681 1.00 0.00 H new ATOM 1251 N GLU A 85 -13.634 5.030 7.291 1.00 0.00 N ATOM 1252 CA GLU A 85 -13.071 3.926 6.524 1.00 0.00 C ATOM 1253 C GLU A 85 -11.656 3.613 6.995 1.00 0.00 C ATOM 1254 O GLU A 85 -11.194 2.476 6.900 1.00 0.00 O ATOM 1255 CB GLU A 85 -13.063 4.265 5.032 1.00 0.00 C ATOM 1256 CG GLU A 85 -14.392 4.793 4.520 1.00 0.00 C ATOM 1257 CD GLU A 85 -14.468 4.811 3.007 1.00 0.00 C ATOM 1258 OE1 GLU A 85 -14.660 3.731 2.409 1.00 0.00 O ATOM 1259 OE2 GLU A 85 -14.335 5.904 2.418 1.00 0.00 O ATOM 0 H GLU A 85 -14.016 5.787 6.724 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.694 3.046 6.683 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.289 5.008 4.841 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.794 3.373 4.467 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.200 4.176 4.913 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.548 5.803 4.900 1.00 0.00 H new ATOM 1266 N CYS A 86 -10.977 4.629 7.517 1.00 0.00 N ATOM 1267 CA CYS A 86 -9.623 4.463 8.018 1.00 0.00 C ATOM 1268 C CYS A 86 -9.651 3.781 9.377 1.00 0.00 C ATOM 1269 O CYS A 86 -8.763 2.996 9.709 1.00 0.00 O ATOM 1270 CB CYS A 86 -8.921 5.818 8.128 1.00 0.00 C ATOM 1271 SG CYS A 86 -7.190 5.714 8.637 1.00 0.00 S ATOM 0 H CYS A 86 -11.345 5.576 7.603 1.00 0.00 H new ATOM 0 HA CYS A 86 -9.068 3.840 7.317 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -8.975 6.322 7.163 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -9.462 6.438 8.843 1.00 0.00 H new ATOM 0 HG CYS A 86 -6.450 5.435 7.605 1.00 0.00 H new ATOM 1277 N ASP A 87 -10.685 4.080 10.158 1.00 0.00 N ATOM 1278 CA ASP A 87 -10.832 3.492 11.479 1.00 0.00 C ATOM 1279 C ASP A 87 -10.979 1.980 11.375 1.00 0.00 C ATOM 1280 O ASP A 87 -10.503 1.239 12.235 1.00 0.00 O ATOM 1281 CB ASP A 87 -12.040 4.091 12.202 1.00 0.00 C ATOM 1282 CG ASP A 87 -11.667 5.283 13.062 1.00 0.00 C ATOM 1283 OD1 ASP A 87 -10.525 5.318 13.565 1.00 0.00 O ATOM 1284 OD2 ASP A 87 -12.518 6.181 13.231 1.00 0.00 O ATOM 0 H ASP A 87 -11.431 4.725 9.897 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.935 3.717 12.056 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -12.785 4.396 11.467 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -12.502 3.326 12.826 1.00 0.00 H new ATOM 1289 N PHE A 88 -11.627 1.528 10.308 1.00 0.00 N ATOM 1290 CA PHE A 88 -11.817 0.101 10.084 1.00 0.00 C ATOM 1291 C PHE A 88 -10.515 -0.519 9.596 1.00 0.00 C ATOM 1292 O PHE A 88 -10.084 -1.567 10.082 1.00 0.00 O ATOM 1293 CB PHE A 88 -12.930 -0.134 9.062 1.00 0.00 C ATOM 1294 CG PHE A 88 -13.357 -1.571 8.958 1.00 0.00 C ATOM 1295 CD1 PHE A 88 -14.257 -2.107 9.865 1.00 0.00 C ATOM 1296 CD2 PHE A 88 -12.861 -2.384 7.953 1.00 0.00 C ATOM 1297 CE1 PHE A 88 -14.653 -3.429 9.772 1.00 0.00 C ATOM 1298 CE2 PHE A 88 -13.252 -3.705 7.854 1.00 0.00 C ATOM 1299 CZ PHE A 88 -14.150 -4.228 8.765 1.00 0.00 C ATOM 0 H PHE A 88 -12.028 2.127 9.587 1.00 0.00 H new ATOM 0 HA PHE A 88 -12.107 -0.370 11.023 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -13.793 0.474 9.331 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -12.592 0.208 8.084 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -14.654 -1.485 10.654 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -12.160 -1.980 7.238 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -15.354 -3.835 10.486 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -12.856 -4.328 7.066 1.00 0.00 H new ATOM 0 HZ PHE A 88 -14.458 -5.260 8.689 1.00 0.00 H new ATOM 1309 N GLN A 89 -9.886 0.156 8.642 1.00 0.00 N ATOM 1310 CA GLN A 89 -8.623 -0.301 8.085 1.00 0.00 C ATOM 1311 C GLN A 89 -7.554 -0.345 9.173 1.00 0.00 C ATOM 1312 O GLN A 89 -6.700 -1.227 9.183 1.00 0.00 O ATOM 1313 CB GLN A 89 -8.183 0.624 6.949 1.00 0.00 C ATOM 1314 CG GLN A 89 -7.392 -0.081 5.859 1.00 0.00 C ATOM 1315 CD GLN A 89 -5.920 0.276 5.884 1.00 0.00 C ATOM 1316 OE1 GLN A 89 -5.532 1.382 5.509 1.00 0.00 O ATOM 1317 NE2 GLN A 89 -5.093 -0.663 6.326 1.00 0.00 N ATOM 0 H GLN A 89 -10.233 1.026 8.238 1.00 0.00 H new ATOM 0 HA GLN A 89 -8.758 -1.306 7.686 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -9.065 1.085 6.505 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -7.576 1.430 7.363 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -7.503 -1.159 5.975 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -7.809 0.180 4.886 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -5.460 -1.566 6.627 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -4.090 -0.482 6.365 1.00 0.00 H new ATOM 1326 N THR A 90 -7.623 0.612 10.094 1.00 0.00 N ATOM 1327 CA THR A 90 -6.680 0.685 11.199 1.00 0.00 C ATOM 1328 C THR A 90 -6.825 -0.514 12.109 1.00 0.00 C ATOM 1329 O THR A 90 -5.912 -1.316 12.218 1.00 0.00 O ATOM 1330 CB THR A 90 -6.889 1.979 11.986 1.00 0.00 C ATOM 1331 OG1 THR A 90 -6.783 3.106 11.134 1.00 0.00 O ATOM 1332 CG2 THR A 90 -5.896 2.165 13.109 1.00 0.00 C ATOM 0 H THR A 90 -8.327 1.350 10.094 1.00 0.00 H new ATOM 0 HA THR A 90 -5.670 0.681 10.790 1.00 0.00 H new ATOM 0 HB THR A 90 -7.888 1.896 12.414 1.00 0.00 H new ATOM 0 HG1 THR A 90 -7.671 3.346 10.797 1.00 0.00 H new ATOM 0 HG21 THR A 90 -6.102 3.103 13.625 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.983 1.337 13.812 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.886 2.190 12.701 1.00 0.00 H new ATOM 1340 N LYS A 91 -7.973 -0.641 12.759 1.00 0.00 N ATOM 1341 CA LYS A 91 -8.209 -1.758 13.666 1.00 0.00 C ATOM 1342 C LYS A 91 -7.796 -3.080 13.033 1.00 0.00 C ATOM 1343 O LYS A 91 -7.391 -4.009 13.729 1.00 0.00 O ATOM 1344 CB LYS A 91 -9.678 -1.809 14.088 1.00 0.00 C ATOM 1345 CG LYS A 91 -9.973 -1.022 15.355 1.00 0.00 C ATOM 1346 CD LYS A 91 -10.230 0.444 15.052 1.00 0.00 C ATOM 1347 CE LYS A 91 -9.938 1.326 16.257 1.00 0.00 C ATOM 1348 NZ LYS A 91 -8.886 2.338 15.963 1.00 0.00 N ATOM 0 H LYS A 91 -8.753 0.011 12.677 1.00 0.00 H new ATOM 0 HA LYS A 91 -7.595 -1.600 14.553 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.294 -1.421 13.277 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.968 -2.849 14.240 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.842 -1.449 15.856 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.133 -1.111 16.044 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.609 0.757 14.213 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.268 0.576 14.747 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.852 1.832 16.566 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -9.620 0.704 17.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -8.717 2.918 16.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.006 1.855 15.