USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1185 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 176 THR OG1 : rot 137:sc= 0.36 USER MOD Set 1.2: A 178 HIS : no HE2:sc= -0.326 K(o=0.034,f=-3.9) USER MOD Set 2.1: A 170 GLN : amide:sc= -2.51! K(o=-2!,f=0.57) USER MOD Set 2.2: A 173 THR OG1 : rot 28:sc= 0.516 USER MOD Set 3.1: A 106 SER OG : rot 74:sc= -0.225 USER MOD Set 3.2: A 125 HIS : no HD1:sc= -3.75! C(o=-4!,f=-2.8!) USER MOD Set 4.1: A 39 CYS SG : rot 32:sc= 0.896 USER MOD Set 4.2: A 46 SER OG : rot 26:sc= 0.289 USER MOD Set 5.1: A 40 HIS : no HD1:sc= -1.59 X(o=-2.1,f=-2.4) USER MOD Set 5.2: A 45 GLN : amide:sc= -0.465 K(o=-2.1,f=-3.8) USER MOD Set 6.1: A 34 ASN : amide:sc= -0.526 K(o=-1.7,f=1.1) USER MOD Set 6.2: A 35 GLN : amide:sc= -1.14 K(o=-1.7,f=1.1) USER MOD Single : A 7 CYS SG : rot 180:sc= -0.222 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 149:sc= 0.14 USER MOD Single : A 55 GLN : amide:sc= -0.15 K(o=-0.15,f=-2.2!) USER MOD Single : A 57 HIS : no HD1:sc= -0.119 K(o=-0.12,f=-0.97) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.0242 X(o=-0.024,f=-0.024) USER MOD Single : A 75 GLN : amide:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : A 81 HIS : no HD1:sc= -2.27 K(o=-2.3,f=-3.4!) USER MOD Single : A 84 SER OG : rot 55:sc= 0.634 USER MOD Single : A 86 GLN : amide:sc= 0.104 X(o=0.1,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0.0844 USER MOD Single : A 92 ASN : amide:sc= -0.05 X(o=-0.05,f=-0.035) USER MOD Single : A 99 CYS SG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc=-0.00236 X(o=-0.0024,f=0) USER MOD Single : A 108 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0167) USER MOD Single : A 109 GLN : amide:sc= -1.81 X(o=-1.8,f=-1.3) USER MOD Single : A 110 GLN : amide:sc= -0.165 K(o=-0.17,f=-1.6) USER MOD Single : A 120 LYS NZ :NH3+ -131:sc= -0.0249 (180deg=-0.618) USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.155 USER MOD Single : A 126 GLN : amide:sc= -0.0605 X(o=-0.06,f=-0.38) USER MOD Single : A 133 GLN : amide:sc= -0.222 K(o=-0.22,f=-0.88) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.0691 K(o=-0.069,f=-1.2) USER MOD Single : A 136 THR OG1 : rot 23:sc= 0.0811 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.0448 X(o=-0.045,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0.046) USER MOD Single : A 164 SER OG : rot 180:sc= 0.294 USER MOD Single : A 174 SER OG : rot -160:sc= -0.351 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 3.399 16.062 -6.359 1.00 0.00 N ATOM 64 CA ARG A 5 4.083 16.085 -5.070 1.00 0.00 C ATOM 65 C ARG A 5 4.703 14.725 -4.763 1.00 0.00 C ATOM 66 O ARG A 5 4.046 13.845 -4.201 1.00 0.00 O ATOM 67 CB ARG A 5 3.109 16.479 -3.957 1.00 0.00 C ATOM 68 CG ARG A 5 3.742 16.536 -2.574 1.00 0.00 C ATOM 69 CD ARG A 5 2.689 16.552 -1.476 1.00 0.00 C ATOM 70 NE ARG A 5 2.944 17.595 -0.481 1.00 0.00 N ATOM 71 CZ ARG A 5 2.023 18.066 0.363 1.00 0.00 C ATOM 72 NH1 ARG A 5 0.780 17.587 0.351 1.00 0.00 N ATOM 73 NH2 ARG A 5 2.345 19.021 1.228 1.00 0.00 N ATOM 0 HA ARG A 5 4.880 16.826 -5.122 1.00 0.00 H new ATOM 0 HB2 ARG A 5 2.681 17.454 -4.190 1.00 0.00 H new ATOM 0 HB3 ARG A 5 2.285 15.766 -3.939 1.00 0.00 H new ATOM 0 HG2 ARG A 5 4.398 15.676 -2.438 1.00 0.00 H new ATOM 0 HG3 ARG A 5 4.365 17.427 -2.495 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.706 16.708 -1.920 1.00 0.00 H new ATOM 0 HD3 ARG A 5 2.665 15.580 -0.983 1.00 0.00 H new ATOM 0 HE ARG A 5 3.884 17.987 -0.429 1.00 0.00 H new ATOM 0 HH11 ARG A 5 0.523 16.852 -0.308 1.00 0.00 H new ATOM 0 HH12 ARG A 5 0.085 17.955 1.001 1.00 0.00 H new ATOM 0 HH21 ARG A 5 3.294 19.393 1.247 1.00 0.00 H new ATOM 0 HH22 ARG A 5 1.643 19.382 1.874 1.00 0.00 H new ATOM 87 N ASP A 6 5.970 14.562 -5.132 1.00 0.00 N ATOM 88 CA ASP A 6 6.686 13.311 -4.892 1.00 0.00 C ATOM 89 C ASP A 6 7.370 13.332 -3.524 1.00 0.00 C ATOM 90 O ASP A 6 8.160 14.229 -3.228 1.00 0.00 O ATOM 91 CB ASP A 6 7.719 13.051 -5.997 1.00 0.00 C ATOM 92 CG ASP A 6 8.772 14.140 -6.086 1.00 0.00 C ATOM 93 OD1 ASP A 6 8.448 15.240 -6.584 1.00 0.00 O ATOM 94 OD2 ASP A 6 9.919 13.894 -5.657 1.00 0.00 O ATOM 0 H ASP A 6 6.523 15.281 -5.599 1.00 0.00 H new ATOM 0 HA ASP A 6 5.957 12.501 -4.904 1.00 0.00 H new ATOM 0 HB2 ASP A 6 8.207 12.094 -5.814 1.00 0.00 H new ATOM 0 HB3 ASP A 6 7.206 12.969 -6.955 1.00 0.00 H new ATOM 99 N CYS A 7 7.053 12.344 -2.690 1.00 0.00 N ATOM 100 CA CYS A 7 7.627 12.250 -1.352 1.00 0.00 C ATOM 101 C CYS A 7 8.919 11.430 -1.360 1.00 0.00 C ATOM 102 O CYS A 7 8.977 10.355 -1.962 1.00 0.00 O ATOM 103 CB CYS A 7 6.618 11.623 -0.387 1.00 0.00 C ATOM 104 SG CYS A 7 5.585 12.826 0.482 1.00 0.00 S ATOM 0 H CYS A 7 6.399 11.595 -2.919 1.00 0.00 H new ATOM 0 HA CYS A 7 7.866 13.260 -1.018 1.00 0.00 H new ATOM 0 HB2 CYS A 7 5.974 10.941 -0.943 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.157 11.025 0.348 1.00 0.00 H new ATOM 0 HG CYS A 7 4.763 12.202 1.272 1.00 0.00 H new ATOM 110 N PRO A 8 9.974 11.930 -0.684 1.00 0.00 N ATOM 111 CA PRO A 8 11.271 11.244 -0.609 1.00 0.00 C ATOM 112 C PRO A 8 11.240 10.044 0.338 1.00 0.00 C ATOM 113 O PRO A 8 10.807 10.160 1.486 1.00 0.00 O ATOM 114 CB PRO A 8 12.209 12.328 -0.077 1.00 0.00 C ATOM 115 CG PRO A 8 11.331 13.219 0.733 1.00 0.00 C ATOM 116 CD PRO A 8 9.984 13.207 0.062 1.00 0.00 C ATOM 0 HA PRO A 8 11.575 10.833 -1.572 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.007 11.899 0.530 1.00 0.00 H new ATOM 0 HB3 PRO A 8 12.686 12.874 -0.891 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.257 12.862 1.760 1.00 0.00 H new ATOM 0 HG3 PRO A 8 11.736 14.230 0.775 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.174 13.252 0.790 1.00 0.00 H new ATOM 0 HD3 PRO A 8 9.861 14.061 -0.604 1.00 0.00 H new ATOM 124 N LEU A 9 11.702 8.894 -0.152 1.00 0.00 N ATOM 125 CA LEU A 9 11.726 7.672 0.646 1.00 0.00 C ATOM 126 C LEU A 9 13.163 7.249 0.945 1.00 0.00 C ATOM 127 O LEU A 9 13.931 6.950 0.031 1.00 0.00 O ATOM 128 CB LEU A 9 10.990 6.546 -0.084 1.00 0.00 C ATOM 129 CG LEU A 9 9.765 5.992 0.646 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.497 6.681 0.164 1.00 0.00 C ATOM 131 CD2 LEU A 9 9.666 4.486 0.453 1.00 0.00 C ATOM 0 H LEU A 9 12.065 8.785 -1.099 1.00 0.00 H new ATOM 0 HA LEU A 9 11.220 7.872 1.591 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.676 6.912 -1.062 1.00 0.00 H new ATOM 0 HB3 LEU A 9 11.690 5.729 -0.259 1.00 0.00 H new ATOM 0 HG LEU A 9 9.878 6.194 1.711 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.637 6.273 0.695 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.569 7.751 0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.376 6.513 -0.906 1.00 0.00 H new ATOM 0 HD21 LEU A 9 8.789 4.109 0.979 1.00 0.00 H new ATOM 0 HD22 LEU A 9 9.577 4.260 -0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 9 10.561 4.009 0.851 1.00 0.00 H new ATOM 143 N PHE A 10 13.518 7.228 2.232 1.00 0.00 N ATOM 144 CA PHE A 10 14.865 6.845 2.659 1.00 0.00 C ATOM 145 C PHE A 10 15.925 7.745 2.020 1.00 0.00 C ATOM 146 O PHE A 10 16.962 7.267 1.555 1.00 0.00 O ATOM 147 CB PHE A 10 15.143 5.378 2.311 1.00 0.00 C ATOM 148 CG PHE A 10 14.476 4.395 3.233 1.00 0.00 C ATOM 149 CD1 PHE A 10 13.094 4.315 3.302 1.00 0.00 C ATOM 150 CD2 PHE A 10 15.232 3.549 4.029 1.00 0.00 C ATOM 151 CE1 PHE A 10 12.481 3.412 4.149 1.00 0.00 C ATOM 152 CE2 PHE A 10 14.625 2.644 4.876 1.00 0.00 C ATOM 153 CZ PHE A 10 13.245 2.575 4.938 1.00 0.00 C ATOM 0 H PHE A 10 12.890 7.472 2.997 1.00 0.00 H new ATOM 0 HA PHE A 10 14.918 6.969 3.741 1.00 0.00 H new ATOM 0 HB2 PHE A 10 14.810 5.188 1.291 1.00 0.00 H new ATOM 0 HB3 PHE A 10 16.219 5.208 2.332 1.00 0.00 H new ATOM 0 HD1 PHE A 10 12.490 4.966 2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 10 16.310 3.599 3.986 1.00 0.00 H new ATOM 0 HE1 PHE A 10 11.403 3.361 4.194 1.00 0.00 H new ATOM 0 HE2 PHE A 10 15.227 1.990 5.490 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.767 1.869 5.601 1.00 0.00 H new ATOM 163 N GLY A 11 15.660 9.051 2.007 1.00 0.00 N ATOM 164 CA GLY A 11 16.602 9.998 1.431 1.00 0.00 C ATOM 165 C GLY A 11 16.356 10.298 -0.043 1.00 0.00 C ATOM 166 O GLY A 11 17.104 11.066 -0.649 1.00 0.00 O ATOM 0 H GLY A 11 14.810 9.470 2.385 1.00 0.00 H new ATOM 0 HA2 GLY A 11 16.554 10.930 1.994 1.00 0.00 H new ATOM 0 HA3 GLY A 11 17.612 9.606 1.548 1.00 0.00 H new ATOM 170 N GLY A 12 15.310 9.701 -0.623 1.00 0.00 N ATOM 171 CA GLY A 12 15.003 9.937 -2.026 1.00 0.00 C ATOM 172 C GLY A 12 15.177 8.701 -2.899 1.00 0.00 C ATOM 173 O GLY A 12 15.418 8.819 -4.100 1.00 0.00 O ATOM 0 H GLY A 12 14.674 9.061 -0.147 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.976 10.291 -2.111 1.00 0.00 H new ATOM 0 HA3 GLY A 12 15.646 10.732 -2.402 1.00 0.00 H new ATOM 177 N ALA A 13 15.042 7.513 -2.303 1.00 0.00 N ATOM 178 CA ALA A 13 15.177 6.260 -3.046 1.00 0.00 C ATOM 179 C ALA A 13 13.901 5.960 -3.831 1.00 0.00 C ATOM 180 O ALA A 13 13.949 5.385 -4.921 1.00 0.00 O ATOM 181 CB ALA A 13 15.505 5.111 -2.102 1.00 0.00 C ATOM 0 H ALA A 13 14.840 7.394 -1.310 1.00 0.00 H new ATOM 0 HA ALA A 13 15.998 6.369 -3.754 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.602 4.187 -2.673 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.443 5.319 -1.587 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.705 5.003 -1.369 1.00 0.00 H new ATOM 187 N PHE A 14 12.761 6.368 -3.272 1.00 0.00 N ATOM 188 CA PHE A 14 11.468 6.162 -3.912 1.00 0.00 C ATOM 189 C PHE A 14 10.678 7.466 -3.942 1.00 0.00 C ATOM 190 O PHE A 14 10.914 8.362 -3.127 1.00 0.00 O ATOM 191 CB PHE A 14 10.672 5.079 -3.180 1.00 0.00 C ATOM 192 CG PHE A 14 10.948 3.690 -3.683 1.00 0.00 C ATOM 193 CD1 PHE A 14 10.812 3.383 -5.029 1.00 0.00 C ATOM 194 CD2 PHE A 14 11.343 2.692 -2.809 1.00 0.00 C ATOM 195 CE1 PHE A 14 11.064 2.106 -5.490 1.00 0.00 C ATOM 196 CE2 PHE A 14 11.597 1.413 -3.265 1.00 0.00 C ATOM 197 CZ PHE A 14 11.457 1.120 -4.607 1.00 0.00 C ATOM 0 H PHE A 14 12.711 6.845 -2.372 1.00 0.00 H new ATOM 0 HA PHE A 14 11.640 5.832 -4.937 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.905 5.125 -2.116 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.607 5.289 -3.283 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.506 4.151 -5.724 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.454 2.916 -1.758 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.954 1.879 -6.540 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.905 0.643 -2.573 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.655 0.121 -4.966 1.00 0.00 H new ATOM 207 N SER A 15 9.741 7.569 -4.882 1.00 0.00 N ATOM 208 CA SER A 15 8.921 8.768 -5.013 1.00 0.00 C ATOM 209 C SER A 15 7.443 8.432 -4.860 1.00 0.00 C ATOM 210 O SER A 15 6.866 7.739 -5.701 1.00 0.00 O ATOM 211 CB SER A 15 9.175 9.444 -6.362 1.00 0.00 C ATOM 212 OG SER A 15 10.311 10.288 -6.302 1.00 0.00 O ATOM 0 H SER A 15 9.532 6.838 -5.562 1.00 0.00 H new ATOM 0 HA SER A 15 9.199 9.459 -4.218 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.322 8.685 -7.131 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.300 10.026 -6.651 1.00 0.00 H new ATOM 0 HG SER A 15 10.454 10.707 -7.176 1.00 0.00 H new ATOM 218 N ALA A 16 6.841 8.925 -3.778 1.00 0.00 N ATOM 219 CA ALA A 16 5.431 8.672 -3.501 1.00 0.00 C ATOM 220 C ALA A 16 4.570 9.886 -3.832 1.00 0.00 C ATOM 221 O ALA A 16 4.947 11.024 -3.563 1.00 0.00 O ATOM 222 CB ALA A 16 5.245 8.265 -2.048 1.00 0.00 C ATOM 0 H ALA A 16 7.310 9.502 -3.080 1.00 0.00 H new ATOM 0 HA ALA A 16 5.105 7.853 -4.142 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.189 8.079 -1.855 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.815 7.358 -1.848 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.597 9.066 -1.398 1.00 0.00 H new ATOM 228 N ILE A 17 3.407 9.627 -4.418 1.00 0.00 N ATOM 229 CA ILE A 17 2.483 10.687 -4.797 1.00 0.00 C ATOM 230 C ILE A 17 1.491 10.969 -3.673 1.00 0.00 C ATOM 231 O ILE A 17 0.701 10.100 -3.300 1.00 0.00 O ATOM 232 CB ILE A 17 1.702 10.334 -6.082 1.00 0.00 C ATOM 233 CG1 ILE A 17 2.503 9.378 -6.982 1.00 0.00 C ATOM 234 CG2 ILE A 17 1.339 11.598 -6.840 1.00 0.00 C ATOM 235 CD1 ILE A 17 3.926 9.829 -7.250 1.00 0.00 C ATOM 0 H ILE A 17 3.081 8.687 -4.642 1.00 0.00 H new ATOM 0 HA ILE A 17 3.084 11.576 -4.987 1.00 0.00 H new ATOM 0 HB ILE A 17 0.786 9.822 -5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 17 2.527 8.392 -6.517 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.982 9.269 -7.933 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.789 11.335 -7.744 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.718 12.235 -6.210 1.00 0.00 H new ATOM 0 HG23 ILE A 17 2.249 12.133 -7.112 1.00 0.00 H new ATOM 0 HD11 ILE A 17 4.423 9.102 -7.892 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.913 10.800 -7.745 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.466 9.910 -6.307 1.00 0.00 H new ATOM 247 N LEU A 18 1.536 12.186 -3.138 1.00 0.00 N ATOM 248 CA LEU A 18 0.642 12.585 -2.055 1.00 0.00 C ATOM 249 C LEU A 18 -0.207 13.790 -2.466 1.00 0.00 C ATOM 250 O LEU A 18 0.311 14.897 -2.624 1.00 0.00 O ATOM 251 CB LEU A 18 1.444 12.917 -0.789 1.00 0.00 C ATOM 252 CG LEU A 18 1.632 11.756 0.197 1.00 0.00 C ATOM 253 CD1 LEU A 18 0.293 11.125 0.547 1.00 0.00 C ATOM 254 CD2 LEU A 18 2.583 10.713 -0.372 1.00 0.00 C ATOM 0 H LEU A 18 2.184 12.915 -3.438 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.023 11.748 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 18 2.427 13.280 -1.088 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.946 13.736 -0.269 1.00 0.00 H new ATOM 0 HG LEU A 18 2.071 12.156 1.111 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.449 10.304 1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.354 11.874 1.004 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.178 10.744 -0.359 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.701 9.900 0.344 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.177 10.320 -1.304 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.553 11.171 -0.564 1.00 0.00 H new ATOM 266 N PRO A 19 -1.528 13.588 -2.649 1.00 0.00 N ATOM 267 CA PRO A 19 -2.448 14.664 -3.047 1.00 0.00 C ATOM 268 C PRO A 19 -2.612 15.727 -1.961 1.00 0.00 C ATOM 269 O PRO A 19 -2.190 15.529 -0.818 1.00 0.00 O ATOM 270 CB PRO A 19 -3.777 13.936 -3.278 1.00 0.00 C ATOM 271 CG PRO A 19 -3.678 12.689 -2.468 1.00 0.00 C ATOM 272 CD PRO A 19 -2.228 12.298 -2.484 1.00 0.00 C ATOM 0 HA PRO A 19 -2.081 15.202 -3.921 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -4.622 14.547 -2.961 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.925 13.710 -4.334 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -4.025 12.857 -1.449 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -4.300 11.899 -2.890 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -1.936 11.798 -1.561 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -2.006 11.613 -3.302 1.00 0.00 H new ATOM 280 N MET A 20 -3.233 16.852 -2.319 1.00 0.00 N ATOM 281 CA MET A 20 -3.460 17.937 -1.367 1.00 0.00 C ATOM 282 C MET A 20 -4.476 17.512 -0.310 1.00 0.00 C ATOM 283 O MET A 20 -5.687 17.632 -0.512 1.00 0.00 O ATOM 284 CB MET A 20 -3.943 19.199 -2.088 1.00 0.00 C ATOM 285 CG MET A 20 -3.349 20.485 -1.532 1.00 0.00 C ATOM 286 SD MET A 20 -4.063 20.949 0.059 1.00 0.00 S ATOM 287 CE MET A 20 -4.720 22.572 -0.321 1.00 0.00 C ATOM 0 H MET A 20 -3.586 17.034 -3.258 1.00 0.00 H new ATOM 0 HA MET A 20 -2.514 18.163 -0.875 1.00 0.00 H new ATOM 0 HB2 MET A 20 -3.693 19.121 -3.146 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.030 19.252 -2.021 1.00 0.00 H new ATOM 0 HG2 MET A 20 -2.271 20.365 -1.421 1.00 0.00 H new ATOM 0 HG3 MET A 20 -3.508 21.293 -2.247 1.00 0.00 H new ATOM 0 HE1 MET A 20 -5.194 22.990 0.567 1.00 0.00 H new ATOM 0 HE2 MET A 20 -3.910 23.227 -0.641 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.456 22.488 -1.120 1.00 0.00 H new ATOM 297 N GLY A 21 -3.974 17.004 0.812 1.00 0.00 N ATOM 298 CA GLY A 21 -4.841 16.551 1.886 1.00 0.00 C ATOM 299 C GLY A 21 -4.121 15.650 2.875 1.00 0.00 C ATOM 300 O GLY A 21 -4.440 15.645 4.064 1.00 0.00 O ATOM 0 H GLY A 21 -2.977 16.898 0.997 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.243 17.416 2.414 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.689 16.014 1.462 1.00 0.00 H new ATOM 304 N ALA A 22 -3.149 14.883 2.379 1.00 0.00 N ATOM 305 CA ALA A 22 -2.378 13.970 3.220 1.00 0.00 C ATOM 306 C ALA A 22 -1.610 14.720 4.308 1.00 0.00 C ATOM 307 O ALA A 22 -1.374 15.924 4.200 1.00 0.00 O ATOM 308 CB ALA A 22 -1.421 13.147 2.368 1.00 0.00 C ATOM 0 H ALA A 22 -2.877 14.877 1.396 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.081 13.299 3.713 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -0.853 12.471 3.008 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -1.989 12.567 1.641 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -0.735 13.813 1.845 1.00 0.00 H new ATOM 314 N ILE A 23 -1.223 13.993 5.356 1.00 0.00 N ATOM 315 CA ILE A 23 -0.482 14.579 6.470 1.00 0.00 C ATOM 316 C ILE A 23 0.187 13.488 7.309 1.00 0.00 C ATOM 317 O ILE A 23 -0.457 12.517 7.712 1.00 0.00 O ATOM 318 CB ILE A 23 -1.408 15.448 7.357 1.00 0.00 C ATOM 319 CG1 ILE A 23 -0.589 16.308 8.329 1.00 0.00 C ATOM 320 CG2 ILE A 23 -2.415 14.586 8.106 1.00 0.00 C ATOM 321 CD1 ILE A 23 -0.044 15.556 9.526 1.00 0.00 C ATOM 0 H ILE A 23 -1.411 12.996 5.456 1.00 0.00 H new ATOM 0 HA ILE A 23 0.294 15.222 6.054 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.965 16.119 6.703 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.244 16.754 7.786 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -1.214 17.128 8.684 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.052 15.222 8.721 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.030 14.040 7.391 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.885 13.878 8.744 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.521 16.240 10.159 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.870 15.132 10.097 1.00 0.00 H new ATOM 0 HD13 ILE A 23 0.610 14.754 9.185 1.00 0.00 H new ATOM 333 N ASP A 24 1.489 13.649 7.557 1.00 0.00 N ATOM 334 CA ASP A 24 2.254 12.677 8.334 1.00 0.00 C ATOM 335 C ASP A 24 1.786 12.634 9.788 1.00 0.00 C ATOM 336 O ASP A 24 1.977 13.588 10.542 1.00 0.00 O ATOM 337 CB ASP A 24 3.753 13.003 8.269 1.00 0.00 C ATOM 338 CG ASP A 24 4.059 14.468 8.535 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.860 15.292 7.619 1.00 0.00 O ATOM 340 OD2 ASP A 24 4.501 14.785 9.659 1.00 0.00 O ATOM 0 H ASP A 24 2.035 14.446 7.229 1.00 0.00 H new ATOM 0 HA ASP A 24 2.085 11.693 7.897 1.00 0.00 H new ATOM 0 HB2 ASP A 24 4.284 12.390 8.997 1.00 0.00 H new ATOM 0 HB3 ASP A 24 4.135 12.732 7.285 1.00 0.00 H new ATOM 345 N VAL A 25 1.173 11.513 10.178 1.00 0.00 N ATOM 346 CA VAL A 25 0.680 11.341 11.540 1.00 0.00 C ATOM 347 C VAL A 25 1.798 10.977 12.528 1.00 0.00 C ATOM 348 O VAL A 25 1.522 10.646 13.684 1.00 0.00 O ATOM 349 CB VAL A 25 -0.421 10.262 11.603 1.00 0.00 C ATOM 350 CG1 VAL A 25 -1.711 10.769 10.972 1.00 0.00 C ATOM 351 CG2 VAL A 25 0.038 8.974 10.936 1.00 0.00 C ATOM 0 H VAL A 25 1.008 10.713 9.567 1.00 0.00 H new ATOM 0 HA VAL A 25 0.265 12.305 11.834 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.619 10.044 12.653 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.473 9.992 11.028 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.055 11.654 11.508 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.529 11.025 9.928 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.757 8.231 10.995 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.275 9.170 9.890 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.925 8.597 11.445 1.00 0.00 H new ATOM 361 N SER A 26 3.059 11.050 12.082 1.00 0.00 N ATOM 362 CA SER A 26 4.198 10.739 12.947 1.00 0.00 C ATOM 363 C SER A 26 4.205 11.643 14.180 1.00 0.00 C ATOM 364 O SER A 26 4.589 11.217 15.271 1.00 0.00 O ATOM 365 CB SER A 26 5.512 10.887 12.177 1.00 0.00 C ATOM 366 OG SER A 26 5.555 12.116 11.471 1.00 0.00 O ATOM 0 H SER A 26 3.313 11.321 11.132 1.00 0.00 H new ATOM 0 HA SER A 26 4.100 9.705 13.277 1.00 0.00 H new ATOM 0 HB2 SER A 26 6.351 10.833 12.870 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.622 10.058 11.478 1.00 0.00 H new ATOM 0 HG SER A 26 6.405 12.187 10.989 1.00 0.00 H new ATOM 372 N ASP A 27 3.770 12.893 13.999 1.00 0.00 N ATOM 373 CA ASP A 27 3.714 13.855 15.099 1.00 0.00 C ATOM 374 C ASP A 27 2.646 13.452 16.120 1.00 0.00 C ATOM 375 O ASP A 27 2.789 13.714 17.315 1.00 0.00 O ATOM 376 CB ASP A 27 3.422 15.261 14.564 1.00 0.00 C ATOM 377 CG ASP A 27 4.089 16.343 15.393 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.335 16.434 15.359 1.00 0.00 O ATOM 379 OD2 ASP A 27 3.366 17.096 16.078 1.00 0.00 O ATOM 0 H ASP A 27 3.452 13.260 13.102 1.00 0.00 H new ATOM 0 HA ASP A 27 4.684 13.859 15.595 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.766 15.333 13.532 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.345 15.427 14.553 1.00 0.00 H new ATOM 384 N LEU A 28 1.579 12.809 15.638 1.00 0.00 N ATOM 385 CA LEU A 28 0.486 12.360 16.500 1.00 0.00 C ATOM 386 C LEU A 28 0.832 11.033 17.188 1.00 0.00 C ATOM 387 O LEU A 28 0.423 10.793 18.325 1.00 0.00 O ATOM 388 CB LEU A 28 -0.802 12.206 15.678 1.00 0.00 C ATOM 389 CG LEU A 28 -2.087 12.717 16.344 1.00 0.00 C ATOM 390 CD1 LEU A 28 -2.385 11.939 17.616 1.00 0.00 C ATOM 391 CD2 LEU A 28 -1.987 14.208 16.638 1.00 0.00 C ATOM 0 H LEU A 28 1.450 12.588 14.651 1.00 0.00 H new ATOM 0 HA LEU A 28 0.333 13.113 17.273 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.672 12.732 14.732 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.934 11.151 15.440 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.912 12.560 15.649 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.300 12.320 18.069 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.511 10.883 17.376 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.558 12.055 18.316 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.909 14.548 17.110 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.147 14.391 17.308 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.833 14.753 15.707 1.00 0.00 H new ATOM 403 N ARG A 29 1.581 10.170 16.490 1.00 0.00 N ATOM 404 CA ARG A 29 1.972 8.868 17.037 1.00 0.00 C ATOM 405 C ARG A 29 3.262 8.354 16.388 1.00 0.00 C ATOM 406 O ARG A 29 3.570 8.705 15.250 1.00 0.00 O ATOM 407 CB ARG A 29 0.846 7.852 16.825 1.00 0.00 C ATOM 408 CG ARG A 29 0.501 7.625 15.360 1.00 0.00 C ATOM 409 CD ARG A 29 -0.725 6.737 15.201 1.00 0.00 C ATOM 410 NE ARG A 29 -1.877 7.250 15.941 1.00 0.00 N ATOM 411 CZ ARG A 29 -2.625 8.283 15.538 1.00 0.00 C ATOM 412 NH1 ARG A 29 -2.348 8.911 14.398 1.00 0.00 N ATOM 413 NH2 ARG A 29 -3.652 8.685 16.276 1.00 0.00 N ATOM 0 H ARG A 29 1.927 10.351 15.548 1.00 0.00 H new ATOM 0 HA ARG A 29 2.155 8.994 18.104 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.136 6.902 17.273 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -0.045 8.194 17.351 1.00 0.00 H new ATOM 0 HG2 ARG A 29 0.320 8.585 14.876 1.00 0.00 H new ATOM 0 HG3 ARG A 29 1.350 7.167 14.853 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.980 6.658 14.144 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.491 5.731 15.549 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.125 6.792 16.818 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.561 8.605 13.826 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -2.923 9.698 14.097 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -3.870 8.206 17.150 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -4.223 9.473 15.969 1.00 0.00 H new ATOM 427 N PRO A 30 4.031 7.507 17.107 1.00 0.00 N ATOM 428 CA PRO A 30 5.292 6.939 16.594 1.00 0.00 C ATOM 429 C PRO A 30 5.083 6.082 15.344 1.00 0.00 C ATOM 430 O PRO A 30 4.174 5.252 15.298 1.00 0.00 O ATOM 431 CB PRO A 30 5.801 6.075 17.759 1.00 0.00 C ATOM 432 CG PRO A 30 4.601 5.817 18.606 1.00 0.00 C ATOM 433 CD PRO A 30 3.731 7.033 18.470 1.00 0.00 C ATOM 0 HA PRO A 30 5.990 7.718 16.289 1.00 0.00 H new ATOM 0 HB2 PRO A 30 6.236 5.143 17.398 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.578 6.592 18.323 1.00 0.00 H new ATOM 0 HG2 PRO A 30 4.075 4.922 18.275 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.885 5.654 19.646 1.00 0.00 H new ATOM 0 HD2 PRO A 30 2.675 6.789 18.589 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.970 7.786 19.221 1.00 0.00 H new ATOM 441 N VAL A 31 5.927 6.290 14.329 1.00 0.00 N ATOM 442 CA VAL A 31 5.825 5.535 13.079 1.00 0.00 C ATOM 443 C VAL A 31 7.191 5.008 12.632 1.00 0.00 C ATOM 444 O VAL A 31 8.168 5.758 12.598 1.00 0.00 O ATOM 445 CB VAL A 31 5.225 6.396 11.946 1.00 0.00 C ATOM 446 CG1 VAL A 31 4.953 5.550 10.711 1.00 0.00 C ATOM 447 CG2 VAL A 31 3.951 7.091 12.411 1.00 0.00 C ATOM 0 H VAL A 31 6.685 6.972 14.349 1.00 0.00 H new ATOM 0 HA VAL A 31 5.162 4.693 13.277 1.00 0.00 H new ATOM 0 HB VAL A 31 5.954 7.162 11.682 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.531 6.177 9.926 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.886 5.108 10.360 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.248 4.758 10.961 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.546 7.692 11.597 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.217 6.343 12.710 1.00 0.00 H new ATOM 0 HG23 VAL A 31 4.178 7.736 13.260 1.00 0.00 H new ATOM 457 N PRO A 32 7.275 3.706 12.280 1.00 0.00 N ATOM 458 CA PRO A 32 8.530 3.078 11.832 1.00 0.00 C ATOM 459 C PRO A 32 9.105 3.728 10.573 1.00 0.00 C ATOM 460 O PRO A 32 8.466 4.582 9.950 1.00 0.00 O ATOM 461 CB PRO A 32 8.132 1.626 11.532 1.00 0.00 C ATOM 462 CG PRO A 32 6.649 1.648 11.386 1.00 0.00 C ATOM 463 CD PRO A 32 6.158 2.743 12.287 1.00 0.00 C ATOM 0 HA PRO A 32 9.308 3.178 12.589 1.00 0.00 H new ATOM 0 HB2 PRO A 32 8.612 1.267 10.622 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.438 0.959 12.338 1.00 0.00 H new ATOM 0 HG2 PRO A 32 6.362 1.837 10.351 1.00 0.00 H new ATOM 0 HG3 PRO A 32 6.215 0.688 11.667 1.00 0.00 H new ATOM 0 HD2 PRO A 32 5.237 3.191 11.913 1.00 0.00 H new ATOM 0 HD3 PRO A 32 5.949 2.375 13.292 1.00 0.00 H new ATOM 471 N ASP A 33 10.317 3.309 10.207 1.00 0.00 N ATOM 472 CA ASP A 33 10.998 3.834 9.026 1.00 0.00 C ATOM 473 C ASP A 33 10.595 3.080 7.759 1.00 0.00 C ATOM 474 O ASP A 33 10.584 3.656 6.672 1.00 0.00 O ATOM 475 CB ASP A 33 12.517 3.750 9.204 1.00 0.00 C ATOM 476 CG ASP A 33 13.261 4.837 8.443 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.730 5.335 7.428 1.00 0.00 O ATOM 478 OD2 ASP A 33 14.380 5.188 8.862 1.00 0.00 O ATOM 0 H ASP A 33 10.849 2.603 10.716 1.00 0.00 H new ATOM 0 HA ASP A 33 10.697 4.876 8.916 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.759 3.825 10.264 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.864 2.774 8.866 1.00 0.00 H new ATOM 483 N ASN A 34 10.277 1.792 7.893 1.00 0.00 N ATOM 484 CA ASN A 34 9.894 0.982 6.737 1.00 0.00 C ATOM 485 C ASN A 34 8.386 1.049 6.454 1.00 0.00 C ATOM 486 O ASN A 34 7.816 0.115 5.883 1.00 0.00 O ATOM 487 CB ASN A 34 10.345 -0.469 6.933 1.00 0.00 C ATOM 488 CG ASN A 34 9.902 -1.046 8.264 1.00 0.00 C ATOM 489 OD1 ASN A 34 10.697 -1.171 9.195 1.00 0.00 O ATOM 490 ND2 ASN A 34 8.628 -1.399 8.358 1.00 0.00 N ATOM 0 H ASN A 34 10.277 1.291 8.782 1.00 0.00 H new ATOM 0 HA ASN A 34 10.400 1.397 5.865 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.945 -1.082 6.125 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.432 -0.520 6.863 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.271 -1.793 9.229 1.00 0.00 H new ATOM 0 HD22 ASN A 34 8.005 -1.277 7.560 1.00 0.00 H new ATOM 497 N GLN A 35 7.746 2.161 6.832 1.00 0.00 N ATOM 498 CA GLN A 35 6.317 2.339 6.593 1.00 0.00 C ATOM 499 C GLN A 35 5.970 3.817 6.429 1.00 0.00 C ATOM 500 O GLN A 35 6.842 4.685 6.511 1.00 0.00 O ATOM 501 CB GLN A 35 5.495 1.740 7.738 1.00 0.00 C ATOM 502 CG GLN A 35 5.128 0.280 7.528 1.00 0.00 C ATOM 503 CD GLN A 35 5.040 -0.501 8.827 1.00 0.00 C ATOM 504 OE1 GLN A 35 5.998 -1.157 9.234 1.00 0.00 O ATOM 505 NE2 GLN A 35 3.888 -0.433 9.487 1.00 0.00 N ATOM 0 H GLN A 35 8.196 2.946 7.303 1.00 0.00 H new ATOM 0 HA GLN A 35 6.070 1.816 5.669 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.059 1.834 8.666 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.581 2.321 7.860 1.00 0.00 H new ATOM 0 HG2 GLN A 35 4.171 0.222 7.010 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.870 -0.186 6.880 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.119 0.123 9.114 1.00 0.00 H new ATOM 0 HE22 GLN A 35 3.774 -0.937 10.367 1.00 0.00 H new ATOM 514 N GLU A 36 4.687 4.092 6.205 1.00 0.00 N ATOM 515 CA GLU A 36 4.210 5.464 6.037 1.00 0.00 C ATOM 516 C GLU A 36 2.716 5.558 6.310 1.00 0.00 C ATOM 517 O GLU A 36 1.905 4.979 5.586 1.00 0.00 O ATOM 518 CB GLU A 36 4.509 5.970 4.626 1.00 0.00 C ATOM 519 CG GLU A 36 5.099 7.372 4.595 1.00 0.00 C ATOM 520 CD GLU A 36 6.593 7.385 4.859 1.00 0.00 C ATOM 521 OE1 GLU A 36 7.336 6.710 4.116 1.00 0.00 O ATOM 522 OE2 GLU A 36 7.020 8.075 5.807 1.00 0.00 O ATOM 0 H GLU A 36 3.958 3.382 6.135 1.00 0.00 H new ATOM 0 HA GLU A 36 4.737 6.089 6.758 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.202 5.282 4.141 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.589 5.959 4.042 1.00 0.00 H new ATOM 0 HG2 GLU A 36 4.902 7.823 3.622 1.00 0.00 H new ATOM 0 HG3 GLU A 36 4.597 7.989 5.340 1.00 0.00 H new ATOM 529 N VAL A 37 2.356 6.294 7.352 1.00 0.00 N ATOM 530 CA VAL A 37 0.955 6.466 7.716 1.00 0.00 C ATOM 531 C VAL A 37 0.476 7.885 7.421 1.00 0.00 C ATOM 532 O VAL A 37 0.926 8.848 8.046 1.00 0.00 O ATOM 533 CB VAL A 37 0.705 6.143 9.204 1.00 0.00 C ATOM 534 CG1 VAL A 37 -0.790 6.091 9.491 1.00 0.00 C ATOM 535 CG2 VAL A 37 1.376 4.833 9.591 1.00 0.00 C ATOM 0 H VAL A 37 3.014 6.782 7.960 1.00 0.00 H new ATOM 0 HA VAL A 37 0.388 5.762 7.107 1.00 0.00 H new ATOM 0 HB VAL A 37 1.144 6.937 9.808 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.950 5.862 10.545 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.239 7.056 9.257 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.252 5.317 8.877 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.187 4.625 10.644 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.972 4.024 8.983 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.450 4.911 9.424 1.00 0.00 H new ATOM 545 N PHE A 38 -0.443 8.003 6.464 1.00 0.00 N ATOM 546 CA PHE A 38 -1.001 9.295 6.072 1.00 0.00 C ATOM 547 C PHE A 38 -2.480 9.389 6.455 1.00 0.00 C ATOM 548 O PHE A 38 -3.129 8.373 6.712 1.00 0.00 O ATOM 549 CB PHE A 38 -0.846 9.501 4.564 1.00 0.00 C ATOM 550 CG PHE A 38 0.548 9.878 4.147 1.00 0.00 C ATOM 551 CD1 PHE A 38 0.998 11.183 4.285 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.406 8.930 3.612 1.00 0.00 C ATOM 553 CE1 PHE A 38 2.278 11.532 3.900 1.00 0.00 C ATOM 554 CE2 PHE A 38 2.686 9.275 3.225 1.00 0.00 C ATOM 555 CZ PHE A 38 3.123 10.577 3.368 1.00 0.00 C ATOM 0 H PHE A 38 -0.819 7.211 5.942 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.454 10.075 6.601 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.135 8.585 4.049 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.536 10.280 4.240 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.341 11.934 4.698 1.00 0.00 H new ATOM 0 HD2 PHE A 38 1.070 7.910 3.496 1.00 0.00 H new ATOM 0 HE1 PHE A 38 2.618 12.551 4.015 1.00 0.00 H new ATOM 0 HE2 PHE A 38 3.345 8.527 2.811 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.123 