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.200 2.948 15.182 1.00 0.00 H new ATOM 1362 N PHE A 92 -7.887 -3.157 11.713 1.00 0.00 N ATOM 1363 CA PHE A 92 -7.503 -4.366 11.006 1.00 0.00 C ATOM 1364 C PHE A 92 -6.033 -4.304 10.595 1.00 0.00 C ATOM 1365 O PHE A 92 -5.382 -5.333 10.418 1.00 0.00 O ATOM 1366 CB PHE A 92 -8.391 -4.574 9.777 1.00 0.00 C ATOM 1367 CG PHE A 92 -8.913 -5.976 9.642 1.00 0.00 C ATOM 1368 CD1 PHE A 92 -10.111 -6.343 10.231 1.00 0.00 C ATOM 1369 CD2 PHE A 92 -8.204 -6.927 8.924 1.00 0.00 C ATOM 1370 CE1 PHE A 92 -10.595 -7.631 10.108 1.00 0.00 C ATOM 1371 CE2 PHE A 92 -8.683 -8.217 8.798 1.00 0.00 C ATOM 1372 CZ PHE A 92 -9.879 -8.571 9.390 1.00 0.00 C ATOM 0 H PHE A 92 -8.221 -2.401 11.115 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.638 -5.213 11.679 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -9.234 -3.885 9.827 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.824 -4.319 8.882 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -10.674 -5.613 10.794 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.268 -6.657 8.458 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -11.531 -7.903 10.572 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.122 -8.949 8.236 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.254 -9.579 9.293 1.00 0.00 H new ATOM 1382 N ALA A 93 -5.521 -3.086 10.443 1.00 0.00 N ATOM 1383 CA ALA A 93 -4.132 -2.881 10.051 1.00 0.00 C ATOM 1384 C ALA A 93 -3.215 -2.751 11.265 1.00 0.00 C ATOM 1385 O ALA A 93 -2.022 -3.042 11.186 1.00 0.00 O ATOM 1386 CB ALA A 93 -4.008 -1.651 9.172 1.00 0.00 C ATOM 0 H ALA A 93 -6.049 -2.225 10.586 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.817 -3.759 9.488 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -2.965 -1.511 8.887 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.614 -1.782 8.276 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.355 -0.775 9.720 1.00 0.00 H new ATOM 1392 N LEU A 94 -3.772 -2.304 12.385 1.00 0.00 N ATOM 1393 CA LEU A 94 -3.001 -2.132 13.601 1.00 0.00 C ATOM 1394 C LEU A 94 -2.891 -3.447 14.341 1.00 0.00 C ATOM 1395 O LEU A 94 -1.813 -3.857 14.774 1.00 0.00 O ATOM 1396 CB LEU A 94 -3.662 -1.080 14.486 1.00 0.00 C ATOM 1397 CG LEU A 94 -5.142 -1.302 14.829 1.00 0.00 C ATOM 1398 CD1 LEU A 94 -5.291 -2.240 16.002 1.00 0.00 C ATOM 1399 CD2 LEU A 94 -5.820 0.028 15.127 1.00 0.00 C ATOM 0 H LEU A 94 -4.757 -2.055 12.471 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.997 -1.797 13.341 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.102 -1.019 15.419 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.568 -0.112 13.993 1.00 0.00 H new ATOM 0 HG LEU A 94 -5.626 -1.759 13.966 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.349 -2.380 16.224 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -4.841 -3.202 15.758 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.791 -1.816 16.873 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.869 -0.144 15.369 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.327 0.506 15.973 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.751 0.676 14.253 1.00 0.00 H new ATOM 1411 N SER A 95 -4.027 -4.096 14.467 1.00 0.00 N ATOM 1412 CA SER A 95 -4.113 -5.384 15.145 1.00 0.00 C ATOM 1413 C SER A 95 -4.400 -6.498 14.144 1.00 0.00 C ATOM 1414 O SER A 95 -5.376 -7.237 14.279 1.00 0.00 O ATOM 1415 CB SER A 95 -5.193 -5.358 16.226 1.00 0.00 C ATOM 1416 OG SER A 95 -6.484 -5.218 15.660 1.00 0.00 O ATOM 0 H SER A 95 -4.918 -3.753 14.106 1.00 0.00 H new ATOM 0 HA SER A 95 -3.152 -5.579 15.621 1.00 0.00 H new ATOM 0 HB2 SER A 95 -5.148 -6.277 16.811 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.003 -4.533 16.913 1.00 0.00 H new ATOM 0 HG SER A 95 -6.435 -4.636 14.873 1.00 0.00 H new ATOM 1422 N LEU A 96 -3.540 -6.610 13.139 1.00 0.00 N ATOM 1423 CA LEU A 96 -3.695 -7.635 12.110 1.00 0.00 C ATOM 1424 C LEU A 96 -3.150 -8.975 12.599 1.00 0.00 C ATOM 1425 O LEU A 96 -3.909 -9.857 13.004 1.00 0.00 O ATOM 1426 CB LEU A 96 -2.992 -7.235 10.801 1.00 0.00 C ATOM 1427 CG LEU A 96 -2.239 -5.905 10.819 1.00 0.00 C ATOM 1428 CD1 LEU A 96 -0.882 -6.063 11.487 1.00 0.00 C ATOM 1429 CD2 LEU A 96 -2.075 -5.376 9.404 1.00 0.00 C ATOM 0 H LEU A 96 -2.728 -6.005 13.013 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.762 -7.733 11.908 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.288 -8.024 10.535 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -3.740 -7.195 10.009 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.821 -5.187 11.397 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -0.363 -5.104 11.489 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.019 -6.403 12.513 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.289 -6.795 10.938 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -1.537 -4.428 9.430 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -1.513 -6.096 8.809 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.057 -5.224 8.956 1.00 0.00 H new ATOM 1441 N SER A 97 -1.831 -9.117 12.552 1.00 0.00 N ATOM 1442 CA SER A 97 -1.174 -10.342 12.985 1.00 0.00 C ATOM 1443 C SER A 97 -0.135 -10.049 14.066 1.00 0.00 C ATOM 1444 O SER A 97 0.166 -8.889 14.350 1.00 0.00 O ATOM 1445 CB SER A 97 -0.509 -11.035 11.793 1.00 0.00 C ATOM 1446 OG SER A 97 -1.056 -12.326 11.581 1.00 0.00 O ATOM 0 H SER A 97 -1.194 -8.395 12.217 1.00 0.00 H new ATOM 0 HA SER A 97 -1.931 -11.004 13.405 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.641 -10.429 10.896 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.564 -11.116 11.968 1.00 0.00 H new ATOM 0 HG SER A 97 -0.615 -12.746 10.813 1.00 0.00 H new ATOM 1452 N PRO A 98 0.426 -11.101 14.685 1.00 0.00 N ATOM 1453 CA PRO A 98 1.432 -10.953 15.739 1.00 0.00 C ATOM 1454 C PRO A 98 2.818 -10.635 15.186 1.00 0.00 C ATOM 1455 O PRO A 98 3.771 -11.383 15.406 1.00 0.00 O ATOM 1456 CB PRO A 98 1.425 -12.326 16.409 1.00 0.00 C ATOM 1457 CG PRO A 98 1.066 -13.268 15.315 1.00 0.00 C ATOM 1458 CD PRO A 98 0.121 -12.519 14.410 1.00 0.00 C ATOM 0 HA PRO A 98 1.205 -10.126 16.412 1.00 0.00 H new ATOM 0 HB2 PRO A 98 2.399 -12.565 16.836 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.701 -12.368 17.223 1.00 0.00 H new ATOM 0 HG2 PRO A 98 1.954 -13.589 14.771 1.00 0.00 H new ATOM 0 HG3 PRO A 98 0.594 -14.166 15.713 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.287 -12.769 13.362 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.919 -12.756 14.633 1.00 0.00 H new ATOM 1466 N GLY A 99 2.925 -9.524 14.466 1.00 0.00 N ATOM 1467 CA GLY A 99 4.202 -9.131 13.896 1.00 0.00 C ATOM 1468 C GLY A 99 4.085 -8.689 12.451 1.00 0.00 C ATOM 1469 O GLY A 99 4.893 -9.081 11.609 1.00 0.00 O ATOM 0 H GLY A 99 2.152 -8.889 14.267 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.625 -8.319 14.487 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.897 -9.968 13.961 1.00 0.00 H new ATOM 1473 N ALA A 100 3.077 -7.873 12.162 1.00 0.00 N ATOM 1474 CA ALA A 100 2.859 -7.378 10.807 1.00 0.00 C ATOM 1475 C ALA A 100 2.241 -5.983 10.822 1.00 0.00 C ATOM 1476 O ALA A 100 1.404 -5.658 9.981 1.00 0.00 O ATOM 1477 CB ALA A 100 1.974 -8.344 10.031 1.00 0.00 C ATOM 0 H ALA A 100 2.398 -7.540 12.847 1.00 0.00 H new ATOM 0 HA ALA A 100 3.827 -7.309 10.311 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.818 -7.964 9.021 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.457 -9.320 9.981 1.00 0.00 H new ATOM 0 HB3 ALA A 100 1.012 -8.441 10.534 1.00 0.00 H new ATOM 1483 N HIS A 101 2.658 -5.165 11.782 1.00 0.00 N ATOM 1484 CA HIS A 101 2.145 -3.804 11.905 1.00 0.00 C ATOM 1485 C HIS A 101 2.860 -2.864 10.940 1.00 0.00 C ATOM 1486 O HIS A 101 2.263 -1.924 10.416 1.00 0.00 O ATOM 1487 CB HIS A 101 2.306 -3.301 13.340 1.00 0.00 C ATOM 1488 CG HIS A 101 1.696 -1.955 13.574 1.00 0.00 C ATOM 1489 ND1 HIS A 101 0.496 -1.776 14.231 1.00 0.00 N ATOM 1490 CD2 HIS A 101 2.126 -0.717 13.235 1.00 0.00 C ATOM 1491 CE1 HIS A 101 0.213 -0.486 14.285 1.00 0.00 C ATOM 1492 NE2 HIS A 101 1.187 0.177 13.689 1.00 0.00 N ATOM 0 H HIS A 101 3.350 -5.420 12.487 1.00 0.00 H new ATOM 0 HA HIS A 101 1.085 -3.819 11.651 1.00 0.00 H new ATOM 0 HB2 HIS A 101 1.852 -4.020 14.022 1.00 0.00 H new ATOM 0 HB3 HIS A 101 3.367 -3.257 13.584 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -0.083 -2.523 14.615 1.00 0.00 H new ATOM 0 HD2 HIS A 101 3.037 -0.477 12.707 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.664 -0.049 14.739 1.00 0.00 H new ATOM 1501 N GLN A 102 4.142 -3.125 10.710 1.00 0.00 N ATOM 1502 CA GLN A 102 4.941 -2.304 9.809 1.00 0.00 C ATOM 1503 C GLN A 102 6.023 -3.137 9.133 1.00 0.00 C ATOM 1504 O GLN A 102 7.105 -2.638 8.824 1.00 0.00 O ATOM 1505 CB GLN A 102 5.578 -1.143 10.573 1.00 0.00 C ATOM 1506 CG GLN A 102 6.348 -1.577 11.809 1.00 0.00 C ATOM 1507 CD GLN A 102 7.302 -0.508 12.307 1.00 0.00 C ATOM 1508 OE1 GLN A 102 7.257 -0.113 13.471 1.00 0.00 O ATOM 1509 NE2 GLN A 102 8.172 -0.033 11.423 1.00 0.00 N ATOM 0 H GLN A 102 4.650 -3.900 11.136 1.00 0.00 H new ATOM 0 HA GLN A 102 4.281 -1.904 9.040 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.252 -0.606 9.905 1.00 0.00 H new ATOM 0 HB3 GLN A 102 4.797 -0.442 10.869 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.643 -1.828 12.602 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.910 -2.483 11.583 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.174 -0.390 10.467 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.838 0.688 11.700 1.00 0.00 H new ATOM 1518 N LYS A 103 5.724 -4.414 8.907 1.00 0.00 N ATOM 1519 CA LYS A 103 6.671 -5.320 8.270 1.00 0.00 C ATOM 1520 C LYS A 103 6.273 -5.598 6.823 1.00 0.00 C ATOM 1521 O LYS A 103 7.129 -5.829 5.968 1.00 0.00 O ATOM 1522 CB LYS A 103 6.750 -6.633 9.051 1.00 0.00 C ATOM 1523 CG LYS A 103 7.832 -6.639 10.118 1.00 0.00 C ATOM 1524 CD LYS A 103 7.277 -6.238 11.477 1.00 0.00 C ATOM 1525 CE LYS A 103 7.251 -7.414 12.442 1.00 0.00 C ATOM 1526 NZ LYS A 103 8.263 -7.268 13.524 1.00 0.00 N ATOM 0 H LYS A 103 4.833 -4.843 9.156 1.00 0.00 H new ATOM 0 HA LYS A 103 7.651 -4.842 8.270 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.786 -6.825 9.521 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.933 -7.451 8.354 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.275 -7.633 10.183 1.00 0.00 H new ATOM 0 HG3 LYS A 103 8.630 -5.953 9.833 1.00 0.00 H new ATOM 0 HD2 LYS A 103 7.885 -5.436 11.896 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.268 -5.844 11.356 1.00 0.00 H new ATOM 0 HE2 LYS A 103 6.258 -7.499 12.883 1.00 0.00 H new ATOM 0 HE3 LYS A 103 7.437 -8.338 11.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 8.213 -8.090 14.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 9.213 -7.212 13.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 8.071 -6.400 14.064 1.00 0.00 H new ATOM 1540 N ARG A 104 4.971 -5.577 6.556 1.00 0.00 N ATOM 1541 CA ARG A 104 4.464 -5.829 5.213 1.00 0.00 C ATOM 1542 C ARG A 104 3.737 -4.607 4.658 1.00 0.00 C ATOM 1543 O ARG A 104 3.809 -4.323 3.463 1.00 0.00 O ATOM 1544 CB ARG A 104 3.522 -7.037 5.217 1.00 0.00 C ATOM 1545 CG ARG A 104 2.358 -6.898 6.183 1.00 0.00 C ATOM 1546 CD ARG A 104 1.211 -7.825 5.815 1.00 0.00 C ATOM 1547 NE ARG A 104 1.248 -9.072 6.578 1.00 0.00 N ATOM 1548 CZ ARG A 104 1.686 -10.234 6.092 1.00 0.00 C ATOM 1549 NH1 ARG A 104 2.144 -10.319 4.850 1.00 0.00 N ATOM 1550 NH2 ARG A 104 1.670 -11.315 6.859 1.00 0.00 N ATOM 0 H ARG A 104 4.249 -5.388 7.251 1.00 0.00 H new ATOM 0 HA ARG A 104 5.318 -6.041 4.569 1.00 0.00 H new ATOM 0 HB2 ARG A 104 3.132 -7.186 4.210 1.00 0.00 H new ATOM 0 HB3 ARG A 104 4.091 -7.930 5.474 1.00 0.00 H new ATOM 0 HG2 ARG A 104 2.696 -7.121 7.195 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.007 -5.866 6.184 1.00 0.00 H new ATOM 0 HD2 ARG A 104 0.263 -7.318 5.995 1.00 0.00 H new ATOM 0 HD3 ARG A 104 1.255 -8.051 4.749 1.00 0.00 H new ATOM 0 HE ARG A 104 0.918 -9.052 7.543 1.00 0.00 H new ATOM 0 HH11 ARG A 104 2.164 -9.490 4.256 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.476 -11.213 4.489 1.00 0.00 H new ATOM 0 HH21 ARG A 104 1.324 -11.256 7.817 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.004 -12.206 6.492 1.00 0.00 H new ATOM 1564 N LEU A 105 3.033 -3.892 5.529 1.00 0.00 N ATOM 1565 CA LEU A 105 2.288 -2.712 5.121 1.00 0.00 C ATOM 1566 C LEU A 105 3.070 -1.438 5.423 1.00 0.00 C ATOM 1567 O LEU A 105 3.534 -1.234 6.544 1.00 0.00 O ATOM 1568 CB LEU A 105 0.945 -2.674 5.847 1.00 0.00 C ATOM 1569 CG LEU A 105 1.015 -2.936 7.353 1.00 0.00 C ATOM 1570 CD1 LEU A 105 0.064 -2.012 8.101 1.00 0.00 C ATOM 1571 CD2 LEU A 105 0.698 -4.392 7.657 1.00 0.00 C ATOM 0 H LEU A 105 2.964 -4.111 6.523 1.00 0.00 H new ATOM 0 HA LEU A 105 2.124 -2.767 4.045 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.489 -1.697 5.684 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.284 -3.414 5.395 1.00 0.00 H new ATOM 0 HG LEU A 105 2.030 -2.729 7.691 1.00 0.00 H new ATOM 0 HD11 LEU A 105 0.128 -2.213 9.170 1.00 0.00 H new ATOM 0 HD12 LEU A 105 0.339 -0.975 7.910 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.956 -2.186 7.759 1.00 0.00 H new ATOM 0 HD21 LEU A 105 0.753 -4.559 8.733 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.306 -4.627 7.304 1.00 0.00 H new ATOM 0 HD23 LEU A 105 1.420 -5.034 7.153 1.00 0.00 H new ATOM 1583 N ILE A 106 3.207 -0.581 4.415 1.00 0.00 N ATOM 1584 CA ILE A 106 3.930 0.675 4.581 1.00 0.00 C ATOM 1585 C ILE A 106 3.043 1.875 4.247 1.00 0.00 C ATOM 1586 O ILE A 106 2.464 1.946 3.161 1.00 0.00 O ATOM 1587 CB ILE A 106 5.194 0.729 3.698 1.00 0.00 C ATOM 1588 CG1 ILE A 106 4.893 0.199 2.289 1.00 0.00 C ATOM 1589 CG2 ILE A 106 6.330 -0.051 4.349 1.00 0.00 C ATOM 1590 CD1 ILE A 106 5.051 -1.301 2.143 1.00 0.00 C ATOM 0 H ILE A 106 2.829 -0.732 3.480 1.00 0.00 H new ATOM 0 HA ILE A 106 4.227 0.723 5.629 1.00 0.00 H new ATOM 0 HB ILE A 106 5.509 1.768 3.603 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.873 0.474 2.020 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.554 0.694 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 106 7.215 -0.003 3.714 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.558 0.383 5.322 1.00 0.00 H new ATOM 0 HG23 ILE A 106 6.031 -1.091 4.477 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.820 -1.593 1.119 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.077 -1.583 2.378 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.370 -1.807 2.827 1.00 0.00 H new ATOM 1602 N PRO A 107 2.917 2.835 5.184 1.00 0.00 N ATOM 1603 CA PRO A 107 2.095 4.037 4.987 1.00 0.00 C ATOM 1604 C PRO A 107 2.704 5.003 3.973 1.00 0.00 C ATOM 1605 O PRO A 107 3.924 5.068 3.817 1.00 0.00 O ATOM 1606 CB PRO A 107 2.071 4.678 6.376 1.00 0.00 C ATOM 1607 CG PRO A 107 3.332 4.218 7.017 1.00 0.00 C ATOM 1608 CD PRO A 107 3.560 2.822 6.510 1.00 0.00 C ATOM 0 HA PRO A 107 1.109 3.793 4.592 1.00 0.00 H new ATOM 0 HB2 PRO A 107 2.032 5.765 6.311 1.00 0.00 H new ATOM 0 HB3 PRO A 107 1.197 4.361 6.945 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.165 4.871 6.755 1.00 0.00 H new ATOM 0 HG3 PRO A 107 3.246 4.231 8.104 1.00 0.00 H new ATOM 0 HD2 PRO A 107 4.622 2.588 6.440 1.00 0.00 H new ATOM 0 HD3 PRO A 107 3.112 2.077 7.167 1.00 0.00 H new ATOM 1616 N ILE A 108 1.844 5.752 3.289 1.00 0.00 N ATOM 1617 CA ILE A 108 2.289 6.718 2.290 1.00 0.00 C ATOM 1618 C ILE A 108 1.313 7.893 2.202 1.00 0.00 C ATOM 1619 O ILE A 108 0.162 7.786 2.620 1.00 0.00 O ATOM 1620 CB ILE A 108 2.440 6.052 0.901 1.00 0.00 C ATOM 1621 CG1 ILE A 108 3.630 5.091 0.904 1.00 0.00 C ATOM 1622 CG2 ILE A 108 2.609 7.095 -0.197 1.00 0.00 C ATOM 1623 CD1 ILE A 108 3.251 3.661 1.213 1.00 0.00 C ATOM 0 H ILE A 108 0.832 5.708 3.409 1.00 0.00 H new ATOM 0 HA ILE A 108 3.264 7.092 2.602 1.00 0.00 H new ATOM 0 HB ILE A 108 1.528 5.491 0.695 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.118 5.127 -0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 108 4.360 5.432 1.638 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.713 6.596 -1.160 1.00 0.00 H new ATOM 0 HG22 ILE A 108 1.735 7.746 -0.218 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.500 7.690 0.001 1.00 0.00 H new ATOM 0 HD11 ILE A 108 4.144 3.036 1.198 1.00 0.00 H new ATOM 0 HD12 ILE A 108 2.790 3.612 2.200 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.545 3.302 0.465 1.00 0.00 H new ATOM 1635 N LYS A 109 1.781 9.012 1.657 1.00 0.00 N ATOM 1636 CA LYS A 109 0.945 10.200 1.516 1.00 0.00 C ATOM 1637 C LYS A 109 1.607 11.230 0.608 1.00 0.00 C ATOM 1638 O LYS A 109 2.832 11.357 0.584 1.00 0.00 O ATOM 1639 CB LYS A 109 0.657 10.814 2.887 1.00 0.00 C ATOM 1640 CG LYS A 109 1.889 11.378 3.578 1.00 0.00 C ATOM 1641 CD LYS A 109 2.534 10.349 4.492 1.00 0.00 C ATOM 1642 CE LYS A 109 2.116 10.549 5.939 1.00 0.00 C ATOM 1643 NZ LYS A 109 3.099 11.376 6.693 1.00 0.00 N ATOM 0 H LYS A 109 2.733 9.121 1.306 1.00 0.00 H new ATOM 0 HA LYS A 109 0.003 9.897 1.059 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.079 11.609 2.771 1.00 0.00 H new ATOM 0 HB3 LYS A 109 0.208 10.055 3.528 1.00 0.00 H new ATOM 0 HG2 LYS A 109 2.611 11.704 2.829 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.612 12.258 4.158 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.255 9.347 4.167 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.619 10.420 4.413 1.00 0.00 H new ATOM 0 HE2 LYS A 109 1.138 11.029 5.971 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.011 9.578 6.