10.848 3.065 1.00 0.00 H new ATOM 565 N CYS A 39 -3.005 10.613 6.491 1.00 0.00 N ATOM 566 CA CYS A 39 -4.406 10.841 6.844 1.00 0.00 C ATOM 567 C CYS A 39 -4.953 12.088 6.149 1.00 0.00 C ATOM 568 O CYS A 39 -4.202 13.007 5.821 1.00 0.00 O ATOM 569 CB CYS A 39 -4.547 10.982 8.363 1.00 0.00 C ATOM 570 SG CYS A 39 -6.253 11.141 8.947 1.00 0.00 S ATOM 0 H CYS A 39 -2.481 11.462 6.280 1.00 0.00 H new ATOM 0 HA CYS A 39 -4.986 9.982 6.506 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.093 10.113 8.840 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -3.982 11.856 8.688 1.00 0.00 H new ATOM 0 HG CYS A 39 -7.045 10.473 8.162 1.00 0.00 H new ATOM 576 N HIS A 40 -6.268 12.111 5.932 1.00 0.00 N ATOM 577 CA HIS A 40 -6.924 13.242 5.281 1.00 0.00 C ATOM 578 C HIS A 40 -7.938 13.888 6.222 1.00 0.00 C ATOM 579 O HIS A 40 -8.949 13.277 6.563 1.00 0.00 O ATOM 580 CB HIS A 40 -7.629 12.794 3.996 1.00 0.00 C ATOM 581 CG HIS A 40 -6.754 12.012 3.067 1.00 0.00 C ATOM 582 ND1 HIS A 40 -7.149 10.828 2.479 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.497 12.248 2.626 1.00 0.00 C ATOM 584 CE1 HIS A 40 -6.172 10.370 1.720 1.00 0.00 C ATOM 585 NE2 HIS A 40 -5.159 11.213 1.789 1.00 0.00 N ATOM 0 H HIS A 40 -6.900 11.356 6.199 1.00 0.00 H new ATOM 0 HA HIS A 40 -6.157 13.973 5.027 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.495 12.188 4.261 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -8.004 13.674 3.473 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.875 13.093 2.884 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -6.197 9.459 1.140 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -4.269 11.112 1.300 1.00 0.00 H new ATOM 594 N PRO A 41 -7.683 15.138 6.656 1.00 0.00 N ATOM 595 CA PRO A 41 -8.586 15.862 7.563 1.00 0.00 C ATOM 596 C PRO A 41 -9.903 16.265 6.896 1.00 0.00 C ATOM 597 O PRO A 41 -10.916 16.448 7.572 1.00 0.00 O ATOM 598 CB PRO A 41 -7.779 17.105 7.949 1.00 0.00 C ATOM 599 CG PRO A 41 -6.835 17.313 6.817 1.00 0.00 C ATOM 600 CD PRO A 41 -6.497 15.942 6.300 1.00 0.00 C ATOM 0 HA PRO A 41 -8.883 15.245 8.411 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.427 17.970 8.087 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.245 16.954 8.887 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -7.290 17.923 6.037 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.938 17.837 7.148 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -6.326 15.950 5.224 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.592 15.550 6.764 1.00 0.00 H new ATOM 608 N VAL A 42 -9.885 16.406 5.569 1.00 0.00 N ATOM 609 CA VAL A 42 -11.081 16.792 4.821 1.00 0.00 C ATOM 610 C VAL A 42 -12.035 15.609 4.659 1.00 0.00 C ATOM 611 O VAL A 42 -13.194 15.673 5.072 1.00 0.00 O ATOM 612 CB VAL A 42 -10.721 17.350 3.423 1.00 0.00 C ATOM 613 CG1 VAL A 42 -11.964 17.881 2.719 1.00 0.00 C ATOM 614 CG2 VAL A 42 -9.659 18.436 3.532 1.00 0.00 C ATOM 0 H VAL A 42 -9.057 16.259 4.992 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.574 17.575 5.397 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.313 16.534 2.826 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.689 18.269 1.738 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.688 17.074 2.601 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.406 18.680 3.314 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.421 18.814 2.538 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.035 19.252 4.150 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.760 18.021 3.987 1.00 0.00 H new ATOM 624 N THR A 43 -11.538 14.532 4.053 1.00 0.00 N ATOM 625 CA THR A 43 -12.340 13.327 3.827 1.00 0.00 C ATOM 626 C THR A 43 -12.366 12.416 5.060 1.00 0.00 C ATOM 627 O THR A 43 -13.140 11.459 5.110 1.00 0.00 O ATOM 628 CB THR A 43 -11.794 12.548 2.623 1.00 0.00 C ATOM 629 OG1 THR A 43 -11.198 13.425 1.683 1.00 0.00 O ATOM 630 CG2 THR A 43 -12.851 11.746 1.894 1.00 0.00 C ATOM 0 H THR A 43 -10.580 14.468 3.708 1.00 0.00 H new ATOM 0 HA THR A 43 -13.362 13.649 3.627 1.00 0.00 H new ATOM 0 HB THR A 43 -11.061 11.857 3.040 1.00 0.00 H new ATOM 0 HG1 THR A 43 -10.464 12.964 1.225 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.395 11.221 1.055 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.294 11.022 2.578 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.626 12.417 1.524 1.00 0.00 H new ATOM 638 N ASP A 44 -11.510 12.707 6.048 1.00 0.00 N ATOM 639 CA ASP A 44 -11.428 11.906 7.270 1.00 0.00 C ATOM 640 C ASP A 44 -11.034 10.457 6.955 1.00 0.00 C ATOM 641 O ASP A 44 -11.464 9.521 7.635 1.00 0.00 O ATOM 642 CB ASP A 44 -12.761 11.948 8.029 1.00 0.00 C ATOM 643 CG ASP A 44 -12.748 12.961 9.159 1.00 0.00 C ATOM 644 OD1 ASP A 44 -12.593 14.168 8.876 1.00 0.00 O ATOM 645 OD2 ASP A 44 -12.891 12.546 10.330 1.00 0.00 O ATOM 0 H ASP A 44 -10.863 13.495 6.022 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.652 12.335 7.904 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.565 12.192 7.334 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.978 10.959 8.433 1.00 0.00 H new ATOM 650 N GLN A 45 -10.207 10.284 5.922 1.00 0.00 N ATOM 651 CA GLN A 45 -9.741 8.959 5.512 1.00 0.00 C ATOM 652 C GLN A 45 -8.383 8.646 6.142 1.00 0.00 C ATOM 653 O GLN A 45 -7.838 9.457 6.892 1.00 0.00 O ATOM 654 CB GLN A 45 -9.641 8.888 3.985 1.00 0.00 C ATOM 655 CG GLN A 45 -10.620 7.917 3.345 1.00 0.00 C ATOM 656 CD GLN A 45 -11.129 8.405 1.998 1.00 0.00 C ATOM 657 OE1 GLN A 45 -10.557 9.316 1.400 1.00 0.00 O ATOM 658 NE2 GLN A 45 -12.208 7.800 1.513 1.00 0.00 N ATOM 0 H GLN A 45 -9.845 11.049 5.352 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.461 8.217 5.857 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.811 9.883 3.574 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.627 8.599 3.711 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -10.135 6.949 3.217 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -11.466 7.764 4.015 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -12.652 7.049 2.041 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -12.592 8.087 0.613 1.00 0.00 H new ATOM 667 N SER A 46 -7.838 7.466 5.832 1.00 0.00 N ATOM 668 CA SER A 46 -6.542 7.056 6.372 1.00 0.00 C ATOM 669 C SER A 46 -5.820 6.098 5.424 1.00 0.00 C ATOM 670 O SER A 46 -6.414 5.145 4.917 1.00 0.00 O ATOM 671 CB SER A 46 -6.725 6.401 7.743 1.00 0.00 C ATOM 672 OG SER A 46 -6.768 7.374 8.774 1.00 0.00 O ATOM 0 H SER A 46 -8.273 6.782 5.213 1.00 0.00 H new ATOM 0 HA SER A 46 -5.927 7.949 6.480 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.646 5.818 7.751 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.906 5.706 7.929 1.00 0.00 H new ATOM 0 HG SER A 46 -7.074 8.229 8.405 1.00 0.00 H new ATOM 678 N LEU A 47 -4.531 6.360 5.199 1.00 0.00 N ATOM 679 CA LEU A 47 -3.706 5.528 4.321 1.00 0.00 C ATOM 680 C LEU A 47 -2.430 5.089 5.037 1.00 0.00 C ATOM 681 O LEU A 47 -1.827 5.871 5.774 1.00 0.00 O ATOM 682 CB LEU A 47 -3.346 6.292 3.044 1.00 0.00 C ATOM 683 CG LEU A 47 -4.275 6.048 1.855 1.00 0.00 C ATOM 684 CD1 LEU A 47 -5.303 7.165 1.741 1.00 0.00 C ATOM 685 CD2 LEU A 47 -3.471 5.926 0.569 1.00 0.00 C ATOM 0 H LEU A 47 -4.033 7.147 5.616 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.282 4.642 4.055 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.341 7.359 3.267 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.331 6.022 2.753 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.806 5.111 2.019 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.955 6.974 0.889 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.899 7.205 2.653 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.792 8.117 1.600 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.147 5.752 -0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -2.913 6.847 0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.776 5.091 0.653 1.00 0.00 H new ATOM 697 N ILE A 48 -2.022 3.835 4.827 1.00 0.00 N ATOM 698 CA ILE A 48 -0.818 3.307 5.470 1.00 0.00 C ATOM 699 C ILE A 48 -0.010 2.420 4.520 1.00 0.00 C ATOM 700 O ILE A 48 -0.487 1.378 4.073 1.00 0.00 O ATOM 701 CB ILE A 48 -1.163 2.493 6.738 1.00 0.00 C ATOM 702 CG1 ILE A 48 -2.135 3.270 7.634 1.00 0.00 C ATOM 703 CG2 ILE A 48 0.105 2.140 7.508 1.00 0.00 C ATOM 704 CD1 ILE A 48 -3.592 2.992 7.332 1.00 0.00 C ATOM 0 H ILE A 48 -2.504 3.171 4.221 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.217 4.172 5.748 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.649 1.568 6.428 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.934 3.020 8.676 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.946 4.338 7.520 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -0.157 1.567 8.397 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.762 1.545 6.874 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.618 3.055 7.804 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -4.221 3.576 8.004 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.809 3.269 6.300 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.797 1.931 7.474 1.00 0.00 H new ATOM 716 N VAL A 49 1.226 2.837 4.235 1.00 0.00 N ATOM 717 CA VAL A 49 2.116 2.077 3.356 1.00 0.00 C ATOM 718 C VAL A 49 3.019 1.160 4.181 1.00 0.00 C ATOM 719 O VAL A 49 3.520 1.556 5.237 1.00 0.00 O ATOM 720 CB VAL A 49 2.989 3.009 2.486 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.755 2.211 1.439 1.00 0.00 C ATOM 722 CG2 VAL A 49 2.135 4.082 1.827 1.00 0.00 C ATOM 0 H VAL A 49 1.633 3.698 4.601 1.00 0.00 H new ATOM 0 HA VAL A 49 1.489 1.479 2.695 1.00 0.00 H new ATOM 0 HB VAL A 49 3.714 3.500 3.135 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.363 2.888 0.838 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.401 1.486 1.935 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.050 1.687 0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.768 4.728 1.219 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.383 3.611 1.194 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.641 4.677 2.595 1.00 0.00 H new ATOM 732 N GLU A 50 3.213 -0.068 3.704 1.00 0.00 N ATOM 733 CA GLU A 50 4.041 -1.047 4.407 1.00 0.00 C ATOM 734 C GLU A 50 5.056 -1.708 3.470 1.00 0.00 C ATOM 735 O GLU A 50 4.742 -2.020 2.320 1.00 0.00 O ATOM 736 CB GLU A 50 3.149 -2.122 5.036 1.00 0.00 C ATOM 737 CG GLU A 50 3.697 -2.698 6.332 1.00 0.00 C ATOM 738 CD GLU A 50 4.885 -3.617 6.111 1.00 0.00 C ATOM 739 OE1 GLU A 50 4.771 -4.552 5.287 1.00 0.00 O ATOM 740 OE2 GLU A 50 5.933 -3.398 6.756 1.00 0.00 O ATOM 0 H GLU A 50 2.808 -0.409 2.832 1.00 0.00 H new ATOM 0 HA GLU A 50 4.594 -0.519 5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.164 -1.696 5.227 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.013 -2.932 4.319 1.00 0.00 H new ATOM 0 HG2 GLU A 50 3.993 -1.882 6.991 1.00 0.00 H new ATOM 0 HG3 GLU A 50 2.907 -3.249 6.842 1.00 0.00 H new ATOM 747 N LEU A 51 6.268 -1.941 3.983 1.00 0.00 N ATOM 748 CA LEU A 51 7.327 -2.590 3.209 1.00 0.00 C ATOM 749 C LEU A 51 7.815 -3.853 3.924 1.00 0.00 C ATOM 750 O LEU A 51 8.258 -3.792 5.074 1.00 0.00 O ATOM 751 CB LEU A 51 8.496 -1.624 2.977 1.00 0.00 C ATOM 752 CG LEU A 51 9.724 -2.226 2.276 1.00 0.00 C ATOM 753 CD1 LEU A 51 9.567 -2.169 0.763 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.991 -1.501 2.704 1.00 0.00 C ATOM 0 H LEU A 51 6.539 -1.689 4.933 1.00 0.00 H new ATOM 0 HA LEU A 51 6.917 -2.875 2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 51 8.137 -0.783 2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 51 8.810 -1.223 3.941 1.00 0.00 H new ATOM 0 HG LEU A 51 9.804 -3.272 2.572 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.449 -2.601 0.289 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.683 -2.734 0.467 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.457 -1.131 0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.850 -1.941 2.198 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.914 -0.447 2.439 1.00 0.00 H new ATOM 0 HD23 LEU A 51 11.118 -1.596 3.782 1.00 0.00 H new ATOM 766 N LEU A 52 7.726 -4.992 3.235 1.00 0.00 N ATOM 767 CA LEU A 52 8.156 -6.270 3.801 1.00 0.00 C ATOM 768 C LEU A 52 8.902 -7.116 2.768 1.00 0.00 C ATOM 769 O LEU A 52 8.959 -6.771 1.586 1.00 0.00 O ATOM 770 CB LEU A 52 6.950 -7.055 4.334 1.00 0.00 C ATOM 771 CG LEU A 52 7.136 -7.652 5.732 1.00 0.00 C ATOM 772 CD1 LEU A 52 7.250 -6.543 6.766 1.00 0.00 C ATOM 773 CD2 LEU A 52 5.989 -8.592 6.081 1.00 0.00 C ATOM 0 H LEU A 52 7.360 -5.055 2.285 1.00 0.00 H new ATOM 0 HA LEU A 52 8.837 -6.051 4.623 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.083 -6.395 4.349 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.724 -7.862 3.637 1.00 0.00 H new ATOM 0 HG LEU A 52 8.059 -8.232 5.736 1.00 0.00 H new ATOM 0 HD11 LEU A 52 7.382 -6.980 7.756 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.108 -5.913 6.531 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.342 -5.940 6.754 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.146 -9.002 7.079 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.048 -8.042 6.058 1.00 0.00 H new ATOM 0 HD23 LEU A 52 5.952 -9.405 5.356 1.00 0.00 H new ATOM 785 N GLU A 53 9.466 -8.232 3.230 1.00 0.00 N ATOM 786 CA GLU A 53 10.204 -9.146 2.363 1.00 0.00 C ATOM 787 C GLU A 53 9.435 -10.455 2.182 1.00 0.00 C ATOM 788 O GLU A 53 8.852 -10.978 3.134 1.00 0.00 O ATOM 789 CB GLU A 53 11.594 -9.427 2.947 1.00 0.00 C ATOM 790 CG GLU A 53 12.732 -8.787 2.162 1.00 0.00 C ATOM 791 CD GLU A 53 12.813 -7.286 2.362 1.00 0.00 C ATOM 792 OE1 GLU A 53 12.107 -6.550 1.639 1.00 0.00 O ATOM 793 OE2 GLU A 53 13.587 -6.844 3.239 1.00 0.00 O ATOM 0 H GLU A 53 9.424 -8.525 4.206 1.00 0.00 H new ATOM 0 HA GLU A 53 10.320 -8.675 1.387 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.626 -9.065 3.975 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.751 -10.505 2.983 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.676 -9.241 2.464 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.601 -9.001 1.101 1.00 0.00 H new ATOM 800 N LEU A 54 9.436 -10.973 0.952 1.00 0.00 N ATOM 801 CA LEU A 54 8.739 -12.220 0.627 1.00 0.00 C ATOM 802 C LEU A 54 9.107 -13.338 1.608 1.00 0.00 C ATOM 803 O LEU A 54 10.287 -13.585 1.864 1.00 0.00 O ATOM 804 CB LEU A 54 9.076 -12.656 -0.801 1.00 0.00 C ATOM 805 CG LEU A 54 7.877 -12.819 -1.738 1.00 0.00 C ATOM 806 CD1 LEU A 54 8.221 -12.317 -3.132 1.00 0.00 C ATOM 807 CD2 LEU A 54 7.432 -14.275 -1.786 1.00 0.00 C ATOM 0 H LEU A 54 9.915 -10.545 0.160 1.00 0.00 H new ATOM 0 HA LEU A 54 7.668 -12.033 0.708 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.758 -11.924 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 54 9.612 -13.604 -0.756 1.00 0.00 H new ATOM 0 HG LEU A 54 7.051 -12.221 -1.352 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.358 -12.440 -3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.492 -11.262 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.061 -12.889 -3.528 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.579 -14.373 -2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 54 8.252 -14.894 -2.149 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.147 -14.601 -0.786 1.00 0.00 H new ATOM 819 N GLN A 55 8.088 -14.008 2.151 1.00 0.00 N ATOM 820 CA GLN A 55 8.300 -15.098 3.101 1.00 0.00 C ATOM 821 C GLN A 55 7.582 -16.369 2.648 1.00 0.00 C ATOM 822 O GLN A 55 6.428 -16.318 2.219 1.00 0.00 O ATOM 823 CB GLN A 55 7.810 -14.689 4.492 1.00 0.00 C ATOM 824 CG GLN A 55 8.166 -15.682 5.590 1.00 0.00 C ATOM 825 CD GLN A 55 9.502 -15.383 6.249 1.00 0.00 C ATOM 826 OE1 GLN A 55 10.079 -14.313 6.058 1.00 0.00 O ATOM 827 NE2 GLN A 55 10.004 -16.335 7.030 1.00 0.00 N ATOM 0 H GLN A 55 7.108 -13.813 1.948 1.00 0.00 H new ATOM 0 HA GLN A 55 9.369 -15.306 3.144 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.234 -13.717 4.744 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.727 -14.567 4.463 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.383 -15.673 6.348 1.00 0.00 H new ATOM 0 HG3 GLN A 55 8.191 -16.687 5.169 1.00 0.00 H new ATOM 0 HE21 GLN A 55 9.494 -17.208 7.162 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.899 -16.192 7.497 1.00 0.00 H new ATOM 836 N ALA A 56 8.276 -17.506 2.748 1.00 0.00 N ATOM 837 CA ALA A 56 7.727 -18.805 2.353 1.00 0.00 C ATOM 838 C ALA A 56 7.458 -18.862 0.849 1.00 0.00 C ATOM 839 O ALA A 56 8.278 -19.382 0.090 1.00 0.00 O ATOM 840 CB ALA A 56 6.461 -19.123 3.145 1.00 0.00 C ATOM 0 H ALA A 56 9.231 -17.552 3.104 1.00 0.00 H new ATOM 0 HA ALA A 56 8.474 -19.565 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 56 6.071 -20.092 2.834 1.00 0.00 H new ATOM 0 HB2 ALA A 56 6.695 -19.150 4.209 1.00 0.00 H new ATOM 0 HB3 ALA A 56 5.712 -18.354 2.958 1.00 0.00 H new ATOM 846 N HIS A 57 6.310 -18.331 0.422 1.00 0.00 N ATOM 847 CA HIS A 57 5.939 -18.324 -0.995 1.00 0.00 C ATOM 848 C HIS A 57 4.632 -17.561 -1.231 1.00 0.00 C ATOM 849 O HIS A 57 3.801 -17.972 -2.045 1.00 0.00 O ATOM 850 CB HIS A 57 5.804 -19.762 -1.520 1.00 0.00 C ATOM 851 CG HIS A 57 5.086 -20.692 -0.589 1.00 0.00 C ATOM 852 ND1 HIS A 57 4.047 -20.298 0.230 1.00 0.00 N ATOM 853 CD2 HIS A 57 5.264 -22.013 -0.356 1.00 0.00 C ATOM 854 CE1 HIS A 57 3.620 -21.337 0.925 1.00 0.00 C ATOM 855 NE2 HIS A 57 4.343 -22.389 0.589 1.00 0.00 N ATOM 0 H HIS A 57 5.621 -17.900 1.038 1.00 0.00 H new ATOM 0 HA HIS A 57 6.733 -17.813 -1.540 1.00 0.00 H new ATOM 0 HB2 HIS A 57 5.275 -19.741 -2.473 1.00 0.00 H new ATOM 0 HB3 HIS A 57 6.800 -20.160 -1.717 1.00 0.00 H new ATOM 0 HD2 HIS A 57 5.996 -22.653 -0.827 1.00 0.00 H new ATOM 0 HE1 HIS A 57 2.816 -21.327 1.646 1.00 0.00 H new ATOM 0 HE2 HIS A 57 4.235 -23.329 0.970 1.00 0.00 H new ATOM 864 N VAL A 58 4.453 -16.450 -0.519 1.00 0.00 N ATOM 865 CA VAL A 58 3.246 -15.640 -0.657 1.00 0.00 C ATOM 866 C VAL A 58 3.524 -14.376 -1.464 1.00 0.00 C ATOM 867 O VAL A 58 4.300 -13.517 -1.042 1.00 0.00 O ATOM 868 CB VAL A 58 2.651 -15.258 0.718 1.00 0.00 C ATOM 869 CG1 VAL A 58 1.899 -16.438 1.320 1.00 0.00 C ATOM 870 CG2 VAL A 58 3.738 -14.770 1.668 1.00 0.00 C ATOM 0 H VAL A 58 5.127 -16.091 0.157 1.00 0.00 H new ATOM 0 HA VAL A 58 2.516 -16.250 -1.189 1.00 0.00 H new ATOM 0 HB VAL A 58 1.946 -14.440 0.567 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.487 -16.151 2.288 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.089 -16.732 0.653 1.00 0.00 H new ATOM 0 HG13 VAL A 58 2.583 -17.277 1.451 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.292 -14.508 2.627 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.475 -15.560 1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.226 -13.893 1.243 1.00 0.00 H new ATOM 880 N ARG A 59 2.893 -14.275 -2.633 1.00 0.00 N ATOM 881 CA ARG A 59 3.078 -13.121 -3.509 1.00 0.00 C ATOM 882 C ARG A 59 1.851 -12.891 -4.392 1.00 0.00 C ATOM 883 O ARG A 59 1.220 -13.843 -4.853 1.00 0.00 O ATOM 884 CB ARG A 59 4.325 -13.307 -4.383 1.00 0.00 C ATOM 885 CG ARG A 59 4.309 -14.571 -5.234 1.00 0.00 C ATOM 886 CD ARG A 59 4.875 -15.764 -4.477 1.00 0.00 C ATOM 887 NE ARG A 59 4.159 -17.001 -4.788 1.00 0.00 N ATOM 888 CZ ARG A 59 4.336 -17.707 -5.910 1.00 0.00 C ATOM 889 NH1 ARG A 59 5.206 -17.304 -6.833 1.00 0.00 N ATOM 890 NH2 ARG A 59 3.639 -18.820 -6.109 1.00 0.00 N ATOM 0 H ARG A 59 2.249 -14.979 -2.995 1.00 0.00 H new ATOM 0 HA ARG A 59 3.212 -12.243 -2.877 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.427 -12.442 -5.039 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.205 -13.326 -3.741 1.00 0.00 H new ATOM 0 HG2 ARG A 59 3.287 -14.788 -5.545 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.890 -14.407 -6.142 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.930 -15.884 -4.725 1.00 0.00 H new ATOM 0 HD3 ARG A 59 4.819 -15.573 -3.405 1.00 0.00 H new ATOM 0 HE ARG A 59 3.483 -17.347 -4.107 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.745 -16.450 -6.688 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.334 -17.849 -7.686 1.00 0.00 H new ATOM 0 HH21 ARG A 59 2.970 -19.135 -5.407 1.00 0.00 H new ATOM 0 HH22 ARG A 59 3.773 -19.360 -6.964 1.00 0.00 H new ATOM 904 N GLY A 60 1.529 -11.619 -4.627 1.00 0.00 N ATOM 905 CA GLY A 60 0.391 -11.274 -5.460 1.00 0.00 C ATOM 906 C GLY A 60 -0.940 -11.485 -4.763 1.00 0.00 C ATOM 907 O GLY A 60 -1.103 -11.121 -3.596 1.00 0.00 O ATOM 0 H GLY A 60 2.040 -10.820 -4.252 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.474 -10.231 -5.765 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.418 -11.875 -6.369 1.00 0.00 H new ATOM 911 N GLU A 61 -1.896 -12.076 -5.484 1.00 0.00 N ATOM 912 CA GLU A 61 -3.229 -12.342 -4.937 1.00 0.00 C ATOM 913 C GLU A 61 -3.137 -13.193 -3.669 1.00 0.00 C ATOM 914 O GLU A 61 -3.930 -13.025 -2.742 1.00 0.00 O ATOM 915 CB GLU A 61 -4.101 -13.049 -5.981 1.00 0.00 C ATOM 916 CG GLU A 61 -5.582 -13.090 -5.623 1.00 0.00 C ATOM 917 CD GLU A 61 -6.171 -11.712 -5.381 1.00 0.00 C ATOM 918 OE1 GLU A 61 -6.059 -10.851 -6.278 1.00 0.00 O ATOM 919 OE2 GLU A 61 -6.743 -11.493 -4.291 1.00 0.00 O ATOM 0 H GLU A 61 -1.771 -12.380 -6.450 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.687 -11.387 -4.679 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.983 -12.545 -6.940 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.740 -14.069 -6.111 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -6.132 -13.578 -6.428 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.718 -13.699 -4.729 1.00 0.00 H new ATOM 926 N ALA A 62 -2.155 -14.098 -3.636 1.00 0.00 N ATOM 927 CA ALA A 62 -1.941 -14.970 -2.483 1.00 0.00 C ATOM 928 C ALA A 62 -1.365 -14.184 -1.306 1.00 0.00 C ATOM 929 O ALA A 62 -1.750 -14.401 -0.157 1.00 0.00 O ATOM 930 CB ALA A 62 -1.009 -16.121 -2.847 1.00 0.00 C ATOM 0 H ALA A 62 -1.494 -14.244 -4.399 1.00 0.00 H new ATOM 0 HA ALA A 62 -2.907 -15.379 -2.188 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -0.862 -16.759 -1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.450 -16.705 -3.654 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.048 -15.722 -3.171 1.00 0.00 H new ATOM 936 N ALA A 63 -0.438 -13.272 -1.607 1.00 0.00 N ATOM 937 CA ALA A 63 0.196 -12.446 -0.582 1.00 0.00 C ATOM 938 C ALA A 63 -0.805 -11.477 0.044 1.00 0.00 C ATOM 939 O ALA A 63 -0.768 -11.231 1.251 1.00 0.00 O ATOM 940 CB ALA A 63 1.378 -11.684 -1.169 1.00 0.00 C ATOM 0 H ALA A 63 -0.110 -13.088 -2.555 1.00 0.00 H new ATOM 0 HA ALA A 63 0.560 -13.107 0.204 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.839 -11.074 -0.393 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.111 -12.392 -1.557 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.031 -11.041 -1.978 1.00 0.00 H new ATOM 946 N ALA A 64 -1.696 -10.928 -0.784 1.00 0.00 N ATOM 947 CA ALA A 64 -2.709 -9.983 -0.310 1.00 0.00 C ATOM 948 C ALA A 64 -3.545 -10.588 0.814 1.00 0.00 C ATOM 949 O ALA A 64 -3.677 -9.995 1.884 1.00 0.00 O ATOM 950 CB ALA A 64 -3.606 -9.541 -1.460 1.00 0.00 C ATOM 0 H ALA A 64 -1.737 -11.121 -1.785 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.192 -9.109 0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.353 -8.839 -1.090 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.002 -9.057 -2.227 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.106 -10.411 -1.887 1.00 0.00 H new ATOM 956 N ARG A 65 -4.103 -11.773 0.565 1.00 0.00 N ATOM 957 CA ARG A 65 -4.924 -12.463 1.560 1.00 0.00 C ATOM 958 C ARG A 65 -4.100 -12.818 2.799 1.00 0.00 C ATOM 959 O ARG A 65 -4.594 -12.742 3.923 1.00 0.00 O ATOM 960 CB ARG A 65 -5.547 -13.730 0.961 1.00 0.00 C ATOM 961 CG ARG A 65 -6.254 -13.500 -0.368 1.00 0.00 C ATOM 962 CD ARG A 65 -7.186 -14.651 -0.714 1.00 0.00 C ATOM 963 NE ARG A 65 -8.553 -14.194 -0.967 1.00 0.00 N ATOM 964 CZ ARG A 65 -9.608 -15.006 -1.043 1.00 0.00 C ATOM 965 NH1 ARG A 65 -9.463 -16.320 -0.893 1.00 0.00 N ATOM 966 NH2 ARG A 65 -10.816 -14.501 -1.272 1.00 0.00 N ATOM 0 H ARG A 65 -4.001 -12.275 -0.317 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.724 -11.787 1.861 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.765 -14.476 0.821 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -6.260 -14.145 1.674 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -6.823 -12.572 -0.322 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -5.513 -13.381 -1.159 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.809 -15.170 -1.595 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -7.190 -15.372 0.104 1.00 0.00 H new ATOM 0 HE ARG A 65 -8.708 -13.194 -1.093 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.539 -16.714 -0.718 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -10.276 -16.933 -0.953 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.934 -13.495 -1.389 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -11.625 -15.120 -1.331 1.00 0.00 H new ATOM 980 N TYR A 66 -2.839 -13.200 2.584 1.00 0.00 N ATOM 981 CA TYR A 66 -1.943 -13.562 3.682 1.00 0.00 C ATOM 982 C TYR A 66 -1.791 -12.404 4.669 1.00 0.00 C ATOM 983 O TYR A 66 -2.063 -12.558 5.860 1.00 0.00 O ATOM 984 CB TYR A 66 -0.571 -13.972 3.134 1.00 0.00 C ATOM 985 CG TYR A 66 0.410 -14.416 4.200 1.00 0.00 C ATOM 986 CD1 TYR A 66 0.111 -15.472 5.051 1.00 0.00 C ATOM 987 CD2 TYR A 66 1.638 -13.781 4.349 1.00 0.00 C ATOM 988 CE1 TYR A 66 1.007 -15.883 6.022 1.00 0.00 C ATOM 989 CE2 TYR A 66 2.538 -14.186 5.316 1.00 0.00 C ATOM 990 CZ TYR A 66 2.218 -15.236 6.149 1.00 0.00 C ATOM 991 OH TYR A 66 3.115 -15.645 7.111 1.00 0.00 O ATOM 0 H TYR A 66 -2.416 -13.266 1.658 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.381 -14.408 4.213 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.705 -14.782 2.417 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.143 -13.131 2.588 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.837 -15.981 4.953 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.893 -12.958 3.698 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.759 -16.706 6.676 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.488 -13.682 5.418 1.00 0.00 H new ATOM 0 HH TYR A 66 3.919 -15.086 7.067 1.00 0.00 H new ATOM 1001 N HIS A 67 -1.354 -11.249 4.167 1.00 0.00 N ATOM 1002 CA HIS A 67 -1.166 -10.068 5.011 1.00 0.00 C ATOM 1003 C HIS A 67 -2.504 -9.563 5.552 1.00 0.00 C ATOM 1004 O HIS A 67 -2.586 -9.107 6.693 1.00 0.00 O ATOM 1005 CB HIS A 67 -0.456 -8.955 4.234 1.00 0.00 C ATOM 1006 CG HIS A 67 0.992 -9.237 3.963 1.00 0.00 C ATOM 1007 ND1 HIS A 67 2.010 -8.381 4.333 1.00 0.00 N ATOM 1008 CD2 HIS A 67 1.593 -10.288 3.355 1.00 0.00 C ATOM 1009 CE1 HIS A 67 3.170 -8.892 3.963 1.00 0.00 C ATOM 1010 NE2 HIS A 67 2.945 -10.049 3.369 1.00 0.00 N ATOM 0 H HIS A 67 -1.124 -11.106 3.184 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.541 -10.357 5.856 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -0.971 -8.801 3.286 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.537 -8.024 4.795 1.00 0.00 H new ATOM 0 HD2 HIS A 67 1.100 -11.153 2.937 1.00 0.00 H new ATOM 0 HE1 HIS A 67 4.138 -8.440 4.120 1.00 0.00 H new ATOM 0 HE2 HIS A 67 3.660 -10.666 2.983 1.00 0.00 H new ATOM 1019 N PHE A 68 -3.549 -9.656 4.728 1.00 0.00 N ATOM 1020 CA PHE A 68 -4.889 -9.217 5.123 1.00 0.00 C ATOM 1021 C PHE A 68 -5.349 -9.948 6.383 1.00 0.00 C ATOM 1022 O PHE A 68 -5.848 -9.327 7.322 1.00 0.00 O ATOM 1023 CB PHE A 68 -5.882 -9.462 3.980 1.00 0.00 C ATOM 1024 CG PHE A 68 -7.256 -8.896 4.225 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -8.126 -9.505 5.118 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -7.680 -7.756 3.559 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -9.387 -8.989 5.341 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -8.941 -7.237 3.777 1.00 0.00 C ATOM 1029 CZ PHE A 68 -9.796 -7.854 4.670 1.00 0.00 C ATOM 0 H PHE A 68 -3.493 -10.032 3.781 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.851 -8.149 5.339 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.480 -9.027 3.065 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.968 -10.536 3.812 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.813 -10.394 5.645 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.016 -7.268 2.861 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -10.053 -9.473 6.040 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -9.259 -6.350 3.250 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.782 -7.449 4.843 1.00 0.00 H new ATOM 1039 N GLU A 69 -5.178 -11.272 6.397 1.00 0.00 N ATOM 1040 CA GLU A 69 -5.574 -12.089 7.543 1.00 0.00 C ATOM 1041 C GLU A 69 -4.808 -11.684 8.801 1.00 0.00 C ATOM 1042 O GLU A 69 -5.340 -11.765 9.909 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.347 -13.574 7.247 1.00 0.00 C ATOM 1044 CG GLU A 69 -6.580 -14.280 6.704 1.00 0.00 C ATOM 1045 CD GLU A 69 -6.772 -15.660 7.299 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -7.330 -15.754 8.413 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -6.365 -16.649 6.653 1.00 0.00 O ATOM 0 H GLU A 69 -4.768 -11.800 5.627 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.636 -11.921 7.720 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.535 -13.673 6.527 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.025 -14.073 8.161 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.462 -13.674 6.911 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.498 -14.364 5.620 1.00 0.00 H new ATOM 1054 N ASP A 70 -3.560 -11.246 8.626 1.00 0.00 N ATOM 1055 CA ASP A 70 -2.730 -10.826 9.755 1.00 0.00 C ATOM 1056 C ASP A 70 -3.315 -9.593 10.447 1.00 0.00 C ATOM 1057 O ASP A 70 -3.146 -9.413 11.654 1.00 0.00 O ATOM 1058 CB ASP A 70 -1.302 -10.530 9.286 1.00 0.00 C ATOM 1059 CG ASP A 70 -0.262 -11.201 10.159 1.00 0.00 C ATOM 1060 OD1 ASP A 70 0.093 -12.364 9.871 1.00 0.00 O ATOM 1061 OD2 ASP A 70 0.197 -10.566 11.131 1.00 0.00 O ATOM 0 H ASP A 70 -3.104 -11.173 7.717 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.710 -11.645 10.474 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.182 -10.868 8.257 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -1.136 -9.453 9.289 1.00 0.00 H new ATOM 1066 N VAL A 71 -4.003 -8.749 9.679 1.00 0.00 N ATOM 1067 CA VAL A 71 -4.612 -7.538 10.221 1.00 0.00 C ATOM 1068 C VAL A 71 -5.966 -7.841 10.852 1.00 0.00 C ATOM 1069 O VAL A 71 -6.204 -7.518 12.015 1.00 0.00 O ATOM 1070 CB VAL A 71 -4.800 -6.463 9.131 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -5.214 -5.135 9.751 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -3.532 -6.303 8.302 1.00 0.00 C ATOM 0 H VAL A 71 -4.152 -8.883 8.679 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.932 -7.158 10.983 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.598 -6.791 8.465 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -5.341 -4.391 8.965 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.155 -5.261 10.287 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.443 -4.801 10.445 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.689 -5.540 7.540 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -2.709 -6.004 8.951 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.290 -7.251 7.821 1.00 0.00 H new ATOM 1082 N GLY A 72 -6.851 -8.464 10.073 1.00 0.00 N ATOM 1083 CA GLY A 72 -8.174 -8.803 10.569 1.00 0.00 C ATOM 1084 C GLY A 72 -8.150 -9.871 11.656 1.00 0.00 C ATOM 1085 O GLY A 72 -9.164 -10.107 12.314 1.00 0.00 O ATOM 0 H GLY A 72 -6.673 -8.739 9.107 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.649 -7.904 10.962 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.788 -9.152 9.739 1.00 0.00 H new ATOM 1089 N GLY