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.955 11.242 7.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 4.065 11.085 6.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.965 12.379 6.453 1.00 0.00 H new ATOM 1657 N TYR A 110 0.789 11.968 -0.136 1.00 0.00 N ATOM 1658 CA TYR A 110 1.295 12.992 -1.042 1.00 0.00 C ATOM 1659 C TYR A 110 1.477 14.330 -0.322 1.00 0.00 C ATOM 1660 O TYR A 110 1.804 15.339 -0.947 1.00 0.00 O ATOM 1661 CB TYR A 110 0.346 13.163 -2.231 1.00 0.00 C ATOM 1662 CG TYR A 110 -1.005 13.731 -1.857 1.00 0.00 C ATOM 1663 CD1 TYR A 110 -2.011 12.910 -1.361 1.00 0.00 C ATOM 1664 CD2 TYR A 110 -1.275 15.085 -2.000 1.00 0.00 C ATOM 1665 CE1 TYR A 110 -3.247 13.423 -1.019 1.00 0.00 C ATOM 1666 CE2 TYR A 110 -2.509 15.607 -1.660 1.00 0.00 C ATOM 1667 CZ TYR A 110 -3.491 14.772 -1.170 1.00 0.00 C ATOM 1668 OH TYR A 110 -4.720 15.289 -0.831 1.00 0.00 O ATOM 0 H TYR A 110 -0.227 11.876 -0.129 1.00 0.00 H new ATOM 0 HA TYR A 110 2.270 12.666 -1.404 1.00 0.00 H new ATOM 0 HB2 TYR A 110 0.814 13.818 -2.966 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.202 12.195 -2.711 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -1.823 11.853 -1.241 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.508 15.742 -2.383 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -4.018 12.771 -0.635 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -2.703 16.663 -1.777 1.00 0.00 H new ATOM 0 HH TYR A 110 -5.411 14.890 -1.400 1.00 0.00 H new ATOM 1678 N LYS A 111 1.265 14.332 0.993 1.00 0.00 N ATOM 1679 CA LYS A 111 1.408 15.542 1.789 1.00 0.00 C ATOM 1680 C LYS A 111 1.165 15.248 3.266 1.00 0.00 C ATOM 1681 O LYS A 111 0.651 14.187 3.620 1.00 0.00 O ATOM 1682 CB LYS A 111 0.437 16.618 1.303 1.00 0.00 C ATOM 1683 CG LYS A 111 -1.005 16.144 1.231 1.00 0.00 C ATOM 1684 CD LYS A 111 -1.775 16.515 2.487 1.00 0.00 C ATOM 1685 CE LYS A 111 -3.199 16.928 2.162 1.00 0.00 C ATOM 1686 NZ LYS A 111 -3.692 17.997 3.074 1.00 0.00 N ATOM 0 H LYS A 111 0.993 13.506 1.527 1.00 0.00 H new ATOM 0 HA LYS A 111 2.428 15.908 1.671 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.496 17.478 1.970 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.749 16.959 0.316 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -1.491 16.585 0.361 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -1.028 15.063 1.095 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.788 15.667 3.172 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.266 17.331 3.000 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -3.248 17.280 1.131 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.854 16.060 2.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -4.728 18.061 3.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.423 17.770 4.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.270 18.908 2.801 1.00 0.00 H new ATOM 1700 N ALA A 112 1.539 16.190 4.124 1.00 0.00 N ATOM 1701 CA ALA A 112 1.364 16.027 5.561 1.00 0.00 C ATOM 1702 C ALA A 112 -0.102 16.153 5.961 1.00 0.00 C ATOM 1703 O ALA A 112 -0.862 16.907 5.352 1.00 0.00 O ATOM 1704 CB ALA A 112 2.206 17.048 6.312 1.00 0.00 C ATOM 0 H ALA A 112 1.965 17.075 3.849 1.00 0.00 H new ATOM 0 HA ALA A 112 1.698 15.024 5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 112 2.067 16.916 7.385 1.00 0.00 H new ATOM 0 HB2 ALA A 112 3.258 16.906 6.063 1.00 0.00 H new ATOM 0 HB3 ALA A 112 1.898 18.054 6.027 1.00 0.00 H new ATOM 1710 N MET A 113 -0.491 15.407 6.991 1.00 0.00 N ATOM 1711 CA MET A 113 -1.862 15.428 7.482 1.00 0.00 C ATOM 1712 C MET A 113 -2.070 16.581 8.460 1.00 0.00 C ATOM 1713 O MET A 113 -1.418 16.652 9.501 1.00 0.00 O ATOM 1714 CB MET A 113 -2.195 14.100 8.166 1.00 0.00 C ATOM 1715 CG MET A 113 -2.339 12.937 7.196 1.00 0.00 C ATOM 1716 SD MET A 113 -1.356 11.503 7.677 1.00 0.00 S ATOM 1717 CE MET A 113 -1.673 11.450 9.439 1.00 0.00 C ATOM 0 H MET A 113 0.128 14.778 7.503 1.00 0.00 H new ATOM 0 HA MET A 113 -2.528 15.572 6.631 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.412 13.866 8.888 1.00 0.00 H new ATOM 0 HB3 MET A 113 -3.123 14.212 8.727 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.388 12.649 7.134 1.00 0.00 H new ATOM 0 HG3 MET A 113 -2.038 13.261 6.200 1.00 0.00 H new ATOM 0 HE1 MET A 113 -1.847 10.419 9.746 1.00 0.00 H new ATOM 0 HE2 MET A 113 -0.812 11.848 9.976 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.553 12.051 9.669 1.00 0.00 H new ATOM 1727 N LYS A 114 -2.986 17.480 8.115 1.00 0.00 N ATOM 1728 CA LYS A 114 -3.287 18.630 8.958 1.00 0.00 C ATOM 1729 C LYS A 114 -3.838 18.193 10.314 1.00 0.00 C ATOM 1730 O LYS A 114 -3.863 18.978 11.261 1.00 0.00 O ATOM 1731 CB LYS A 114 -4.288 19.552 8.257 1.00 0.00 C ATOM 1732 CG LYS A 114 -3.661 20.819 7.698 1.00 0.00 C ATOM 1733 CD LYS A 114 -3.336 20.677 6.220 1.00 0.00 C ATOM 1734 CE LYS A 114 -1.893 20.245 6.007 1.00 0.00 C ATOM 1735 NZ LYS A 114 -1.435 20.513 4.614 1.00 0.00 N ATOM 0 H LYS A 114 -3.533 17.433 7.256 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.358 19.174 9.129 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -4.766 19.005 7.445 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -5.073 19.826 8.962 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -4.343 21.657 7.842 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.750 21.050 8.251 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -4.006 19.947 5.767 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -3.511 21.627 5.715 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -1.248 20.773 6.710 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -1.796 19.181 6.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -0.447 20.205 4.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.035 19.989 3.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -1.503 21.532 4.416 1.00 0.00 H new ATOM 1749 N LYS A 115 -4.278 16.939 10.405 1.00 0.00 N ATOM 1750 CA LYS A 115 -4.820 16.417 11.656 1.00 0.00 C ATOM 1751 C LYS A 115 -3.873 15.384 12.270 1.00 0.00 C ATOM 1752 O LYS A 115 -2.685 15.362 11.949 1.00 0.00 O ATOM 1753 CB LYS A 115 -6.226 15.838 11.444 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.436 15.211 10.083 1.00 0.00 C ATOM 1755 CD LYS A 115 -5.768 13.858 10.001 1.00 0.00 C ATOM 1756 CE LYS A 115 -6.436 12.859 10.931 1.00 0.00 C ATOM 1757 NZ LYS A 115 -7.911 12.813 10.733 1.00 0.00 N ATOM 0 H LYS A 115 -4.270 16.271 9.634 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.908 17.243 12.362 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.418 15.088 12.211 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.959 16.632 11.584 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.503 15.106 9.888 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.034 15.867 9.311 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.811 13.490 8.976 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.714 13.953 10.262 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.016 11.868 10.760 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.217 13.124 11.