A 73 -6.997 -10.516 11.843 1.00 0.00 N ATOM 1090 CA GLY A 73 -6.873 -11.554 12.853 1.00 0.00 C ATOM 1091 C GLY A 73 -6.311 -11.042 14.167 1.00 0.00 C ATOM 1092 O GLY A 73 -6.692 -11.522 15.235 1.00 0.00 O ATOM 0 H GLY A 73 -6.146 -10.336 11.311 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -7.853 -11.997 13.032 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.229 -12.347 12.473 1.00 0.00 H new ATOM 1096 N VAL A 74 -5.397 -10.075 14.094 1.00 0.00 N ATOM 1097 CA VAL A 74 -4.781 -9.512 15.296 1.00 0.00 C ATOM 1098 C VAL A 74 -5.256 -8.078 15.561 1.00 0.00 C ATOM 1099 O VAL A 74 -4.516 -7.259 16.109 1.00 0.00 O ATOM 1100 CB VAL A 74 -3.239 -9.545 15.195 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -2.602 -9.247 16.546 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -2.771 -10.895 14.665 1.00 0.00 C ATOM 0 H VAL A 74 -5.068 -9.666 13.219 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.095 -10.133 16.135 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.924 -8.771 14.495 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.517 -9.276 16.451 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.911 -8.258 16.883 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.922 -9.994 17.272 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.683 -10.903 14.599 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -3.100 -11.685 15.341 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.195 -11.064 13.675 1.00 0.00 H new ATOM 1112 N GLN A 75 -6.501 -7.782 15.180 1.00 0.00 N ATOM 1113 CA GLN A 75 -7.077 -6.451 15.387 1.00 0.00 C ATOM 1114 C GLN A 75 -8.592 -6.477 15.173 1.00 0.00 C ATOM 1115 O GLN A 75 -9.088 -6.056 14.125 1.00 0.00 O ATOM 1116 CB GLN A 75 -6.428 -5.435 14.435 1.00 0.00 C ATOM 1117 CG GLN A 75 -5.450 -4.488 15.115 1.00 0.00 C ATOM 1118 CD GLN A 75 -4.701 -3.616 14.124 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -4.733 -2.389 14.210 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -4.018 -4.248 13.174 1.00 0.00 N ATOM 0 H GLN A 75 -7.129 -8.446 14.727 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.878 -6.149 16.415 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.906 -5.975 13.645 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -7.212 -4.849 13.956 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -5.992 -3.853 15.816 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.734 -5.067 15.698 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -4.018 -5.267 13.138 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -3.494 -3.713 12.481 1.00 0.00 H new ATOM 1129 N GLY A 76 -9.324 -6.979 16.171 1.00 0.00 N ATOM 1130 CA GLY A 76 -10.775 -7.060 16.072 1.00 0.00 C ATOM 1131 C GLY A 76 -11.230 -7.791 14.822 1.00 0.00 C ATOM 1132 O GLY A 76 -10.689 -8.847 14.491 1.00 0.00 O ATOM 0 H GLY A 76 -8.936 -7.331 17.046 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.168 -7.570 16.951 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.193 -6.053 16.073 1.00 0.00 H new ATOM 1136 N ALA A 77 -12.220 -7.224 14.127 1.00 0.00 N ATOM 1137 CA ALA A 77 -12.746 -7.820 12.898 1.00 0.00 C ATOM 1138 C ALA A 77 -13.259 -9.239 13.141 1.00 0.00 C ATOM 1139 O ALA A 77 -12.513 -10.209 13.004 1.00 0.00 O ATOM 1140 CB ALA A 77 -11.670 -7.814 11.821 1.00 0.00 C ATOM 0 H ALA A 77 -12.674 -6.351 14.396 1.00 0.00 H new ATOM 0 HA ALA A 77 -13.592 -7.221 12.561 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -12.066 -8.259 10.908 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.362 -6.788 11.621 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.811 -8.391 12.162 1.00 0.00 H new ATOM 1146 N ARG A 78 -14.537 -9.355 13.511 1.00 0.00 N ATOM 1147 CA ARG A 78 -15.139 -10.660 13.780 1.00 0.00 C ATOM 1148 C ARG A 78 -15.800 -11.259 12.535 1.00 0.00 C ATOM 1149 O ARG A 78 -16.030 -12.469 12.471 1.00 0.00 O ATOM 1150 CB ARG A 78 -16.159 -10.558 14.922 1.00 0.00 C ATOM 1151 CG ARG A 78 -16.141 -11.751 15.869 1.00 0.00 C ATOM 1152 CD ARG A 78 -16.976 -11.492 17.117 1.00 0.00 C ATOM 1153 NE ARG A 78 -16.312 -11.971 18.333 1.00 0.00 N ATOM 1154 CZ ARG A 78 -16.843 -11.881 19.559 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -18.038 -11.327 19.742 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -16.173 -12.345 20.607 1.00 0.00 N ATOM 0 H ARG A 78 -15.171 -8.565 13.630 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.332 -11.329 14.078 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -15.963 -9.650 15.492 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -17.158 -10.458 14.497 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -16.522 -12.632 15.352 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -15.113 -11.971 16.158 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -17.170 -10.423 17.207 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -17.943 -11.984 17.014 1.00 0.00 H new ATOM 0 HE ARG A 78 -15.391 -12.398 18.240 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -18.560 -10.965 18.944 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -18.433 -11.264 20.680 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -15.255 -12.770 20.478 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -16.577 -12.277 21.541 1.00 0.00 H new ATOM 1170 N ALA A 79 -16.099 -10.416 11.549 1.00 0.00 N ATOM 1171 CA ALA A 79 -16.726 -10.870 10.310 1.00 0.00 C ATOM 1172 C ALA A 79 -16.127 -10.146 9.112 1.00 0.00 C ATOM 1173 O ALA A 79 -16.391 -8.963 8.899 1.00 0.00 O ATOM 1174 CB ALA A 79 -18.231 -10.653 10.363 1.00 0.00 C ATOM 0 H ALA A 79 -15.917 -9.413 11.584 1.00 0.00 H new ATOM 0 HA ALA A 79 -16.535 -11.937 10.200 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -18.681 -10.997 9.432 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -18.650 -11.214 11.198 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -18.441 -9.592 10.497 1.00 0.00 H new ATOM 1180 N VAL A 80 -15.315 -10.859 8.337 1.00 0.00 N ATOM 1181 CA VAL A 80 -14.669 -10.275 7.167 1.00 0.00 C ATOM 1182 C VAL A 80 -15.009 -11.045 5.898 1.00 0.00 C ATOM 1183 O VAL A 80 -14.751 -12.247 5.801 1.00 0.00 O ATOM 1184 CB VAL A 80 -13.136 -10.241 7.323 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -12.503 -9.404 6.220 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -12.746 -9.712 8.697 1.00 0.00 C ATOM 0 H VAL A 80 -15.089 -11.841 8.498 1.00 0.00 H new ATOM 0 HA VAL A 80 -15.048 -9.256 7.086 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.760 -11.260 7.234 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.421 -9.392 6.348 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.749 -9.835 5.250 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.885 -8.385 6.272 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.660 -9.696 8.786 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.135 -8.701 8.822 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -13.164 -10.359 9.468 1.00 0.00 H new ATOM 1196 N HIS A 81 -15.575 -10.341 4.922 1.00 0.00 N ATOM 1197 CA HIS A 81 -15.940 -10.950 3.650 1.00 0.00 C ATOM 1198 C HIS A 81 -15.061 -10.410 2.519 1.00 0.00 C ATOM 1199 O HIS A 81 -14.285 -9.470 2.718 1.00 0.00 O ATOM 1200 CB HIS A 81 -17.422 -10.701 3.350 1.00 0.00 C ATOM 1201 CG HIS A 81 -17.721 -9.323 2.842 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -16.866 -8.252 3.001 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -18.788 -8.850 2.167 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.397 -7.183 2.446 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.564 -7.517 1.930 1.00 0.00 N ATOM 0 H HIS A 81 -15.791 -9.346 4.989 1.00 0.00 H new ATOM 0 HA HIS A 81 -15.776 -12.025 3.721 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -17.760 -11.429 2.613 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -18.000 -10.875 4.258 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.658 -9.416 1.868 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -16.952 -6.199 2.418 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -19.196 -6.888 1.436 1.00 0.00 H new ATOM 1214 N VAL A 82 -15.192 -11.000 1.331 1.00 0.00 N ATOM 1215 CA VAL A 82 -14.413 -10.571 0.172 1.00 0.00 C ATOM 1216 C VAL A 82 -15.302 -9.869 -0.853 1.00 0.00 C ATOM 1217 O VAL A 82 -16.163 -10.495 -1.472 1.00 0.00 O ATOM 1218 CB VAL A 82 -13.683 -11.755 -0.501 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -12.644 -12.347 0.438 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -14.668 -12.825 -0.960 1.00 0.00 C ATOM 0 H VAL A 82 -15.829 -11.775 1.147 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.663 -9.870 0.538 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.172 -11.373 -1.385 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.141 -13.179 -0.054 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.911 -11.583 0.698 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -13.134 -12.704 1.344 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.123 -13.644 -1.429 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -15.221 -13.203 -0.100 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.365 -12.394 -1.679 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.090 -8.564 -1.027 1.00 0.00 N ATOM 1231 CA GLU A 83 -15.876 -7.777 -1.975 1.00 0.00 C ATOM 1232 C GLU A 83 -15.513 -8.131 -3.417 1.00 0.00 C ATOM 1233 O GLU A 83 -16.355 -8.614 -4.175 1.00 0.00 O ATOM 1234 CB GLU A 83 -15.662 -6.281 -1.732 1.00 0.00 C ATOM 1235 CG GLU A 83 -16.466 -5.736 -0.563 1.00 0.00 C ATOM 1236 CD GLU A 83 -17.678 -4.939 -1.003 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -17.498 -3.800 -1.480 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -18.807 -5.453 -0.868 1.00 0.00 O ATOM 0 H GLU A 83 -14.381 -8.031 -0.524 1.00 0.00 H new ATOM 0 HA GLU A 83 -16.928 -8.015 -1.819 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -14.603 -6.098 -1.551 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.930 -5.732 -2.635 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -16.791 -6.565 0.066 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -15.824 -5.103 0.050 1.00 0.00 H new ATOM 1245 N SER A 84 -14.253 -7.890 -3.787 1.00 0.00 N ATOM 1246 CA SER A 84 -13.772 -8.182 -5.136 1.00 0.00 C ATOM 1247 C SER A 84 -12.289 -7.841 -5.269 1.00 0.00 C ATOM 1248 O SER A 84 -11.730 -7.128 -4.432 1.00 0.00 O ATOM 1249 CB SER A 84 -14.579 -7.398 -6.177 1.00 0.00 C ATOM 1250 OG SER A 84 -15.545 -8.224 -6.806 1.00 0.00 O ATOM 0 H SER A 84 -13.547 -7.492 -3.168 1.00 0.00 H new ATOM 0 HA SER A 84 -13.904 -9.249 -5.315 1.00 0.00 H new ATOM 0 HB2 SER A 84 -15.075 -6.555 -5.696 1.00 0.00 H new ATOM 0 HB3 SER A 84 -13.905 -6.985 -6.928 1.00 0.00 H new ATOM 0 HG SER A 84 -16.117 -8.635 -6.125 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.657 -8.352 -6.326 1.00 0.00 N ATOM 1257 CA VAL A 85 -10.238 -8.097 -6.572 1.00 0.00 C ATOM 1258 C VAL A 85 -9.979 -7.803 -8.048 1.00 0.00 C ATOM 1259 O VAL A 85 -10.505 -8.491 -8.927 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.359 -9.286 -6.131 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.417 -9.462 -4.621 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -9.782 -10.567 -6.840 1.00 0.00 C ATOM 0 H VAL A 85 -12.105 -8.944 -7.025 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.970 -7.224 -5.977 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.328 -9.070 -6.412 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.791 -10.305 -4.329 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -9.055 -8.556 -4.135 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.446 -9.651 -4.316 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -9.148 -11.391 -6.512 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -10.821 -10.791 -6.598 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -9.680 -10.437 -7.917 1.00 0.00 H new ATOM 1272 N GLN A 86 -9.167 -6.783 -8.315 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.837 -6.403 -9.687 1.00 0.00 C ATOM 1274 C GLN A 86 -7.328 -6.435 -9.916 1.00 0.00 C ATOM 1275 O GLN A 86 -6.572 -5.760 -9.213 1.00 0.00 O ATOM 1276 CB GLN A 86 -9.398 -5.015 -10.017 1.00 0.00 C ATOM 1277 CG GLN A 86 -8.943 -3.915 -9.068 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.304 -2.747 -9.795 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -8.980 -1.787 -10.163 1.00 0.00 O ATOM 1280 NE2 GLN A 86 -6.994 -2.823 -10.009 1.00 0.00 N ATOM 0 H GLN A 86 -8.725 -6.205 -7.600 1.00 0.00 H new ATOM 0 HA GLN A 86 -9.299 -7.130 -10.355 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -9.103 -4.748 -11.032 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -10.487 -5.063 -10.004 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.798 -3.558 -8.495 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.231 -4.328 -8.354 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -6.471 -3.637 -9.687 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -6.512 -2.067 -10.495 1.00 0.00 H new ATOM 1289 N PRO A 87 -6.870 -7.228 -10.904 1.00 0.00 N ATOM 1290 CA PRO A 87 -5.442 -7.354 -11.226 1.00 0.00 C ATOM 1291 C PRO A 87 -4.801 -6.009 -11.562 1.00 0.00 C ATOM 1292 O PRO A 87 -5.459 -5.110 -12.092 1.00 0.00 O ATOM 1293 CB PRO A 87 -5.422 -8.274 -12.450 1.00 0.00 C ATOM 1294 CG PRO A 87 -6.719 -9.006 -12.410 1.00 0.00 C ATOM 1295 CD PRO A 87 -7.708 -8.068 -11.780 1.00 0.00 C ATOM 0 HA PRO A 87 -4.872 -7.740 -10.381 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.322 -7.701 -13.372 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -4.579 -8.964 -12.410 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -7.037 -9.291 -13.413 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.630 -9.925 -11.831 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -8.230 -7.472 -12.529 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.468 -8.606 -11.214 1.00 0.00 H new ATOM 1303 N LEU A 88 -3.513 -5.880 -11.251 1.00 0.00 N ATOM 1304 CA LEU A 88 -2.778 -4.648 -11.520 1.00 0.00 C ATOM 1305 C LEU A 88 -1.625 -4.906 -12.490 1.00 0.00 C ATOM 1306 O LEU A 88 -0.510 -5.231 -12.078 1.00 0.00 O ATOM 1307 CB LEU A 88 -2.256 -4.049 -10.211 1.00 0.00 C ATOM 1308 CG LEU A 88 -2.326 -2.524 -10.115 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -3.747 -2.034 -10.352 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -1.819 -2.059 -8.760 1.00 0.00 C ATOM 0 H LEU A 88 -2.957 -6.614 -10.812 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.458 -3.934 -11.985 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.824 -4.475 -9.384 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.219 -4.358 -10.078 1.00 0.00 H new ATOM 0 HG LEU A 88 -1.688 -2.099 -10.890 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.774 -0.947 -10.279 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.076 -2.339 -11.345 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.410 -2.464 -9.602 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -1.874 -0.972 -8.704 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.434 -2.494 -7.972 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.785 -2.377 -8.630 1.00 0.00 H new ATOM 1322 N SER A 89 -1.908 -4.764 -13.785 1.00 0.00 N ATOM 1323 CA SER A 89 -0.909 -4.986 -14.831 1.00 0.00 C ATOM 1324 C SER A 89 0.236 -3.974 -14.737 1.00 0.00 C ATOM 1325 O SER A 89 0.109 -2.939 -14.086 1.00 0.00 O ATOM 1326 CB SER A 89 -1.567 -4.904 -16.212 1.00 0.00 C ATOM 1327 OG SER A 89 -2.707 -4.061 -16.186 1.00 0.00 O ATOM 0 H SER A 89 -2.827 -4.495 -14.136 1.00 0.00 H new ATOM 0 HA SER A 89 -0.490 -5.982 -14.687 1.00 0.00 H new ATOM 0 HB2 SER A 89 -0.848 -4.526 -16.939 1.00 0.00 H new ATOM 0 HB3 SER A 89 -1.857 -5.902 -16.540 1.00 0.00 H new ATOM 0 HG SER A 89 -3.107 -4.024 -17.080 1.00 0.00 H new ATOM 1333 N LEU A 90 1.356 -4.286 -15.398 1.00 0.00 N ATOM 1334 CA LEU A 90 2.525 -3.406 -15.390 1.00 0.00 C ATOM 1335 C LEU A 90 2.211 -2.054 -16.035 1.00 0.00 C ATOM 1336 O LEU A 90 2.793 -1.035 -15.660 1.00 0.00 O ATOM 1337 CB LEU A 90 3.706 -4.065 -16.110 1.00 0.00 C ATOM 1338 CG LEU A 90 5.083 -3.770 -15.501 1.00 0.00 C ATOM 1339 CD1 LEU A 90 6.023 -4.954 -15.690 1.00 0.00 C ATOM 1340 CD2 LEU A 90 5.679 -2.508 -16.114 1.00 0.00 C ATOM 0 H LEU A 90 1.476 -5.140 -15.943 1.00 0.00 H new ATOM 0 HA LEU A 90 2.796 -3.234 -14.348 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.552 -5.144 -16.116 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.707 -3.737 -17.149 1.00 0.00 H new ATOM 0 HG LEU A 90 4.955 -3.606 -14.431 1.00 0.00 H new ATOM 0 HD11 LEU A 90 6.993 -4.722 -15.250 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.604 -5.833 -15.201 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.146 -5.155 -16.754 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.656 -2.314 -15.670 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.790 -2.643 -17.190 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.018 -1.663 -15.921 1.00 0.00 H new ATOM 1352 N GLU A 91 1.286 -2.046 -16.997 1.00 0.00 N ATOM 1353 CA GLU A 91 0.901 -0.811 -17.678 1.00 0.00 C ATOM 1354 C GLU A 91 0.371 0.227 -16.687 1.00 0.00 C ATOM 1355 O GLU A 91 0.481 1.430 -16.926 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.157 -1.094 -18.748 1.00 0.00 C ATOM 1357 CG GLU A 91 0.080 -0.339 -20.047 1.00 0.00 C ATOM 1358 CD GLU A 91 -1.050 -0.516 -21.044 1.00 0.00 C ATOM 1359 OE1 GLU A 91 -2.051 0.226 -20.945 1.00 0.00 O ATOM 1360 OE2 GLU A 91 -0.931 -1.391 -21.925 1.00 0.00 O ATOM 0 H GLU A 91 0.792 -2.878 -17.320 1.00 0.00 H new ATOM 0 HA GLU A 91 1.793 -0.406 -18.156 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.175 -2.164 -18.956 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.139 -0.829 -18.356 1.00 0.00 H new ATOM 0 HG2 GLU A 91 0.203 0.722 -19.828 1.00 0.00 H new ATOM 0 HG3 GLU A 91 1.012 -0.682 -20.496 1.00 0.00 H new ATOM 1367 N ASN A 92 -0.199 -0.243 -15.573 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.742 0.648 -14.547 1.00 0.00 C ATOM 1369 C ASN A 92 0.347 1.521 -13.921 1.00 0.00 C ATOM 1370 O ASN A 92 0.046 2.576 -13.359 1.00 0.00 O ATOM 1371 CB ASN A 92 -1.455 -0.157 -13.455 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.934 -0.352 -13.742 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -3.678 0.615 -13.912 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -3.369 -1.607 -13.796 1.00 0.00 N ATOM 0 H ASN A 92 -0.296 -1.236 -15.360 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.461 1.304 -15.037 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.977 -1.131 -13.357 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.339 0.353 -12.499 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.353 -1.798 -13.984 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.719 -2.379 -13.649 1.00 0.00 H new ATOM 1381 N LEU A 93 1.609 1.097 -14.019 1.00 0.00 N ATOM 1382 CA LEU A 93 2.701 1.871 -13.459 1.00 0.00 C ATOM 1383 C LEU A 93 3.057 3.030 -14.384 1.00 0.00 C ATOM 1384 O LEU A 93 3.687 2.840 -15.426 1.00 0.00 O ATOM 1385 CB LEU A 93 3.922 0.981 -13.219 1.00 0.00 C ATOM 1386 CG LEU A 93 3.780 -0.017 -12.064 1.00 0.00 C ATOM 1387 CD1 LEU A 93 3.870 -1.447 -12.578 1.00 0.00 C ATOM 1388 CD2 LEU A 93 4.840 0.242 -11.002 1.00 0.00 C ATOM 0 H LEU A 93 1.891 0.230 -14.477 1.00 0.00 H new ATOM 0 HA LEU A 93 2.381 2.279 -12.500 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.134 0.427 -14.134 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.785 1.618 -13.025 1.00 0.00 H new ATOM 0 HG LEU A 93 2.799 0.120 -11.609 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.767 -2.141 -11.744 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.072 -1.625 -13.299 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.835 -1.600 -13.060 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.724 -0.476 -10.190 1.00 0.00 H new ATOM 0 HD22 LEU A 93 5.831 0.134 -11.443 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.725 1.253 -10.612 1.00 0.00 H new ATOM 1400 N ALA A 94 2.635 4.231 -13.988 1.00 0.00 N ATOM 1401 CA ALA A 94 2.892 5.451 -14.757 1.00 0.00 C ATOM 1402 C ALA A 94 4.339 5.486 -15.234 1.00 0.00 C ATOM 1403 O ALA A 94 4.603 5.413 -16.436 1.00 0.00 O ATOM 1404 CB ALA A 94 2.573 6.683 -13.922 1.00 0.00 C ATOM 0 H ALA A 94 2.107 4.386 -13.129 1.00 0.00 H new ATOM 0 HA ALA A 94 2.242 5.452 -15.632 1.00 0.00 H new ATOM 0 HB1 ALA A 94 2.769 7.581 -14.508 1.00 0.00 H new ATOM 0 HB2 ALA A 94 1.523 6.663 -13.630 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.198 6.689 -13.029 1.00 0.00 H new ATOM 1410 N LEU A 95 5.278 5.555 -14.284 1.00 0.00 N ATOM 1411 CA LEU A 95 6.700 5.542 -14.620 1.00 0.00 C ATOM 1412 C LEU A 95 7.046 4.201 -15.260 1.00 0.00 C ATOM 1413 O LEU A 95 7.926 4.113 -16.118 1.00 0.00 O ATOM 1414 CB LEU A 95 7.563 5.769 -13.369 1.00 0.00 C ATOM 1415 CG LEU A 95 8.800 6.656 -13.568 1.00 0.00 C ATOM 1416 CD1 LEU A 95 9.729 6.068 -14.620 1.00 0.00 C ATOM 1417 CD2 LEU A 95 8.387 8.071 -13.947 1.00 0.00 C ATOM 0 H LEU A 95 5.079 5.620 -13.286 1.00 0.00 H new ATOM 0 HA LEU A 95 6.907 6.352 -15.320 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.939 6.216 -12.595 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.890 4.799 -12.994 1.00 0.00 H new ATOM 0 HG LEU A 95 9.343 6.696 -12.624 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.597 6.716 -14.742 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.057 5.078 -14.304 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.200 5.989 -15.570 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.277 8.685 -14.084 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.816 8.047 -14.875 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.772 8.495 -13.154 1.00 0.00 H new ATOM 1429 N ARG A 96 6.320 3.156 -14.839 1.00 0.00 N ATOM 1430 CA ARG A 96 6.506 1.808 -15.362 1.00 0.00 C ATOM 1431 C ARG A 96 7.933 1.309 -15.101 1.00 0.00 C ATOM 1432 O ARG A 96 8.637 0.893 -16.023 1.00 0.00 O ATOM 1433 CB ARG A 96 6.197 1.790 -16.864 1.00 0.00 C ATOM 1434 CG ARG A 96 5.219 0.703 -17.285 1.00 0.00 C ATOM 1435 CD ARG A 96 4.796 0.859 -18.741 1.00 0.00 C ATOM 1436 NE ARG A 96 4.206 2.174 -19.009 1.00 0.00 N ATOM 1437 CZ ARG A 96 4.905 3.242 -19.411 1.00 0.00 C ATOM 1438 NH1 ARG A 96 6.218 3.158 -19.614 1.00 0.00 N ATOM 1439 NH2 ARG A 96 4.286 4.401 -19.616 1.00 0.00 N ATOM 0 H ARG A 96 5.591 3.227 -14.129 1.00 0.00 H new ATOM 0 HA ARG A 96 5.819 1.136 -14.847 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.791 2.760 -17.152 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.129 1.658 -17.414 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.678 -0.275 -17.142 1.00 0.00 H new ATOM 0 HG3 ARG A 96 4.338 0.738 -16.644 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.662 0.713 -19.387 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.075 0.081 -18.993 1.00 0.00 H new ATOM 0 HE ARG A 96 3.200 2.282 -18.881 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.702 2.273 -19.463 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.740 3.979 -19.920 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.280 4.475 -19.467 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.818 5.216 -19.922 1.00 0.00 H new ATOM 1453 N GLY A 97 8.348 1.351 -13.833 1.00 0.00 N ATOM 1454 CA GLY A 97 9.682 0.890 -13.473 1.00 0.00 C ATOM 1455 C GLY A 97 9.783 -0.611 -13.612 1.00 0.00 C ATOM 1456 O GLY A 97 9.562 -1.147 -14.701 1.00 0.00 O ATOM 0 H GLY A 97 7.787 1.694 -13.053 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.423 1.370 -14.112 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.909 1.181 -12.447 1.00 0.00 H new ATOM 1460 N ARG A 98 10.070 -1.307 -12.514 1.00 0.00 N ATOM 1461 CA ARG A 98 10.131 -2.757 -12.566 1.00 0.00 C ATOM 1462 C ARG A 98 9.139 -3.349 -11.566 1.00 0.00 C ATOM 1463 O ARG A 98 9.384 -3.368 -10.359 1.00 0.00 O ATOM 1464 CB ARG A 98 11.560 -3.254 -12.277 1.00 0.00 C ATOM 1465 CG ARG A 98 12.166 -2.731 -10.975 1.00 0.00 C ATOM 1466 CD ARG A 98 13.161 -1.600 -11.217 1.00 0.00 C ATOM 1467 NE ARG A 98 14.463 -1.866 -10.601 1.00 0.00 N ATOM 1468 CZ ARG A 98 15.409 -2.643 -11.141 1.00 0.00 C ATOM 1469 NH1 ARG A 98 15.197 -3.258 -12.300 1.00 0.00 N ATOM 1470 NH2 ARG A 98 16.568 -2.806 -10.514 1.00 0.00 N ATOM 0 H ARG A 98 10.259 -0.898 -11.599 1.00 0.00 H new ATOM 0 HA ARG A 98 9.861 -3.087 -13.569 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.552 -4.344 -12.246 1.00 0.00 H new ATOM 0 HB3 ARG A 98 12.206 -2.963 -13.105 1.00 0.00 H new ATOM 0 HG2 ARG A 98 11.369 -2.378 -10.321 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.666 -3.548 -10.455 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.291 -1.456 -12.290 1.00 0.00 H new ATOM 0 HD3 ARG A 98 12.755 -0.670 -10.818 1.00 0.00 H new ATOM 0 HE ARG A 98 14.662 -1.430 -9.701 1.00 0.00 H new ATOM 0 HH11 ARG A 98 14.308 -3.139 -12.785 1.00 0.00 H new ATOM 0 HH12 ARG A 98 15.924 -3.848 -12.704 1.00 0.00 H new ATOM 0 HH21 ARG A 98 16.736 -2.339 -9.623 1.00 0.00 H new ATOM 0 HH22 ARG A 98 17.291 -3.398 -10.924 1.00 0.00 H new ATOM 1484 N CYS A 99 8.017 -3.841 -12.090 1.00 0.00 N ATOM 1485 CA CYS A 99 6.978 -4.446 -11.259 1.00 0.00 C ATOM 1486 C CYS A 99 6.238 -5.538 -12.031 1.00 0.00 C ATOM 1487 O CYS A 99 5.241 -5.269 -12.704 1.00 0.00 O ATOM 1488 CB CYS A 99 5.993 -3.377 -10.773 1.00 0.00 C ATOM 1489 SG CYS A 99 5.671 -3.427 -8.993 1.00 0.00 S ATOM 0 H CYS A 99 7.805 -3.832 -13.088 1.00 0.00 H new ATOM 0 HA CYS A 99 7.455 -4.901 -10.391 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.383 -2.393 -11.034 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.050 -3.498 -11.306 1.00 0.00 H new ATOM 0 HG CYS A 99 4.831 -2.487 -8.677 1.00 0.00 H new ATOM 1495 N GLN A 100 6.731 -6.771 -11.932 1.00 0.00 N ATOM 1496 CA GLN A 100 6.114 -7.902 -12.628 1.00 0.00 C ATOM 1497 C GLN A 100 5.090 -8.623 -11.739 1.00 0.00 C ATOM 1498 O GLN A 100 4.769 -9.792 -11.974 1.00 0.00 O ATOM 1499 CB GLN A 100 7.197 -8.881 -13.092 1.00 0.00 C ATOM 1500 CG GLN A 100 6.945 -9.467 -14.474 1.00 0.00 C ATOM 1501 CD GLN A 100 7.978 -10.510 -14.862 1.00 0.00 C ATOM 1502 OE1 GLN A 100 8.725 -10.333 -15.823 1.00 0.00 O ATOM 1503 NE2 GLN A 100 8.024 -11.608 -14.113 1.00 0.00 N ATOM 0 H GLN A 100 7.553 -7.013 -11.379 1.00 0.00 H new ATOM 0 HA GLN A 100 5.581 -7.514 -13.496 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.159 -8.369 -13.095 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.271 -9.695 -12.371 1.00 0.00 H new ATOM 0 HG2 GLN A 100 5.953 -9.917 -14.499 1.00 0.00 H new ATOM 0 HG3 GLN A 100 6.949 -8.664 -15.211 1.00 0.00 H new ATOM 0 HE21 GLN A 100 7.386 -11.715 -13.324 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.697 -12.344 -14.327 1.00 0.00 H new ATOM 1512 N GLU A 101 4.574 -7.922 -10.722 1.00 0.00 N ATOM 1513 CA GLU A 101 3.589 -8.498 -9.808 1.00 0.00 C ATOM 1514 C GLU A 101 2.857 -7.404 -9.029 1.00 0.00 C ATOM 1515 O GLU A 101 3.474 -6.653 -8.272 1.00 0.00 O ATOM 1516 CB GLU A 101 4.269 -9.459 -8.831 1.00 0.00 C ATOM 1517 CG GLU A 101 3.467 -10.720 -8.550 1.00 0.00 C ATOM 1518 CD GLU A 101 3.820 -11.863 -9.484 1.00 0.00 C ATOM 1519 OE1 GLU A 101 5.026 -12.100 -9.707 1.00 0.00 O ATOM 1520 OE2 GLU A 101 2.888 -12.525 -9.987 1.00 0.00 O ATOM 0 H GLU A 101 4.824 -6.955 -10.514 1.00 0.00 H new ATOM 0 HA GLU A 101 2.860 -9.047 -10.404 1.00 0.00 H new ATOM 0 HB2 GLU A 101 5.243 -9.741 -9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 101 4.450 -8.938 -7.891 1.00 0.00 H new ATOM 0 HG2 GLU A 101 3.639 -11.032 -7.520 1.00 0.00 H new ATOM 0 HG3 GLU A 101 2.404 -10.497 -8.642 1.00 0.00 H new ATOM 1527 N ALA A 102 1.538 -7.320 -9.218 1.00 0.00 N ATOM 1528 CA ALA A 102 0.726 -6.318 -8.530 1.00 0.00 C ATOM 1529 C ALA A 102 -0.763 -6.671 -8.578 1.00 0.00 C ATOM 1530 O ALA A 102 -1.311 -6.929 -9.650 1.00 0.00 O ATOM 1531 CB ALA A 102 0.968 -4.943 -9.134 1.00 0.00 C ATOM 0 H ALA A 102 1.012 -7.933 -9.841 1.00 0.00 H new ATOM 0 HA ALA A 102 1.027 -6.304 -7.482 1.00 0.00 H new ATOM 0 HB1 ALA A 102 0.358 -4.205 -8.614 1.00 0.00 H new ATOM 0 HB2 ALA A 102 2.021 -4.681 -9.032 1.00 0.00 H new ATOM 0 HB3 ALA A 102 0.699 -4.957 -10.190 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.408 -6.685 -7.410 1.00 0.00 N ATOM 1538 CA TRP A 103 -2.833 -7.012 -7.316 1.00 0.00 C ATOM 1539 C TRP A 103 -3.543 -6.107 -6.306 1.00 0.00 C ATOM 1540 O TRP A 103 -2.895 -5.467 -5.477 1.00 0.00 O ATOM 1541 CB TRP A 103 -3.012 -8.480 -6.915 1.00 0.00 C ATOM 1542 CG TRP A 103 -2.549 -9.445 -7.963 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -1.259 -9.801 -8.238 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -3.372 -10.178 -8.877 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -1.230 -10.711 -9.266 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -2.515 -10.962 -9.673 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.750 -10.256 -9.093 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -2.992 -11.801 -10.677 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.222 -11.091 -10.090 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -4.346 -11.857 -10.866 1.00 0.00 C ATOM 0 H TRP A 103 -0.966 -6.474 -6.515 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.281 -6.848 -8.296 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -2.462 -8.666 -5.992 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -4.065 -8.665 -6.702 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.389 -9.422 -7.722 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -0.389 -11.132 -9.662 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -5.434 -9.675 -8.493 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -2.318 -12.386 -11.284 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -6.285 -11.152 -10.272 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -4.747 -12.506 -11.630 1.00 0.00 H new ATOM 1561 N VAL A 104 -4.877 -6.064 -6.379 1.00 0.00 N ATOM 1562 CA VAL A 104 -5.675 -5.239 -5.466 1.00 0.00 C ATOM 1563 C VAL A 104 -6.797 -6.055 -4.822 1.00 0.00 C ATOM 1564 O VAL A 104 -7.485 -6.823 -5.497 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.297 -4.022 -6.188 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -6.902 -3.052 -5.183 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -5.264 -3.318 -7.058 1.00 0.00 C ATOM 0 H VAL A 104 -5.426 -6.589 -7.059 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.992 -4.883 -4.695 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.094 -4.386 -6.837 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.334 -2.203 -5.712 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.680 -3.558 -4.612 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.125 -2.700 -4.504 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.727 -2.465 -7.555 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.439 -2.971 -6.435 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.885 -4.013 -7.807 1.00 0.00 H new ATOM 1577 N LEU A 105 -6.978 -5.875 -3.511 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.020 -6.585 -2.767 1.00 0.00 C ATOM 1579 C LEU A 105 -8.907 -5.610 -1.993 1.00 0.00 C ATOM 1580 O LEU A 105 -8.413 -4.688 -1.338 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.388 -7.593 -1.803 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.312 -8.730 -1.355 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -7.516 -10.010 -1.142 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -9.061 -8.345 -0.086 1.00 0.00 C ATOM 0 H LEU A 105 -6.415 -5.242 -2.943 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.643 -7.117 -3.486 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.509 -8.026 -2.280 