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.287 11.928 11.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.351 13.622 11.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -8.126 12.856 9.716 1.00 0.00 H new ATOM 1771 N GLU A 116 -4.386 14.549 13.170 1.00 0.00 N ATOM 1772 CA GLU A 116 -3.565 13.549 13.836 1.00 0.00 C ATOM 1773 C GLU A 116 -3.377 12.305 12.977 1.00 0.00 C ATOM 1774 O GLU A 116 -4.020 12.143 11.941 1.00 0.00 O ATOM 1775 CB GLU A 116 -4.195 13.165 15.175 1.00 0.00 C ATOM 1776 CG GLU A 116 -5.686 12.881 15.093 1.00 0.00 C ATOM 1777 CD GLU A 116 -6.204 12.132 16.304 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -5.543 12.182 17.362 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -7.272 11.493 16.195 1.00 0.00 O ATOM 0 H GLU A 116 -5.366 14.547 13.453 1.00 0.00 H new ATOM 0 HA GLU A 116 -2.582 13.988 14.004 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -3.688 12.283 15.565 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -4.027 13.971 15.889 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -6.226 13.822 14.994 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.892 12.299 14.195 1.00 0.00 H new ATOM 1786 N PHE A 117 -2.491 11.425 13.430 1.00 0.00 N ATOM 1787 CA PHE A 117 -2.206 10.181 12.726 1.00 0.00 C ATOM 1788 C PHE A 117 -2.814 8.997 13.469 1.00 0.00 C ATOM 1789 O PHE A 117 -2.949 9.021 14.692 1.00 0.00 O ATOM 1790 CB PHE A 117 -0.694 9.975 12.553 1.00 0.00 C ATOM 1791 CG PHE A 117 0.154 10.856 13.429 1.00 0.00 C ATOM 1792 CD1 PHE A 117 0.245 12.217 13.182 1.00 0.00 C ATOM 1793 CD2 PHE A 117 0.861 10.323 14.495 1.00 0.00 C ATOM 1794 CE1 PHE A 117 1.025 13.030 13.985 1.00 0.00 C ATOM 1795 CE2 PHE A 117 1.642 11.130 15.300 1.00 0.00 C ATOM 1796 CZ PHE A 117 1.724 12.486 15.045 1.00 0.00 C ATOM 0 H PHE A 117 -1.954 11.552 14.288 1.00 0.00 H new ATOM 0 HA PHE A 117 -2.656 10.247 11.736 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -0.454 8.933 12.765 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -0.431 10.157 11.511 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -0.299 12.647 12.354 1.00 0.00 H new ATOM 0 HD2 PHE A 117 0.801 9.264 14.699 1.00 0.00 H new ATOM 0 HE1 PHE A 117 1.087 14.089 13.783 1.00 0.00 H new ATOM 0 HE2 PHE A 117 2.188 10.702 16.128 1.00 0.00 H new ATOM 0 HZ PHE A 117 2.333 13.119 15.673 1.00 0.00 H new ATOM 1806 N PRO A 118 -3.194 7.946 12.732 1.00 0.00 N ATOM 1807 CA PRO A 118 -3.794 6.748 13.309 1.00 0.00 C ATOM 1808 C PRO A 118 -2.756 5.780 13.857 1.00 0.00 C ATOM 1809 O PRO A 118 -1.615 5.767 13.399 1.00 0.00 O ATOM 1810 CB PRO A 118 -4.529 6.137 12.121 1.00 0.00 C ATOM 1811 CG PRO A 118 -3.721 6.533 10.932 1.00 0.00 C ATOM 1812 CD PRO A 118 -3.067 7.848 11.266 1.00 0.00 C ATOM 0 HA PRO A 118 -4.434 6.974 14.162 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -4.595 5.053 12.211 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -5.549 6.514 12.050 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -2.971 5.775 10.705 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -4.354 6.629 10.050 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -2.023 7.865 10.954 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -3.563 8.679 10.766 1.00 0.00 H new ATOM 1820 N SER A 119 -3.165 4.950 14.819 1.00 0.00 N ATOM 1821 CA SER A 119 -2.270 3.953 15.395 1.00 0.00 C ATOM 1822 C SER A 119 -1.975 2.930 14.317 1.00 0.00 C ATOM 1823 O SER A 119 -2.451 1.794 14.356 1.00 0.00 O ATOM 1824 CB SER A 119 -2.911 3.281 16.612 1.00 0.00 C ATOM 1825 OG SER A 119 -1.939 2.969 17.595 1.00 0.00 O ATOM 0 H SER A 119 -4.106 4.951 15.212 1.00 0.00 H new ATOM 0 HA SER A 119 -1.350 4.426 15.737 1.00 0.00 H new ATOM 0 HB2 SER A 119 -3.666 3.941 17.040 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.423 2.370 16.301 1.00 0.00 H new ATOM 0 HG SER A 119 -2.375 2.542 18.362 1.00 0.00 H new ATOM 1831 N ILE A 120 -1.239 3.384 13.319 1.00 0.00 N ATOM 1832 CA ILE A 120 -0.918 2.583 12.164 1.00 0.00 C ATOM 1833 C ILE A 120 0.442 2.987 11.606 1.00 0.00 C ATOM 1834 O ILE A 120 1.274 2.142 11.278 1.00 0.00 O ATOM 1835 CB ILE A 120 -2.025 2.801 11.107 1.00 0.00 C ATOM 1836 CG1 ILE A 120 -3.236 1.932 11.434 1.00 0.00 C ATOM 1837 CG2 ILE A 120 -1.536 2.536 9.699 1.00 0.00 C ATOM 1838 CD1 ILE A 120 -2.974 0.456 11.285 1.00 0.00 C ATOM 0 H ILE A 120 -0.847 4.325 13.292 1.00 0.00 H new ATOM 0 HA ILE A 120 -0.867 1.529 12.437 1.00 0.00 H new ATOM 0 HB ILE A 120 -2.316 3.851 11.145 1.00 0.00 H new ATOM 0 HG12 ILE A 120 -3.554 2.135 12.457 1.00 0.00 H new ATOM 0 HG13 ILE A 120 -4.062 2.214 10.782 1.00 0.00 H new ATOM 0 HG21 ILE A 120 -2.350 2.703 8.994 1.00 0.00 H new ATOM 0 HG22 ILE A 120 -0.711 3.210 9.467 1.00 0.00 H new ATOM 0 HG23 ILE A 120 -1.194 1.504 9.621 1.00 0.00 H new ATOM 0 HD11 ILE A 120 -3.878 -0.101 11.533 1.00 0.00 H new ATOM 0 HD12 ILE A 120 -2.686 0.240 10.256 1.00 0.00 H new ATOM 0 HD13 ILE A 120 -2.169 0.160 11.957 1.00 0.00 H new ATOM 1850 N LEU A 121 0.652 4.293 11.513 1.00 0.00 N ATOM 1851 CA LEU A 121 1.901 4.844 11.007 1.00 0.00 C ATOM 1852 C LEU A 121 2.521 5.805 12.021 1.00 0.00 C ATOM 1853 O LEU A 121 3.211 6.754 11.649 1.00 0.00 O ATOM 1854 CB LEU A 121 1.674 5.561 9.666 1.00 0.00 C ATOM 1855 CG LEU A 121 0.487 6.538 9.601 1.00 0.00 C ATOM 1856 CD1 LEU A 121 -0.825 5.795 9.388 1.00 0.00 C ATOM 1857 CD2 LEU A 121 0.412 7.407 10.850 1.00 0.00 C ATOM 0 H LEU A 121 -0.035 4.997 11.785 1.00 0.00 H new ATOM 0 HA LEU A 121 2.593 4.017 10.847 1.00 0.00 H new ATOM 0 HB2 LEU A 121 2.582 6.110 9.415 1.00 0.00 H new ATOM 0 HB3 LEU A 121 1.535 4.804 8.894 1.00 0.00 H new ATOM 0 HG LEU A 121 0.652 7.193 8.745 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -1.646 6.511 9.346 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -0.780 5.239 8.452 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -0.989 5.103 10.214 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -0.438 8.085 10.771 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.289 6.773 11.728 1.00 0.00 H new ATOM 0 HD23 LEU A 121 1.331 7.986 10.946 1.00 0.00 H new ATOM 1869 N ARG A 122 2.258 5.551 13.304 1.00 0.00 N ATOM 1870 CA ARG A 122 2.766 6.388 14.395 1.00 0.00 C ATOM 1871 C ARG A 122 4.165 6.932 14.109 1.00 0.00 C ATOM 1872 O ARG A 122 4.430 8.118 14.305 1.00 0.00 O ATOM 1873 CB ARG A 122 2.777 5.597 15.706 1.00 0.00 C ATOM 1874 CG ARG A 122 3.315 4.182 15.565 1.00 0.00 C ATOM 1875 CD ARG A 122 2.868 3.299 16.720 1.00 0.00 C ATOM 1876 NE ARG A 122 3.933 2.404 17.167 1.00 0.00 N ATOM 1877 CZ ARG A 122 5.035 2.814 17.792 1.00 0.00 C ATOM 1878 NH1 ARG A 122 5.221 4.104 18.045 1.00 0.00 N ATOM 1879 NH2 ARG A 122 5.953 1.934 18.166 1.00 0.00 N ATOM 0 H ARG A 122 1.690 4.764 13.616 1.00 0.00 H new ATOM 0 HA ARG A 122 2.094 7.242 14.483 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.380 6.134 16.438 1.00 0.00 H new ATOM 0 HB3 ARG A 122 1.762 5.552 16.101 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.972 3.753 14.624 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.404 4.208 15.525 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.547 3.925 17.552 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.004 2.710 16.413 1.00 0.00 H new ATOM 0 HE ARG A 122 3.826 1.405 16.990 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.518 4.786 17.760 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.067 4.413 18.524 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.816 0.941 17.975 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.797 2.249 18.645 1.00 0.00 H new ATOM 1893 N PHE A 123 5.051 6.063 13.648 1.00 0.00 N ATOM 1894 CA PHE A 123 6.420 6.467 13.338 1.00 0.00 C ATOM 1895 C PHE A 123 7.123 5.412 12.492 1.00 0.00 C ATOM 1896 O PHE A 123 8.342 5.253 12.566 1.00 0.00 O