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.040 -7.058 -0.919 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.045 -8.908 -2.142 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.188 -10.807 -0.824 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.030 -10.296 -2.075 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.760 -9.845 -0.374 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -9.712 -9.166 0.216 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.346 -8.138 0.710 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -9.662 -7.456 -0.274 1.00 0.00 H new ATOM 1596 N SER A 106 -10.222 -5.822 -2.073 1.00 0.00 N ATOM 1597 CA SER A 106 -11.191 -4.969 -1.386 1.00 0.00 C ATOM 1598 C SER A 106 -12.141 -5.804 -0.527 1.00 0.00 C ATOM 1599 O SER A 106 -12.472 -6.938 -0.877 1.00 0.00 O ATOM 1600 CB SER A 106 -11.990 -4.143 -2.399 1.00 0.00 C ATOM 1601 OG SER A 106 -11.303 -4.037 -3.639 1.00 0.00 O ATOM 0 H SER A 106 -10.641 -6.581 -2.610 1.00 0.00 H new ATOM 0 HA SER A 106 -10.640 -4.292 -0.733 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.964 -4.605 -2.559 1.00 0.00 H new ATOM 0 HB3 SER A 106 -12.172 -3.147 -1.996 1.00 0.00 H new ATOM 0 HG SER A 106 -11.357 -4.891 -4.117 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.573 -5.235 0.601 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.478 -5.942 1.494 1.00 0.00 C ATOM 1609 C GLY A 107 -13.785 -5.157 2.758 1.00 0.00 C ATOM 1610 O GLY A 107 -13.403 -3.993 2.880 1.00 0.00 O ATOM 0 H GLY A 107 -12.312 -4.299 0.910 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.409 -6.155 0.968 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.039 -6.902 1.765 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.477 -5.798 3.700 1.00 0.00 N ATOM 1615 CA LYS A 108 -14.842 -5.158 4.967 1.00 0.00 C ATOM 1616 C LYS A 108 -14.816 -6.171 6.113 1.00 0.00 C ATOM 1617 O LYS A 108 -14.942 -7.376 5.887 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.236 -4.527 4.869 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.432 -3.643 3.644 1.00 0.00 C ATOM 1620 CD LYS A 108 -17.325 -2.451 3.948 1.00 0.00 C ATOM 1621 CE LYS A 108 -18.751 -2.678 3.465 1.00 0.00 C ATOM 1622 NZ LYS A 108 -18.865 -2.568 1.981 1.00 0.00 N ATOM 0 H LYS A 108 -14.797 -6.762 3.611 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.110 -4.376 5.171 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -16.983 -5.321 4.854 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.419 -3.934 5.765 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -15.463 -3.291 3.290 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -16.871 -4.231 2.838 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -17.330 -2.264 5.022 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -16.917 -1.560 3.471 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -19.088 -3.665 3.782 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -19.412 -1.950 3.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -19.864 -2.645 1.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -18.489 -1.649 1.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -18.321 -3.333 1.533 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.659 -5.672 7.340 1.00 0.00 N ATOM 1637 CA GLN A 109 -14.624 -6.527 8.525 1.00 0.00 C ATOM 1638 C GLN A 109 -15.590 -6.013 9.591 1.00 0.00 C ATOM 1639 O GLN A 109 -16.031 -4.862 9.532 1.00 0.00 O ATOM 1640 CB GLN A 109 -13.204 -6.597 9.096 1.00 0.00 C ATOM 1641 CG GLN A 109 -12.559 -5.237 9.324 1.00 0.00 C ATOM 1642 CD GLN A 109 -11.048 -5.321 9.459 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -10.476 -4.866 10.449 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -10.390 -5.902 8.460 1.00 0.00 N ATOM 0 H GLN A 109 -14.554 -4.677 7.538 1.00 0.00 H new ATOM 0 HA GLN A 109 -14.934 -7.529 8.228 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -13.230 -7.138 10.042 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.578 -7.175 8.416 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -12.810 -4.577 8.494 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -12.976 -4.788 10.225 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.901 -6.267 7.656 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -9.374 -5.983 8.497 1.00 0.00 H new ATOM 1653 N GLN A 110 -15.912 -6.862 10.573 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.819 -6.468 11.644 1.00 0.00 C ATOM 1655 C GLN A 110 -16.037 -6.184 12.919 1.00 0.00 C ATOM 1656 O GLN A 110 -15.853 -7.067 13.759 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.869 -7.558 11.893 1.00 0.00 C ATOM 1658 CG GLN A 110 -18.721 -7.320 13.132 1.00 0.00 C ATOM 1659 CD GLN A 110 -19.615 -8.499 13.464 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -19.187 -9.653 13.410 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -20.866 -8.218 13.809 1.00 0.00 N ATOM 0 H GLN A 110 -15.559 -7.816 10.644 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.336 -5.558 11.340 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -18.522 -7.626 11.023 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -17.365 -8.520 11.990 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -18.070 -7.113 13.981 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -19.337 -6.434 12.979 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -21.181 -7.248 13.841 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -21.512 -8.972 14.042 1.00 0.00 H new ATOM 1670 N ILE A 111 -15.565 -4.949 13.055 1.00 0.00 N ATOM 1671 CA ILE A 111 -14.795 -4.565 14.230 1.00 0.00 C ATOM 1672 C ILE A 111 -15.708 -4.272 15.418 1.00 0.00 C ATOM 1673 O ILE A 111 -16.236 -3.169 15.574 1.00 0.00 O ATOM 1674 CB ILE A 111 -13.872 -3.363 13.944 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -13.052 -3.006 15.187 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -14.665 -2.160 13.445 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -11.877 -2.103 14.892 1.00 0.00 C ATOM 0 H ILE A 111 -15.701 -4.204 12.372 1.00 0.00 H new ATOM 0 HA ILE A 111 -14.161 -5.414 14.487 1.00 0.00 H new ATOM 0 HB ILE A 111 -13.182 -3.650 13.151 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -13.702 -2.519 15.914 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -12.688 -3.924 15.649 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -13.985 -1.330 13.253 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -15.185 -2.424 12.524 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -15.393 -1.865 14.201 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -11.340 -1.890 15.817 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -11.206 -2.597 14.189 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -12.235 -1.170 14.458 1.00 0.00 H new ATOM 1689 N ALA A 112 -15.885 -5.296 16.246 1.00 0.00 N ATOM 1690 CA ALA A 112 -16.729 -5.209 17.436 1.00 0.00 C ATOM 1691 C ALA A 112 -16.080 -5.913 18.629 1.00 0.00 C ATOM 1692 O ALA A 112 -15.725 -7.091 18.546 1.00 0.00 O ATOM 1693 CB ALA A 112 -18.099 -5.814 17.153 1.00 0.00 C ATOM 0 H ALA A 112 -15.449 -6.209 16.113 1.00 0.00 H new ATOM 0 HA ALA A 112 -16.847 -4.155 17.689 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -18.719 -5.744 18.046 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -18.575 -5.271 16.337 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -17.984 -6.861 16.873 1.00 0.00 H new ATOM 1800 N ALA A 119 -20.692 -2.746 16.170 1.00 0.00 N ATOM 1801 CA ALA A 119 -19.543 -2.632 15.271 1.00 0.00 C ATOM 1802 C ALA A 119 -19.792 -1.596 14.172 1.00 0.00 C ATOM 1803 O ALA A 119 -20.822 -0.920 14.164 1.00 0.00 O ATOM 1804 CB ALA A 119 -19.227 -3.988 14.654 1.00 0.00 C ATOM 0 HA ALA A 119 -18.689 -2.296 15.858 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -18.371 -3.893 13.986 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -18.994 -4.702 15.444 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -20.090 -4.341 14.089 1.00 0.00 H new ATOM 1810 N LYS A 120 -18.842 -1.484 13.239 1.00 0.00 N ATOM 1811 CA LYS A 120 -18.956 -0.538 12.127 1.00 0.00 C ATOM 1812 C LYS A 120 -18.200 -1.049 10.903 1.00 0.00 C ATOM 1813 O LYS A 120 -17.007 -1.353 10.982 1.00 0.00 O ATOM 1814 CB LYS A 120 -18.437 0.849 12.529 1.00 0.00 C ATOM 1815 CG LYS A 120 -17.071 0.833 13.200 1.00 0.00 C ATOM 1816 CD LYS A 120 -16.931 1.966 14.204 1.00 0.00 C ATOM 1817 CE LYS A 120 -16.882 1.449 15.635 1.00 0.00 C ATOM 1818 NZ LYS A 120 -18.090 0.647 15.984 1.00 0.00 N ATOM 0 H LYS A 120 -17.985 -2.037 13.232 1.00 0.00 H new ATOM 0 HA LYS A 120 -20.012 -0.449 11.872 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -18.385 1.477 11.640 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -19.156 1.312 13.205 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.923 -0.122 13.704 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -16.291 0.918 12.443 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.024 2.531 13.990 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.769 2.655 14.095 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -15.990 0.837 15.768 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.796 2.291 16.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.477 0.979 16.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -18.807 0.758 15.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -17.829 -0.356 16.066 1.00 0.00 H new ATOM 1832 N ASP A 121 -18.905 -1.145 9.774 1.00 0.00 N ATOM 1833 CA ASP A 121 -18.308 -1.625 8.527 1.00 0.00 C ATOM 1834 C ASP A 121 -17.193 -0.697 8.062 1.00 0.00 C ATOM 1835 O ASP A 121 -17.407 0.503 7.877 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.365 -1.744 7.423 1.00 0.00 C ATOM 1837 CG ASP A 121 -20.521 -2.647 7.807 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -21.400 -2.195 8.572 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -20.552 -3.803 7.338 1.00 0.00 O ATOM 0 H ASP A 121 -19.891 -0.896 9.698 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.889 -2.611 8.726 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -19.749 -0.752 7.186 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -18.896 -2.129 6.518 1.00 0.00 H new ATOM 1844 N VAL A 122 -16.005 -1.261 7.868 1.00 0.00 N ATOM 1845 CA VAL A 122 -14.856 -0.490 7.416 1.00 0.00 C ATOM 1846 C VAL A 122 -14.397 -0.967 6.042 1.00 0.00 C ATOM 1847 O VAL A 122 -13.821 -2.050 5.911 1.00 0.00 O ATOM 1848 CB VAL A 122 -13.680 -0.587 8.412 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -12.582 0.398 8.040 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -14.164 -0.348 9.837 1.00 0.00 C ATOM 0 H VAL A 122 -15.814 -2.252 8.018 1.00 0.00 H new ATOM 0 HA VAL A 122 -15.170 0.552 7.353 1.00 0.00 H new ATOM 0 HB VAL A 122 -13.265 -1.594 8.359 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -11.762 0.315 8.753 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -12.216 0.173 7.038 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -12.980 1.412 8.062 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -13.321 -0.420 10.524 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -14.607 0.645 9.909 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -14.911 -1.098 10.098 1.00 0.00 H new ATOM 1860 N THR A 123 -14.664 -0.156 5.019 1.00 0.00 N ATOM 1861 CA THR A 123 -14.282 -0.494 3.650 1.00 0.00 C ATOM 1862 C THR A 123 -12.765 -0.531 3.510 1.00 0.00 C ATOM 1863 O THR A 123 -12.110 0.510 3.418 1.00 0.00 O ATOM 1864 CB THR A 123 -14.885 0.507 2.662 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.255 0.733 2.949 1.00 0.00 O ATOM 1866 CG2 THR A 123 -14.786 0.059 1.222 1.00 0.00 C ATOM 0 H THR A 123 -15.143 0.739 5.113 1.00 0.00 H new ATOM 0 HA THR A 123 -14.673 -1.485 3.420 1.00 0.00 H new ATOM 0 HB THR A 123 -14.301 1.419 2.783 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.622 1.377 2.308 1.00 0.00 H new ATOM 0 HG21 THR A 123 -15.232 0.814 0.575 1.00 0.00 H new ATOM 0 HG22 THR A 123 -13.738 -0.076 0.954 1.00 0.00 H new ATOM 0 HG23 THR A 123 -15.317 -0.885 1.097 1.00 0.00 H new ATOM 1874 N LEU A 124 -12.214 -1.742 3.504 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.774 -1.937 3.383 1.00 0.00 C ATOM 1876 C LEU A 124 -10.363 -2.092 1.922 1.00 0.00 C ATOM 1877 O LEU A 124 -11.034 -2.773 1.145 1.00 0.00 O ATOM 1878 CB LEU A 124 -10.338 -3.168 4.178 1.00 0.00 C ATOM 1879 CG LEU A 124 -9.881 -2.884 5.611 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -10.853 -3.491 6.611 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -8.473 -3.416 5.836 1.00 0.00 C ATOM 0 H LEU A 124 -12.748 -2.607 3.582 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.280 -1.054 3.788 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.168 -3.874 4.210 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -9.524 -3.658 3.643 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.867 -1.805 5.762 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -10.512 -3.279 7.624 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -11.843 -3.060 6.464 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -10.901 -4.570 6.463 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.164 -3.206 6.860 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.460 -4.493 5.667 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.786 -2.931 5.143 1.00 0.00 H new ATOM 1893 N HIS A 125 -9.251 -1.458 1.562 1.00 0.00 N ATOM 1894 CA HIS A 125 -8.734 -1.522 0.201 1.00 0.00 C ATOM 1895 C HIS A 125 -7.210 -1.487 0.210 1.00 0.00 C ATOM 1896 O HIS A 125 -6.608 -0.481 0.586 1.00 0.00 O ATOM 1897 CB HIS A 125 -9.280 -0.359 -0.630 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.687 -0.753 -2.013 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -10.991 -0.690 -2.462 1.00 0.00 N ATOM 1900 CD2 HIS A 125 -8.957 -1.219 -3.053 1.00 0.00 C ATOM 1901 CE1 HIS A 125 -11.043 -1.105 -3.713 1.00 0.00 C ATOM 1902 NE2 HIS A 125 -9.823 -1.429 -4.097 1.00 0.00 N ATOM 0 H HIS A 125 -8.689 -0.892 2.198 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.061 -2.460 -0.249 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -10.139 0.072 -0.116 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -8.521 0.421 -0.692 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -7.891 -1.393 -3.060 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -11.934 -1.169 -4.320 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -9.565 -1.779 -5.020 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.585 -2.589 -0.200 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.127 -2.664 -0.227 1.00 0.00 C ATOM 1913 C GLN A 126 -4.624 -3.422 -1.451 1.00 0.00 C ATOM 1914 O GLN A 126 -5.316 -4.290 -1.988 1.00 0.00 O ATOM 1915 CB GLN A 126 -4.595 -3.316 1.055 1.00 0.00 C ATOM 1916 CG GLN A 126 -5.119 -4.722 1.307 1.00 0.00 C ATOM 1917 CD GLN A 126 -4.922 -5.165 2.747 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -5.207 -4.417 3.682 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -4.431 -6.387 2.934 1.00 0.00 N ATOM 0 H GLN A 126 -7.061 -3.435 -0.515 1.00 0.00 H new ATOM 0 HA GLN A 126 -4.750 -1.643 -0.288 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -3.507 -3.350 1.007 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -4.857 -2.686 1.905 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.180 -4.761 1.060 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -4.611 -5.421 0.642 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -4.208 -6.975 2.131 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -4.278 -6.736 3.880 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.413 -3.081 -1.884 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.799 -3.716 -3.044 1.00 0.00 C ATOM 1930 C ALA A 127 -1.504 -4.428 -2.659 1.00 0.00 C ATOM 1931 O ALA A 127 -0.741 -3.936 -1.828 