ATOM 1897 CB PHE A 123 7.204 6.709 14.630 1.00 0.00 C ATOM 1898 CG PHE A 123 8.119 7.899 14.563 1.00 0.00 C ATOM 1899 CD1 PHE A 123 7.623 9.181 14.736 1.00 0.00 C ATOM 1900 CD2 PHE A 123 9.475 7.734 14.329 1.00 0.00 C ATOM 1901 CE1 PHE A 123 8.461 10.277 14.676 1.00 0.00 C ATOM 1902 CE2 PHE A 123 10.319 8.828 14.267 1.00 0.00 C ATOM 1903 CZ PHE A 123 9.811 10.101 14.442 1.00 0.00 C ATOM 0 H PHE A 123 4.851 5.077 13.480 1.00 0.00 H new ATOM 0 HA PHE A 123 6.379 7.393 12.765 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.501 6.847 15.451 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.793 5.821 14.860 1.00 0.00 H new ATOM 0 HD1 PHE A 123 6.569 9.325 14.920 1.00 0.00 H new ATOM 0 HD2 PHE A 123 9.877 6.741 14.194 1.00 0.00 H new ATOM 0 HE1 PHE A 123 8.061 11.271 14.812 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.374 8.687 14.082 1.00 0.00 H new ATOM 0 HZ PHE A 123 10.468 10.957 14.396 1.00 0.00 H new ATOM 1913 N ILE A 124 6.346 4.692 11.692 1.00 0.00 N ATOM 1914 CA ILE A 124 6.881 3.653 10.838 1.00 0.00 C ATOM 1915 C ILE A 124 7.338 4.225 9.495 1.00 0.00 C ATOM 1916 O ILE A 124 7.310 5.437 9.288 1.00 0.00 O ATOM 1917 CB ILE A 124 5.825 2.554 10.612 1.00 0.00 C ATOM 1918 CG1 ILE A 124 4.723 3.045 9.667 1.00 0.00 C ATOM 1919 CG2 ILE A 124 5.232 2.115 11.947 1.00 0.00 C ATOM 1920 CD1 ILE A 124 3.563 2.082 9.528 1.00 0.00 C ATOM 0 H ILE A 124 5.336 4.815 11.621 1.00 0.00 H new ATOM 0 HA ILE A 124 7.748 3.219 11.336 1.00 0.00 H new ATOM 0 HB ILE A 124 6.311 1.697 10.146 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.347 4.002 10.029 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.155 3.224 8.682 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.487 1.338 11.776 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.024 1.724 12.586 1.00 0.00 H new ATOM 0 HG23 ILE A 124 4.761 2.969 12.434 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.824 2.499 8.844 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.924 1.131 9.136 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.104 1.922 10.504 1.00 0.00 H new ATOM 1932 N THR A 125 7.762 3.348 8.590 1.00 0.00 N ATOM 1933 CA THR A 125 8.226 3.775 7.272 1.00 0.00 C ATOM 1934 C THR A 125 7.129 4.528 6.524 1.00 0.00 C ATOM 1935 O THR A 125 6.236 3.919 5.935 1.00 0.00 O ATOM 1936 CB THR A 125 8.678 2.565 6.451 1.00 0.00 C ATOM 1937 OG1 THR A 125 9.734 1.884 7.104 1.00 0.00 O ATOM 1938 CG2 THR A 125 9.156 2.928 5.061 1.00 0.00 C ATOM 0 H THR A 125 7.794 2.340 8.743 1.00 0.00 H new ATOM 0 HA THR A 125 9.072 4.448 7.414 1.00 0.00 H new ATOM 0 HB THR A 125 7.795 1.932 6.359 1.00 0.00 H new ATOM 0 HG1 THR A 125 10.008 1.113 6.565 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.461 2.024 4.534 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.348 3.412 4.513 1.00 0.00 H new ATOM 0 HG23 THR A 125 10.004 3.609 5.134 1.00 0.00 H new ATOM 1946 N VAL A 126 7.200 5.854 6.550 1.00 0.00 N ATOM 1947 CA VAL A 126 6.212 6.685 5.878 1.00 0.00 C ATOM 1948 C VAL A 126 6.838 7.488 4.739 1.00 0.00 C ATOM 1949 O VAL A 126 7.926 8.044 4.882 1.00 0.00 O ATOM 1950 CB VAL A 126 5.534 7.649 6.869 1.00 0.00 C ATOM 1951 CG1 VAL A 126 6.521 8.692 7.373 1.00 0.00 C ATOM 1952 CG2 VAL A 126 4.324 8.312 6.228 1.00 0.00 C ATOM 0 H VAL A 126 7.933 6.376 7.030 1.00 0.00 H new ATOM 0 HA VAL A 126 5.462 6.013 5.462 1.00 0.00 H new ATOM 0 HB VAL A 126 5.191 7.070 7.727 1.00 0.00 H new ATOM 0 HG11 VAL A 126 6.018 9.361 8.071 1.00 0.00 H new ATOM 0 HG12 VAL A 126 7.349 8.195 7.879 1.00 0.00 H new ATOM 0 HG13 VAL A 126 6.904 9.268 6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 126 3.858 8.989 6.944 1.00 0.00 H new ATOM 0 HG22 VAL A 126 4.640 8.874 5.349 1.00 0.00 H new ATOM 0 HG23 VAL A 126 3.605 7.548 5.931 1.00 0.00 H new ATOM 1962 N CYS A 127 6.138 7.544 3.609 1.00 0.00 N ATOM 1963 CA CYS A 127 6.620 8.280 2.447 1.00 0.00 C ATOM 1964 C CYS A 127 5.774 9.526 2.203 1.00 0.00 C ATOM 1965 O CYS A 127 4.586 9.432 1.895 1.00 0.00 O ATOM 1966 CB CYS A 127 6.598 7.385 1.206 1.00 0.00 C ATOM 1967 SG CYS A 127 7.508 8.058 -0.205 1.00 0.00 S ATOM 0 H CYS A 127 5.235 7.088 3.475 1.00 0.00 H new ATOM 0 HA CYS A 127 7.646 8.591 2.645 1.00 0.00 H new ATOM 0 HB2 CYS A 127 7.017 6.413 1.465 1.00 0.00 H new ATOM 0 HB3 CYS A 127 5.562 7.217 0.910 1.00 0.00 H new ATOM 0 HG CYS A 127 8.764 7.741 -0.102 1.00 0.00 H new ATOM 1973 N ASP A 128 6.394 10.695 2.345 1.00 0.00 N ATOM 1974 CA ASP A 128 5.695 11.959 2.140 1.00 0.00 C ATOM 1975 C ASP A 128 6.491 12.875 1.219 1.00 0.00 C ATOM 1976 O ASP A 128 7.721 12.839 1.202 1.00 0.00 O ATOM 1977 CB ASP A 128 5.447 12.654 3.479 1.00 0.00 C ATOM 1978 CG ASP A 128 4.421 13.764 3.372 1.00 0.00 C ATOM 1979 OD1 ASP A 128 4.629 14.688 2.558 1.00 0.00 O ATOM 1980 OD2 ASP A 128 3.408 13.709 4.101 1.00 0.00 O ATOM 0 H ASP A 128 7.377 10.792 2.601 1.00 0.00 H new ATOM 0 HA ASP A 128 4.736 11.743 1.670 1.00 0.00 H new ATOM 0 HB2 ASP A 128 5.109 11.919 4.210 1.00 0.00 H new ATOM 0 HB3 ASP A 128 6.385 13.065 3.851 1.00 0.00 H new ATOM 1985 N TYR A 129 5.782 13.698 0.451 1.00 0.00 N ATOM 1986 CA TYR A 129 6.429 14.622 -0.469 1.00 0.00 C ATOM 1987 C TYR A 129 7.033 15.798 0.288 1.00 0.00 C ATOM 1988 O TYR A 129 6.426 16.864 0.389 1.00 0.00 O ATOM 1989 CB TYR A 129 5.440 15.131 -1.519 1.00 0.00 C ATOM 1990 CG TYR A 129 5.046 14.091 -2.548 1.00 0.00 C ATOM 1991 CD1 TYR A 129 4.630 12.821 -2.163 1.00 0.00 C ATOM 1992 CD2 TYR A 129 5.091 14.381 -3.906 1.00 0.00 C ATOM 1993 CE1 TYR A 129 4.270 11.873 -3.102 1.00 0.00 C ATOM 1994 CE2 TYR A 129 4.732 13.437 -4.850 1.00 0.00 C ATOM 1995 CZ TYR A 129 4.324 12.185 -4.443 1.00 0.00 C ATOM 1996 OH TYR A 129 3.967 11.244 -5.380 1.00 0.00 O ATOM 0 H TYR A 129 4.763 13.742 0.449 1.00 0.00 H new ATOM 0 HA TYR A 129 7.227 14.082 -0.978 1.00 0.00 H new ATOM 0 HB2 TYR A 129 4.542 15.487 -1.015 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.879 15.987 -2.032 1.00 0.00 H new ATOM 0 HD1 TYR A 129 4.588 12.572 -1.113 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.412 15.360 -4.230 1.00 0.00 H new ATOM 0 HE1 TYR A 129 3.948 10.892 -2.786 1.00 0.00 H new ATOM 0 HE2 TYR A 129 4.771 13.679 -5.902 1.00 0.00 H new ATOM 0 HH TYR A 129 4.060 11.625 -6.278 1.00 0.00 H new ATOM 2006 N THR A 130 8.238 15.598 0.807 1.00 0.00 N ATOM 2007 CA THR A 130 8.937 16.644 1.544 1.00 0.00 C ATOM 2008 C THR A 130 9.701 17.534 0.576 1.00 0.00 C ATOM 2009 O THR A 130 9.553 18.758 0.580 1.00 0.00 O ATOM 2010 CB THR A 130 9.899 16.029 2.562 1.00 0.00 C ATOM 2011 OG1 THR A 130 10.753 15.087 1.940 1.00 0.00 O ATOM 2012 CG2 THR A 130 9.193 15.326 3.703 1.00 0.00 C ATOM 0 H THR A 130 8.752 14.720 0.731 1.00 0.00 H new ATOM 0 HA THR A 130 8.203 17.245 2.080 1.00 0.00 H new ATOM 0 HB THR A 130 10.466 16.867 2.967 1.00 0.00 H new ATOM 0 HG1 THR A 130 11.362 14.706 2.607 1.00 0.00 H new ATOM 0 HG21 THR A 130 9.932 14.912 4.389 1.00 0.00 H new ATOM 0 HG22 THR A 130 8.563 16.039 4.235 1.00 0.00 H new ATOM 0 HG23 THR A 130 8.575 14.520 3.307 1.00 0.00 H new ATOM 2020 N ASN A 131 10.501 16.901 -0.269 1.00 0.00 N ATOM 2021 CA ASN A 131 11.281 17.605 -1.273 1.00 0.00 C ATOM 2022 C ASN A 131 11.052 16.964 -2.638 1.00 0.00 C ATOM 2023 O ASN A 131 11.996 16.559 -3.316 1.00 0.00 O ATOM 2024 CB ASN A 131 12.769 17.574 -0.915 1.00 0.00 C ATOM 2025 CG ASN A 131 13.205 18.810 -0.154 1.00 0.00 C ATOM 2026 OD1 ASN A 131 12.520 19.264 0.764 1.00 0.00 O ATOM 2027 ND2 ASN A 131 14.354 19.362 -0.530 1.00 0.00 N ATOM 0 H ASN A 131 10.627 15.889 -0.277 1.00 0.00 H new ATOM 0 HA ASN A 131 10.960 18.646 -1.307 1.00 0.00 H new ATOM 0 HB2 ASN A 131 12.977 16.688 -0.315 1.00 0.00 H new ATOM 0 HB3 ASN A 131 13.358 17.486 -1.828 1.00 0.00 H new ATOM 0 HD21 ASN A 131 14.700 20.194 -0.053 1.00 0.00 H new ATOM 0 HD22 ASN A 131 14.890 18.953 -1.296 1.00 0.00 H new ATOM 2034 N PRO A 132 9.776 16.853 -3.055 1.00 0.00 N ATOM 2035 CA PRO A 132 9.402 16.249 -4.333 1.00 0.00 C ATOM 2036 C PRO A 132 10.255 16.761 -5.484 1.00 0.00 C ATOM 2037 O PRO A 132 10.481 16.058 -6.470 1.00 0.00 O ATOM 2038 CB PRO A 132 7.932 16.659 -4.525 1.00 0.00 C ATOM 2039 CG PRO A 132 7.631 17.622 -3.420 1.00 0.00 C ATOM 2040 CD PRO A 132 8.594 17.302 -2.316 1.00 0.00 C ATOM 0 HA PRO A 132 9.550 15.169 -4.325 1.00 0.00 H new ATOM 0 HB2 PRO A 132 7.779 17.122 -5.500 1.00 0.00 H new ATOM 0 HB3 PRO A 132 7.274 15.791 -4.478 1.00 0.00 H new ATOM 0 HG2 PRO A 132 7.752 18.652 -3.757 1.00 0.00 H new ATOM 0 HG3 PRO A 132 6.600 17.517 -3.081 1.00 0.00 H new ATOM 0 HD2 PRO A 132 8.808 18.174 -1.697 1.00 0.00 H new ATOM 0 HD3 PRO A 132 8.210 16.527 -1.653 1.00 0.00 H new ATOM 2048 N CYS A 133 10.728 17.991 -5.347 1.00 0.00 N ATOM 2049 CA CYS A 133 11.565 18.612 -6.371 1.00 0.00 C ATOM 2050 C CYS A 133 12.684 17.670 -6.804 1.00 0.00 C ATOM 2051 O CYS A 133 12.979 17.542 -7.992 1.00 0.00 O ATOM 2052 CB CYS A 133 12.158 19.923 -5.849 1.00 0.00 C ATOM 2053 SG CYS A 133 12.218 21.246 -7.079 1.00 0.00 S ATOM 0 H CYS A 133 10.548 18.582 -4.536 1.00 0.00 H new ATOM 0 HA CYS A 133 10.939 18.825 -7.237 1.00 0.00 H new ATOM 0 HB2 CYS A 133 11.570 20.261 -4.996 1.00 0.00 H new ATOM 0 HB3 CYS A 133 13.168 19.733 -5.485 1.00 0.00 H new ATOM 0 HG CYS A 133 12.732 22.313 -6.544 1.00 0.00 H new ATOM 2059 N THR A 134 13.297 17.010 -5.828 1.00 0.00 N ATOM 2060 CA THR A 134 14.382 16.073 -6.099 1.00 0.00 C ATOM 2061 C THR A 134 14.036 14.676 -5.589 1.00 0.00 C ATOM 2062 O THR A 134 14.488 13.673 -6.142 1.00 0.00 O ATOM 2063 CB THR A 134 15.679 16.559 -5.451 1.00 0.00 C ATOM 2064 OG1 THR A 134 15.580 16.523 -4.038 1.00 0.00 O ATOM 2065 CG2 THR A 134 16.054 17.970 -5.849 1.00 0.00 C ATOM 0 H THR A 134 13.061 17.106 -4.840 1.00 0.00 H new ATOM 0 HA THR A 134 14.522 16.021 -7.179 1.00 0.00 H new ATOM 0 HB THR A 134 16.452 15.879 -5.809 1.00 0.00 H new ATOM 0 HG1 THR A 134 16.421 16.836 -3.643 1.00 0.00 H new ATOM 0 HG21 THR A 134 16.983 18.253 -5.354 1.00 0.00 H new ATOM 0 HG22 THR A 134 16.188 18.020 -6.930 1.00 0.00 H new ATOM 0 HG23 THR A 134 15.261 18.655 -5.550 1.00 0.00 H new ATOM 2073 N LYS A 135 13.227 14.618 -4.535 1.00 0.00 N ATOM 2074 CA LYS A 135 12.814 13.346 -3.953 1.00 0.00 C ATOM 2075 C LYS A 135 11.779 12.643 -4.832 1.00 0.00 C ATOM 2076 O LYS A 135 11.375 11.519 -4.541 1.00 0.00 O ATOM 2077 CB LYS A 135 12.243 13.565 -2.549 1.00 0.00 C ATOM 2078 CG LYS A 135 13.306 13.616 -1.464 1.00 0.00 C ATOM 2079 CD LYS A 135 12.686 13.626 -0.077 1.00 0.00 C ATOM 2080 CE LYS A 135 13.667 13.138 0.977 1.00 0.00 C ATOM 2081 NZ LYS A 135 13.003 12.300 2.012 1.00 0.00 N ATOM 0 H LYS A 135 12.844 15.439 -4.066 1.00 0.00 H new ATOM 0 HA LYS A 135 13.695 12.708 -3.887 1.00 0.00 H new ATOM 0 HB2 LYS A 135 11.677 14.497 -2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 135 11.541 12.763 -2.322 1.00 0.00 H new ATOM 0 HG2 LYS A 135 13.968 12.756 -1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 135 13.920 14.507 -1.596 1.00 0.00 H new ATOM 0 HD2 LYS A 135 12.359 14.636 0.169 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.798 12.993 -0.070 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.458 12.562 0.497 1.00 0.00 H new ATOM 0 HE3 LYS A 135 14.142 13.995 1.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 13.725 11.864 2.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.375 12.895 2.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 12.445 11.554 1.549 1.00 0.00 H new ATOM 2095 N SER A 136 11.348 13.312 -5.905 1.00 0.00 N ATOM 2096 CA SER A 136 10.357 12.745 -6.819 1.00 0.00 C ATOM 2097 C SER A 136 10.682 11.295 -7.175 1.00 0.00 C ATOM 2098 O SER A 136 9.790 10.511 -7.496 1.00 0.00 O ATOM 2099 CB SER A 136 10.276 13.587 -8.095 1.00 0.00 C ATOM 2100 OG SER A 136 9.615 12.882 -9.131 1.00 0.00 O ATOM 0 H SER A 136 11.670 14.245 -6.160 1.00 0.00 H new ATOM 0 HA SER A 136 9.393 12.758 -6.311 1.00 0.00 H new ATOM 0 HB2 SER A 136 9.746 14.516 -7.888 1.00 0.00 H new ATOM 0 HB3 SER A 136 11.281 13.859 -8.419 1.00 0.00 H new ATOM 0 HG SER A 136 9.575 13.442 -9.934 1.00 0.00 H new ATOM 2106 N TRP A 137 11.965 10.942 -7.115 1.00 0.00 N ATOM 2107 CA TRP A 137 12.401 9.585 -7.431 1.00 0.00 C ATOM 2108 C TRP A 137 11.883 8.575 -6.405 1.00 0.00 C ATOM 2109 O TRP A 137 12.019 7.366 -6.597 1.00 0.00 O ATOM 2110 CB TRP A 137 13.928 9.520 -7.496 1.00 0.00 C ATOM 2111 CG TRP A 137 14.506 10.272 -8.657 1.00 0.00 C ATOM 2112 CD1 TRP A 137 14.657 11.624 -8.763 1.00 0.00 C ATOM 2113 CD2 TRP A 137 15.008 9.714 -9.876 1.00 0.00 C ATOM 2114 NE1 TRP A 137 15.224 11.941 -9.975 1.00 0.00 N ATOM 2115 CE2 TRP A 137 15.448 10.785 -10.675 1.00 0.00 C ATOM 2116 CE3 TRP A 137 15.129 8.410 -10.369 1.00 0.00 C ATOM 2117 CZ2 TRP A 137 15.999 10.593 -11.940 1.00 0.00 C ATOM 2118 CZ3 TRP A 137 15.677 8.221 -11.623 1.00 0.00 C ATOM 2119 CH2 TRP A 137 16.107 9.308 -12.397 1.00 0.00 C ATOM 0 H TRP A 137 12.719 11.576 -6.851 1.00 0.00 H new ATOM 0 HA TRP A 137 11.985 9.324 -8.404 1.00 0.00 H new ATOM 0 HB2 TRP A 137 14.341 9.921 -6.571 1.00 0.00 H new ATOM 0 HB3 TRP A 137 14.238 8.477 -7.558 1.00 0.00 H new ATOM 0 HD1 TRP A 137 14.373 12.340 -8.006 1.00 0.00 H new ATOM 0 HE1 TRP A 137 15.442 12.883 -10.300 1.00 0.00 H new ATOM 0 HE3 TRP A 137 14.800 7.567 -9.780 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 16.329 11.429 -12.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 15.776 7.219 -12.014 1.00 0.00 H new ATOM 0 HH2 TRP A 137 16.532 9.127 -13.373 1.00 0.00 H new ATOM 2130 N PHE A 138 11.292 9.071 -5.317 1.00 0.00 N ATOM 2131 CA PHE A 138 10.758 8.207 -4.265 1.00 0.00 C ATOM 2132 C PHE A 138 9.967 7.041 -4.854 1.00 0.00 C ATOM 2133 O PHE A 138 9.912 5.959 -4.270 1.00 0.00 O ATOM 2134 CB PHE A 138 9.868 9.018 -3.317 1.00 0.00 C ATOM 2135 CG PHE A 138 10.414 9.121 -1.920 1.00 0.00 C ATOM 2136 CD1 PHE A 138 10.959 8.012 -1.291 1.00 0.00 C ATOM 2137 CD2 PHE A 138 10.382 10.326 -1.236 1.00 0.00 C ATOM 2138 CE1 PHE A 138 11.461 8.105 -0.007 1.00 0.00 C ATOM 2139 CE2 PHE A 138 10.883 10.424 0.047 1.00 0.00 C ATOM 2140 CZ PHE A 138 11.423 9.312 0.663 1.00 0.00 C ATOM 0 H PHE A 138 11.171 10.069 -5.142 1.00 0.00 H new ATOM 0 HA PHE A 138 11.600 7.798 -3.707 1.00 0.00 H new ATOM 0 HB2 PHE A 138 9.739 10.021 -3.723 1.00 0.00 H new ATOM 0 HB3 PHE A 138 8.880 8.560 -3.279 1.00 0.00 H new ATOM 0 HD1 PHE A 138 10.991 7.066 -1.810 1.00 0.00 H new ATOM 0 HD2 PHE A 138 9.960 11.199 -1.712 1.00 0.00 H new ATOM 0 HE1 PHE A 138 11.883 7.234 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 138 10.853 11.369 0.568 1.00 0.00 H new ATOM 0 HZ PHE A 138 11.815 9.386 1.667 1.00 0.00 H new ATOM 2150 N TRP A 139 9.360 7.268 -6.016 1.00 0.00 N ATOM 2151 CA TRP A 139 8.578 6.232 -6.686 1.00 0.00 C ATOM 2152 C TRP A 139 9.391 4.949 -6.829 1.00 0.00 C ATOM 2153 O TRP A 139 8.838 3.849 -6.845 1.00 0.00 O ATOM 2154 CB TRP A 139 8.124 6.717 -8.063 1.00 0.00 C ATOM 2155 CG TRP A 139 6.902 7.583 -8.018 1.00 0.00 C ATOM 2156 CD1 TRP A 139 5.889 7.521 -7.105 1.00 0.00 C ATOM 2157 CD2 TRP A 139 6.565 8.640 -8.923 1.00 0.00 C ATOM 2158 NE1 TRP A 139 4.941 8.476 -7.389 1.00 0.00 N ATOM 2159 CE2 TRP A 139 5.334 9.175 -8.500 1.00 0.00 C ATOM 2160 CE3 TRP A 139 7.183 9.185 -10.052 1.00 0.00 C ATOM 2161 CZ2 TRP A 139 4.711 10.229 -9.164 1.00 0.00 C ATOM 2162 CZ3 TRP A 139 6.566 10.231 -10.711 1.00 0.00 C ATOM 2163 CH2 TRP A 139 5.341 10.744 -10.265 1.00 0.00 C ATOM 0 H TRP A 139 9.394 8.158 -6.513 1.00 0.00 H new ATOM 0 HA TRP A 139 7.700 6.021 -6.076 1.00 0.00 H new ATOM 0 HB2 TRP A 139 8.937 7.273 -8.530 1.00 0.00 H new ATOM 0 HB3 TRP A 139 7.924 5.853 -8.696 1.00 0.00 H new ATOM 0 HD1 TRP A 139 5.839 6.825 -6.281 1.00 0.00 H new ATOM 0 HE1 TRP A 139 4.085 8.638 -6.859 1.00 0.00 H new ATOM 0 HE3 TRP A 139 8.127 8.795 -10.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 139 3.766 10.625 -8.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 139 7.036 10.660 -11.584 1.00 0.00 H new ATOM 0 HH2 TRP A 139 4.884 11.563 -10.801 1.00 0.00 H new ATOM 2174 N THR A 140 10.707 5.100 -6.930 1.00 0.00 N ATOM 2175 CA THR A 140 11.603 3.957 -7.068 1.00 0.00 C ATOM 2176 C THR A 140 11.775 3.243 -5.731 1.00 0.00 C ATOM 2177 O THR A 140 11.792 2.014 -5.671 1.00 0.00 O ATOM 2178 CB THR A 140 12.963 4.412 -7.598 1.00 0.00 C ATOM 2179 OG1 THR A 140 12.821 5.069 -8.846 1.00 0.00 O ATOM 2180 CG2 THR A 140 13.944 3.277 -7.787 1.00 0.00 C ATOM 0 H THR A 140 11.178 6.005 -6.919 1.00 0.00 H new ATOM 0 HA THR A 140 11.161 3.259 -7.779 1.00 0.00 H new ATOM 0 HB THR A 140 13.356 5.087 -6.838 1.00 0.00 H new ATOM 0 HG1 THR A 140 13.702 5.354 -9.168 1.00 0.00 H new ATOM 0 HG21 THR A 140 14.887 3.671 -8.165 1.00 0.00 H new ATOM 0 HG22 THR A 140 14.115 2.781 -6.832 1.00 0.00 H new ATOM 0 HG23 THR A 140 13.538 2.560 -8.501 1.00 0.00 H new ATOM 2188 N ARG A 141 11.900 4.023 -4.662 1.00 0.00 N ATOM 2189 CA ARG A 141 12.069 3.467 -3.323 1.00 0.00 C ATOM 2190 C ARG A 141 10.930 2.511 -2.984 1.00 0.00 C ATOM 2191 O ARG A 141 11.159 1.394 -2.522 1.00 0.00 O ATOM 2192 CB ARG A 141 12.134 4.590 -2.286 1.00 0.00 C ATOM 2193 CG ARG A 141 13.282 5.560 -2.511 1.00 0.00 C ATOM 2194 CD ARG A 141 14.514 5.164 -1.712 1.00 0.00 C ATOM 2195 NE ARG A 141 14.972 6.247 -0.844 1.00 0.00 N ATOM 2196 CZ ARG A 141 15.909 6.102 0.090 1.00 0.00 C ATOM 2197 NH1 ARG A 141 16.487 4.923 0.283 1.00 0.00 N ATOM 2198 NH2 ARG A 141 16.267 7.139 0.835 1.00 0.00 N ATOM 0 H ARG A 141 11.888 5.042 -4.696 1.00 0.00 H new ATOM 0 HA ARG A 141 13.005 2.910 -3.303 1.00 0.00 H new ATOM 0 HB2 ARG A 141 11.194 5.142 -2.301 1.00 0.00 H new ATOM 0 HB3 ARG A 141 12.230 4.151 -1.293 1.00 0.00 H new ATOM 0 HG2 ARG A 141 13.530 5.591 -3.572 1.00 0.00 H new ATOM 0 HG3 ARG A 141 12.971 6.565 -2.227 1.00 0.00 H new ATOM 0 HD2 ARG A 141 14.288 4.285 -1.108 1.00 0.00 H new ATOM 0 HD3 ARG A 141 15.315 4.883 -2.396 1.00 0.00 H new ATOM 0 HE ARG A 141 14.549 7.168 -0.961 1.00 0.00 H new ATOM 0 HH11 ARG A 141 16.214 4.122 -0.286 1.00 0.00 H new ATOM 0 HH12 ARG A 141 17.205 4.818 1.000 1.00 0.00 H new ATOM 0 HH21 ARG A 141 15.824 8.047 0.692 1.00 0.00 H new ATOM 0 HH22 ARG A 141 16.985 7.029 1.551 1.00 0.00 H new ATOM 2212 N LEU A 142 9.701 2.958 -3.220 1.00 0.00 N ATOM 2213 CA LEU A 142 8.526 2.143 -2.946 1.00 0.00 C ATOM 2214 C LEU A 142 8.396 1.030 -3.981 1.00 0.00 C ATOM 2215 O LEU A 142 8.001 -0.092 -3.658 1.00 0.00 O ATOM 2216 CB LEU A 142 7.264 3.011 -2.942 1.00 0.00 C ATOM 2217 CG LEU A 142 6.431 2.935 -1.662 1.00 0.00 C ATOM 2218 CD1 LEU A 142 5.804 1.558 -1.514 1.00 0.00 C ATOM 2219 CD2 LEU A 142 7.288 3.266 -0.449 1.00 0.00 C ATOM 0 H LEU A 142 9.494 3.881 -3.601 1.00 0.00 H new ATOM 0 HA LEU A 142 8.642 1.691 -1.961 1.00 0.00 H new ATOM 0 HB2 LEU A 142 7.554 4.048 -3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 142 6.637 2.717 -3.784 1.00 0.00 H new ATOM 0 HG LEU A 142 5.630 3.671 -1.728 1.00 0.00 H new ATOM 0 HD11 LEU A 142 5.215 1.523 -0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 142 5.157 1.359 -2.369 1.00 0.00 H new ATOM 0 HD13 LEU A 142 6.589 0.803 -1.470 1.00 0.00 H new ATOM 0 HD21 LEU A 142 6.679 3.207 0.453 1.00 0.00 H new ATOM 0 HD22 LEU A 142 8.110 2.554 -0.379 1.00 0.00 H new ATOM 0 HD23 LEU A 142 7.689 4.274 -0.551 1.00 0.00 H new ATOM 2231 N ALA A 143 8.734 1.349 -5.225 1.00 0.00 N ATOM 2232 CA ALA A 143 8.663 0.379 -6.310 1.00 0.00 C ATOM 2233 C ALA A 143 9.613 -0.786 -6.063 1.00 0.00 C ATOM 2234 O ALA A 143 9.304 -1.933 -6.385 1.00 0.00 O ATOM 2235 CB ALA A 143 8.978 1.048 -7.640 1.00 0.00 C ATOM 0 H ALA A 143 9.060 2.273 -5.507 1.00 0.00 H new ATOM 0 HA ALA A 143 7.647 -0.014 -6.348 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.921 0.311 -8.441 1.00 0.00 H new ATOM 0 HB2 ALA A 143 8.257 1.843 -7.827 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.982 1.470 -7.606 1.00 0.00 H new ATOM 2241 N LYS A 144 10.772 -0.485 -5.486 1.00 0.00 N ATOM 2242 CA LYS A 144 11.768 -1.508 -5.194 1.00 0.00 C ATOM 2243 C LYS A 144 11.487 -2.173 -3.848 1.00 0.00 C ATOM 2244 O LYS A 144 11.861 -3.325 -3.626 1.00 0.00 O ATOM 2245 CB LYS A 144 13.175 -0.904 -5.200 1.00 0.00 C ATOM 2246 CG LYS A 144 13.430 0.075 -4.064 1.00 0.00 C ATOM 2247 CD LYS A 144 14.780 -0.166 -3.409 1.00 0.00 C ATOM 2248 CE LYS A 144 14.720 -1.315 -2.415 1.00 0.00 C ATOM 2249 NZ LYS A 144 15.905 -1.334 -1.515 1.00 0.00 N ATOM 0 H LYS A 144 11.044 0.459 -5.212 1.00 0.00 H new ATOM 0 HA LYS A 144 11.709 -2.268 -5.973 1.00 0.00 H new ATOM 0 HB2 LYS A 144 13.906 -1.710 -5.143 1.00 0.00 H new ATOM 0 HB3 LYS A 144 13.337 -0.394 -6.150 1.00 0.00 H new ATOM 0 HG2 LYS A 144 13.387 1.095 -4.446 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.641 -0.019 -3.318 1.00 0.00 H new ATOM 0 HD2 LYS A 144 15.523 -0.385 -4.175 1.00 0.00 H new ATOM 0 HD3 LYS A 144 15.105 0.741 -2.899 1.00 0.00 H new ATOM 0 HE2 LYS A 144 13.812 -1.231 -1.818 1.00 0.00 H new ATOM 0 HE3 LYS A 144 14.660 -2.260 -2.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 15.825 -2.132 -0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 16.770 -1.440 -2.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 15.949 -0.443 -0.980 1.00 0.00 H new ATOM 2263 N ALA A 145 10.824 -1.443 -2.954 1.00 0.00 N ATOM 2264 CA ALA A 145 10.495 -1.970 -1.636 1.00 0.00 C ATOM 2265 C ALA A 145 9.151 -2.697 -1.639 1.00 0.00 C ATOM 2266 O ALA A 145 8.735 -3.258 -0.626 1.00 0.00 O ATOM 2267 CB ALA A 145 10.499 -0.868 -0.591 1.00 0.00 C ATOM 0 H ALA A 145 10.506 -0.488 -3.119 1.00 0.00 H new ATOM 0 HA ALA A 145 11.267 -2.695 -1.377 1.00 0.00 H new ATOM 0 HB1 ALA A 145 10.250 -1.289 0.383 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.488 -0.412 -0.547 1.00 0.00 H new ATOM 0 HB3 ALA A 145 9.762 -0.111 -0.858 1.00 0.00 H new ATOM 2273 N LEU A 146 8.475 -2.686 -2.780 1.00 0.00 N ATOM 2274 CA LEU A 146 7.185 -3.354 -2.905 1.00 0.00 C ATOM 2275 C LEU A 146 7.361 -4.874 -2.957 1.00 0.00 C ATOM 2276 O LEU A 146 6.385 -5.621 -2.941 1.00 0.00 O ATOM 2277 CB LEU A 146 6.448 -2.860 -4.154 1.00 0.00 C ATOM 2278 CG LEU A 146 5.074 -2.236 -3.894 1.00 0.00 C ATOM 2279 CD1 LEU A 146 5.148 -1.217 -2.767 1.00 0.00 C ATOM 2280 CD2 LEU A 146 4.537 -1.590 -5.162 1.00 0.00 C ATOM 0 H LEU A 146 8.797 -2.224 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 146 6.588 -3.110 -2.026 1.00 0.00 H new ATOM 0 HB2 LEU A 146 7.074 -2.124 -4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 146 6.325 -3.698 -4.840 1.00 0.00 H new ATOM 0 HG LEU A 146 4.390 -3.029 -3.591 1.00 0.00 H new ATOM 0 HD11 LEU A 146 4.160 -0.787 -2.600 1.00 0.00 H new ATOM 0 HD12 LEU A 146 5.489 -1.707 -1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 146 5.847 -0.426 -3.037 1.00 0.00 H new ATOM 0 HD21 LEU A 146 3.560 -1.151 -4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 146 5.224 -0.811 -5.492 1.00 0.00 H new ATOM 0 HD23 LEU A 146 4.442 -2.345 -5.943 1.00 0.00 H new ATOM 2292 N SER A 147 8.615 -5.319 -3.019 1.00 0.00 N ATOM 2293 CA SER A 147 8.929 -6.741 -3.071 1.00 0.00 C ATOM 2294 C SER A 147 10.416 -6.960 -2.812 1.00 0.00 C ATOM 2295 O SER A 147 11.071 -7.743 -3.500 1.00 0.00 O ATOM 2296 CB SER A 147 8.539 -7.326 -4.428 1.00 0.00 C ATOM 2297 OG SER A 147 7.947 -8.605 -4.284 1.00 0.00 O ATOM 0 H SER A 147 9.432 -4.709 -3.034 1.00 0.00 H new ATOM 0 HA SER A 147 8.357 -7.251 -2.296 1.00 0.00 H new ATOM 0 HB2 SER A 147 7.842 -6.654 -4.930 1.00 0.00 H new ATOM 0 HB3 SER A 147 9.422 -7.401 -5.062 1.00 0.00 H new ATOM 0 HG SER A 147 7.706 -8.955 -5.167 1.00 0.00 H new