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.534 -2.683 -4.131 1.00 0.00 C ATOM 0 H ALA A 127 -2.836 -2.364 -1.445 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.492 -4.463 -3.429 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.075 -3.170 -4.992 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.475 -2.223 -4.433 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.862 -1.916 -3.747 1.00 0.00 H new ATOM 1938 N LEU A 128 -1.263 -5.585 -3.275 1.00 0.00 N ATOM 1939 CA LEU A 128 -0.061 -6.367 -3.003 1.00 0.00 C ATOM 1940 C LEU A 128 0.907 -6.303 -4.182 1.00 0.00 C ATOM 1941 O LEU A 128 0.572 -6.710 -5.296 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.430 -7.825 -2.707 1.00 0.00 C ATOM 1943 CG LEU A 128 0.524 -8.564 -1.762 1.00 0.00 C ATOM 1944 CD1 LEU A 128 1.927 -8.623 -2.348 1.00 0.00 C ATOM 1945 CD2 LEU A 128 0.545 -7.897 -0.394 1.00 0.00 C ATOM 0 H LEU A 128 -1.887 -6.001 -3.967 1.00 0.00 H new ATOM 0 HA LEU A 128 0.430 -5.940 -2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.431 -7.849 -2.277 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.475 -8.370 -3.650 1.00 0.00 H new ATOM 0 HG LEU A 128 0.161 -9.585 -1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 128 2.587 -9.152 -1.660 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.901 -9.149 -3.302 1.00 0.00 H new ATOM 0 HD13 LEU A 128 2.300 -7.610 -2.502 1.00 0.00 H new ATOM 0 HD21 LEU A 128 1.228 -8.436 0.263 1.00 0.00 H new ATOM 0 HD22 LEU A 128 0.880 -6.865 -0.498 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -0.458 -7.912 0.034 1.00 0.00 H new ATOM 1957 N LEU A 129 2.110 -5.794 -3.924 1.00 0.00 N ATOM 1958 CA LEU A 129 3.138 -5.677 -4.955 1.00 0.00 C ATOM 1959 C LEU A 129 4.337 -6.556 -4.616 1.00 0.00 C ATOM 1960 O LEU A 129 4.935 -6.417 -3.548 1.00 0.00 O ATOM 1961 CB LEU A 129 3.591 -4.218 -5.104 1.00 0.00 C ATOM 1962 CG LEU A 129 2.476 -3.171 -5.008 1.00 0.00 C ATOM 1963 CD1 LEU A 129 3.062 -1.791 -4.749 1.00 0.00 C ATOM 1964 CD2 LEU A 129 1.632 -3.170 -6.274 1.00 0.00 C ATOM 0 H LEU A 129 2.397 -5.455 -3.006 1.00 0.00 H new ATOM 0 HA LEU A 129 2.709 -6.011 -5.900 1.00 0.00 H new ATOM 0 HB2 LEU A 129 4.333 -4.005 -4.335 1.00 0.00 H new ATOM 0 HB3 LEU A 129 4.089 -4.106 -6.067 1.00 0.00 H new ATOM 0 HG LEU A 129 1.830 -3.431 -4.169 1.00 0.00 H new ATOM 0 HD11 LEU A 129 2.256 -1.060 -4.684 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.619 -1.802 -3.812 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.732 -1.521 -5.566 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.846 -2.420 -6.187 1.00 0.00 H new ATOM 0 HD22 LEU A 129 2.263 -2.936 -7.132 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.182 -4.153 -6.412 1.00 0.00 H new ATOM 1976 N ARG A 130 4.684 -7.462 -5.527 1.00 0.00 N ATOM 1977 CA ARG A 130 5.811 -8.366 -5.316 1.00 0.00 C ATOM 1978 C ARG A 130 6.870 -8.182 -6.402 1.00 0.00 C ATOM 1979 O ARG A 130 6.602 -8.387 -7.586 1.00 0.00 O ATOM 1980 CB ARG A 130 5.323 -9.818 -5.286 1.00 0.00 C ATOM 1981 CG ARG A 130 6.446 -10.841 -5.215 1.00 0.00 C ATOM 1982 CD ARG A 130 6.717 -11.467 -6.575 1.00 0.00 C ATOM 1983 NE ARG A 130 7.042 -12.890 -6.473 1.00 0.00 N ATOM 1984 CZ ARG A 130 7.485 -13.626 -7.494 1.00 0.00 C ATOM 1985 NH1 ARG A 130 7.638 -13.085 -8.699 1.00 0.00 N ATOM 1986 NH2 ARG A 130 7.774 -14.909 -7.309 1.00 0.00 N ATOM 0 H ARG A 130 4.202 -7.589 -6.417 1.00 0.00 H new ATOM 0 HA ARG A 130 6.268 -8.127 -4.356 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.666 -9.953 -4.427 1.00 0.00 H new ATOM 0 HB3 ARG A 130 4.725 -10.009 -6.177 1.00 0.00 H new ATOM 0 HG2 ARG A 130 7.353 -10.362 -4.847 1.00 0.00 H new ATOM 0 HG3 ARG A 130 6.184 -11.621 -4.500 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.842 -11.341 -7.212 1.00 0.00 H new ATOM 0 HD3 ARG A 130 7.541 -10.941 -7.057 1.00 0.00 H new ATOM 0 HE ARG A 130 6.923 -13.346 -5.568 1.00 0.00 H new ATOM 0 HH11 ARG A 130 7.416 -12.101 -8.848 1.00 0.00 H new ATOM 0 HH12 ARG A 130 7.977 -13.654 -9.474 1.00 0.00 H new ATOM 0 HH21 ARG A 130 7.657 -15.330 -6.387 1.00 0.00 H new ATOM 0 HH22 ARG A 130 8.113 -15.473 -8.088 1.00 0.00 H new ATOM 2000 N LEU A 131 8.075 -7.798 -5.988 1.00 0.00 N ATOM 2001 CA LEU A 131 9.179 -7.591 -6.920 1.00 0.00 C ATOM 2002 C LEU A 131 10.271 -8.634 -6.698 1.00 0.00 C ATOM 2003 O LEU A 131 10.628 -8.936 -5.557 1.00 0.00 O ATOM 2004 CB LEU A 131 9.759 -6.182 -6.763 1.00 0.00 C ATOM 2005 CG LEU A 131 8.734 -5.046 -6.803 1.00 0.00 C ATOM 2006 CD1 LEU A 131 8.147 -4.796 -5.421 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.371 -3.777 -7.347 1.00 0.00 C ATOM 0 H LEU A 131 8.311 -7.624 -5.011 1.00 0.00 H new ATOM 0 HA LEU A 131 8.793 -7.699 -7.934 1.00 0.00 H new ATOM 0 HB2 LEU A 131 10.297 -6.131 -5.816 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.491 -6.018 -7.554 1.00 0.00 H new ATOM 0 HG LEU A 131 7.923 -5.342 -7.468 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.421 -3.984 -5.475 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.654 -5.701 -5.066 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.945 -4.523 -4.731 1.00 0.00 H new ATOM 0 HD21 LEU A 131 8.630 -2.978 -7.369 1.00 0.00 H new ATOM 0 HD22 LEU A 131 10.202 -3.483 -6.705 1.00 0.00 H new ATOM 0 HD23 LEU A 131 9.739 -3.959 -8.357 1.00 0.00 H new ATOM 2019 N PRO A 132 10.817 -9.207 -7.789 1.00 0.00 N ATOM 2020 CA PRO A 132 11.868 -10.227 -7.707 1.00 0.00 C ATOM 2021 C PRO A 132 13.267 -9.645 -7.460 1.00 0.00 C ATOM 2022 O PRO A 132 14.251 -10.384 -7.449 1.00 0.00 O ATOM 2023 CB PRO A 132 11.800 -10.888 -9.079 1.00 0.00 C ATOM 2024 CG PRO A 132 11.363 -9.800 -9.997 1.00 0.00 C ATOM 2025 CD PRO A 132 10.446 -8.913 -9.191 1.00 0.00 C ATOM 0 HA PRO A 132 11.709 -10.904 -6.867 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.769 -11.291 -9.374 1.00 0.00 H new ATOM 0 HB3 PRO A 132 11.095 -11.719 -9.085 1.00 0.00 H new ATOM 0 HG2 PRO A 132 12.219 -9.238 -10.370 1.00 0.00 H new ATOM 0 HG3 PRO A 132 10.846 -10.208 -10.866 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.594 -7.860 -9.432 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.398 -9.140 -9.384 1.00 0.00 H new ATOM 2033 N GLN A 133 13.350 -8.324 -7.254 1.00 0.00 N ATOM 2034 CA GLN A 133 14.632 -7.660 -6.999 1.00 0.00 C ATOM 2035 C GLN A 133 15.387 -8.351 -5.861 1.00 0.00 C ATOM 2036 O GLN A 133 16.614 -8.453 -5.888 1.00 0.00 O ATOM 2037 CB GLN A 133 14.406 -6.182 -6.656 1.00 0.00 C ATOM 2038 CG GLN A 133 14.730 -5.221 -7.792 1.00 0.00 C ATOM 2039 CD GLN A 133 14.044 -5.591 -9.095 1.00 0.00 C ATOM 2040 OE1 GLN A 133 12.816 -5.624 -9.176 1.00 0.00 O ATOM 2041 NE2 GLN A 133 14.835 -5.872 -10.127 1.00 0.00 N ATOM 0 H GLN A 133 12.546 -7.697 -7.259 1.00 0.00 H new ATOM 0 HA GLN A 133 15.235 -7.727 -7.904 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.365 -6.044 -6.364 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.017 -5.924 -5.791 1.00 0.00 H new ATOM 0 HG2 GLN A 133 14.432 -4.213 -7.504 1.00 0.00 H new ATOM 0 HG3 GLN A 133 15.809 -5.202 -7.948 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.848 -5.833 -10.018 1.00 0.00 H new ATOM 0 HE22 GLN A 133 14.428 -6.126 -11.027 1.00 0.00 H new ATOM 2050 N TYR A 134 14.637 -8.821 -4.864 1.00 0.00 N ATOM 2051 CA TYR A 134 15.216 -9.505 -3.709 1.00 0.00 C ATOM 2052 C TYR A 134 14.111 -10.076 -2.813 1.00 0.00 C ATOM 2053 O TYR A 134 14.206 -10.025 -1.585 1.00 0.00 O ATOM 2054 CB TYR A 134 16.106 -8.545 -2.901 1.00 0.00 C ATOM 2055 CG TYR A 134 15.643 -7.104 -2.933 1.00 0.00 C ATOM 2056 CD1 TYR A 134 14.293 -6.784 -2.849 1.00 0.00 C ATOM 2057 CD2 TYR A 134 16.557 -6.067 -3.050 1.00 0.00 C ATOM 2058 CE1 TYR A 134 13.869 -5.474 -2.887 1.00 0.00 C ATOM 2059 CE2 TYR A 134 16.140 -4.751 -3.086 1.00 0.00 C ATOM 2060 CZ TYR A 134 14.795 -4.460 -3.003 1.00 0.00 C ATOM 2061 OH TYR A 134 14.375 -3.150 -3.042 1.00 0.00 O ATOM 0 H TYR A 134 13.621 -8.739 -4.834 1.00 0.00 H new ATOM 0 HA TYR A 134 15.831 -10.327 -4.074 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.140 -8.882 -1.865 1.00 0.00 H new ATOM 0 HB3 TYR A 134 17.124 -8.598 -3.287 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.565 -7.575 -2.752 1.00 0.00 H new ATOM 0 HD2 TYR A 134 17.611 -6.292 -3.114 1.00 0.00 H new ATOM 0 HE1 TYR A 134 12.816 -5.243 -2.826 1.00 0.00 H new ATOM 0 HE2 TYR A 134 16.863 -3.954 -3.179 1.00 0.00 H new ATOM 0 HH TYR A 134 15.153 -2.559 -3.125 1.00 0.00 H new ATOM 2071 N GLN A 135 13.053 -10.612 -3.440 1.00 0.00 N ATOM 2072 CA GLN A 135 11.922 -11.175 -2.701 1.00 0.00 C ATOM 2073 C GLN A 135 11.317 -10.109 -1.784 1.00 0.00 C ATOM 2074 O GLN A 135 11.506 -10.148 -0.566 1.00 0.00 O ATOM 2075 CB GLN A 135 12.361 -12.394 -1.881 1.00 0.00 C ATOM 2076 CG GLN A 135 13.076 -13.466 -2.695 1.00 0.00 C ATOM 2077 CD GLN A 135 12.119 -14.473 -3.307 1.00 0.00 C ATOM 2078 OE1 GLN A 135 11.154 -14.895 -2.671 1.00 0.00 O ATOM 2079 NE2 GLN A 135 12.384 -14.868 -4.548 1.00 0.00 N ATOM 0 H GLN A 135 12.961 -10.666 -4.454 1.00 0.00 H new ATOM 0 HA GLN A 135 11.167 -11.500 -3.416 1.00 0.00 H new ATOM 0 HB2 GLN A 135 13.021 -12.061 -1.080 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.484 -12.836 -1.409 1.00 0.00 H new ATOM 0 HG2 GLN A 135 13.652 -12.990 -3.488 1.00 0.00 H new ATOM 0 HG3 GLN A 135 13.787 -13.989 -2.055 1.00 0.00 H new ATOM 0 HE21 GLN A 135 13.195 -14.493 -5.040 1.00 0.00 H new ATOM 0 HE22 GLN A 135 11.776 -15.546 -5.008 1.00 0.00 H new ATOM 2088 N THR A 136 10.606 -9.148 -2.372 1.00 0.00 N ATOM 2089 CA THR A 136 9.998 -8.067 -1.599 1.00 0.00 C ATOM 2090 C THR A 136 8.477 -8.052 -1.754 1.00 0.00 C ATOM 2091 O THR A 136 7.939 -8.493 -2.776 1.00 0.00 O ATOM 2092 CB THR A 136 10.590 -6.721 -2.032 1.00 0.00 C ATOM 2093 OG1 THR A 136 10.100 -5.668 -1.220 1.00 0.00 O ATOM 2094 CG2 THR A 136 10.294 -6.369 -3.474 1.00 0.00 C ATOM 0 H THR A 136 10.437 -9.096 -3.377 1.00 0.00 H new ATOM 0 HA THR A 136 10.220 -8.238 -0.546 1.00 0.00 H new ATOM 0 HB THR A 136 11.668 -6.834 -1.919 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.804 -6.030 -0.359 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.742 -5.405 -3.713 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.711 -7.135 -4.128 1.00 0.00 H new ATOM 0 HG23 THR A 136 9.215 -6.314 -3.621 1.00 0.00 H new ATOM 2102 N ASP A 137 7.793 -7.537 -0.732 1.00 0.00 N ATOM 2103 CA ASP A 137 6.333 -7.451 -0.736 1.00 0.00 C ATOM 2104 C ASP A 137 5.859 -6.079 -0.243 1.00 0.00 C ATOM 2105 O ASP A 137 5.813 -5.821 0.961 1.00 0.00 O ATOM 2106 CB ASP A 137 5.738 -8.559 0.145 1.00 0.00 C ATOM 2107 CG ASP A 137 5.167 -9.723 -0.653 1.00 0.00 C ATOM 2108 OD1 ASP A 137 5.610 -9.945 -1.799 1.00 0.00 O ATOM 2109 OD2 ASP A 137 4.277 -10.419 -0.122 1.00 0.00 O ATOM 0 H ASP A 137 8.230 -7.171 0.114 1.00 0.00 H new ATOM 0 HA ASP A 137 5.989 -7.582 -1.762 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.510 -8.933 0.817 1.00 0.00 H new ATOM 0 HB3 ASP A 137 4.951 -8.134 0.768 1.00 0.00 H new ATOM 2114 N LEU A 138 5.499 -5.204 -1.186 1.00 0.00 N ATOM 2115 CA LEU A 138 5.017 -3.858 -0.860 1.00 0.00 C ATOM 2116 C LEU A 138 3.488 -3.826 -0.847 1.00 0.00 C ATOM 2117 O LEU A 138 2.846 -4.278 -1.796 1.00 0.00 O ATOM 2118 CB LEU A 138 5.546 -2.837 -1.877 1.00 0.00 C ATOM 2119 CG LEU A 138 7.019 -2.452 -1.710 1.00 0.00 C ATOM 2120 CD1 LEU A 138 7.740 -2.499 -3.048 1.00 0.00 C ATOM 2121 CD2 LEU A 138 7.141 -1.070 -1.086 1.00 0.00 C ATOM 0 H LEU A 138 5.532 -5.404 -2.186 1.00 0.00 H new ATOM 0 HA LEU A 138 5.386 -3.596 0.131 1.00 0.00 H new ATOM 0 HB2 LEU A 138 5.404 -3.240 -2.880 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.941 -1.933 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 138 7.489 -3.174 -1.042 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.785 -2.222 -2.908 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.683 -3.508 -3.457 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.269 -1.800 -3.740 1.00 0.00 H new ATOM 0 HD21 LEU A 138 8.194 -0.813 -0.975 1.00 0.00 H new ATOM 0 HD22 LEU A 138 6.654 -0.336 -1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 138 6.662 -1.069 -0.107 1.00 0.00 H new ATOM 2133 N LEU A 139 2.909 -3.295 0.229 1.00 0.00 N ATOM 2134 CA LEU A 139 1.453 -3.216 0.357 1.00 0.00 C ATOM 2135 C LEU A 139 1.016 -1.873 0.946 1.00 0.00 C ATOM 2136 O LEU A 139 1.737 -1.269 1.743 1.00 0.00 O ATOM 2137 CB LEU A 139 0.937 -4.364 1.232 1.00 0.00 C ATOM 2138 CG LEU A 139 -0.577 -4.374 1.471 1.00 0.00 C ATOM 2139 CD1 LEU A 139 -1.117 -5.796 1.445 1.00 0.00 C ATOM 2140 CD2 LEU A 139 -0.916 -3.695 2.791 1.00 0.00 C ATOM 0 H LEU A 139 3.423 -2.914 1.023 1.00 0.00 H new ATOM 0 HA LEU A 139 1.025 -3.302 -0.642 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.222 -5.309 0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.441 -4.318 2.198 1.00 0.00 H new ATOM 0 HG LEU A 139 -1.053 -3.814 0.666 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -2.193 -5.780 1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -0.911 -6.246 0.474 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -0.634 -6.383 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.995 -3.712 2.942 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -0.426 -4.224 3.609 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.569 -2.662 2.768 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.177 -1.424 0.554 1.00 0.00 N ATOM 2153 CA LEU A 140 -0.734 -0.162 1.039 1.00 0.00 C ATOM 2154 C LEU A 140 -2.152 -0.371 1.573 1.00 0.00 C ATOM 2155 O LEU A 140 -3.007 -0.922 0.881 1.00 0.00 O ATOM 2156 CB LEU A 140 -0.749 0.884 -0.082 1.00 0.00 C ATOM 2157 CG LEU A 140 -1.489 0.463 -1.357 1.00 0.00 C ATOM 2158 CD1 LEU A 140 -2.231 1.645 -1.961 1.00 0.00 C ATOM 2159 CD2 LEU A 140 -0.515 -0.134 -2.365 1.00 0.00 C ATOM 0 H LEU A 140 -0.779 -1.920 -0.103 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.102 0.199 1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -1.207 1.796 0.300 1.00 0.00 H new ATOM 0 HB3 LEU A 140 0.281 1.129 -0.343 1.00 0.00 H new ATOM 0 HG LEU A 140 -2.222 -0.300 -1.094 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -2.750 1.326 -2.865 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -2.956 2.025 -1.242 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.520 2.432 -2.210 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -1.057 -0.428 -3.264 1.00 0.00 H new ATOM 0 HD22 LEU A 140 0.242 0.607 -2.623 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -0.032 -1.009 -1.930 1.00 0.00 H new ATOM 2171 N THR A 141 -2.389 0.068 2.809 1.00 0.00 N ATOM 2172 CA THR A 141 -3.699 -0.074 3.445 1.00 0.00 C ATOM 2173 C THR A 141 -4.541 1.192 3.278 1.00 0.00 C ATOM 2174 O THR A 141 -4.086 2.297 3.580 1.00 0.00 O ATOM 2175 CB THR A 141 -3.538 -0.392 4.937 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.445 -1.270 5.154 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.767 -1.026 5.554 1.00 0.00 C ATOM 0 H THR A 141 -1.688 0.526 3.392 1.00 0.00 H new ATOM 0 HA THR A 141 -4.216 -0.898 2.953 1.00 0.00 H new ATOM 0 HB THR A 141 -3.368 0.572 5.416 1.00 0.00 H new ATOM 0 HG1 THR A 141 -2.361 -1.457 6.112 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.583 -1.224 6.610 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.615 -0.348 5.454 1.00 0.00 H new ATOM 0 HG23 THR A 141 -4.989 -1.963 5.043 1.00 0.00 H new ATOM 2185 N PHE A 142 -5.775 1.014 2.804 1.00 0.00 N ATOM 2186 CA PHE A 142 -6.699 2.128 2.602 1.00 0.00 C ATOM 2187 C PHE A 142 -7.976 1.914 3.414 1.00 0.00 C ATOM 2188 O PHE A 142 -8.676 0.917 3.230 1.00 0.00 O ATOM 2189 CB PHE A 142 -7.043 2.263 1.114 1.00 0.00 C ATOM 2190 CG PHE A 142 -7.423 3.657 0.696 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -8.460 4.331 1.323 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -6.744 4.290 -0.332 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -8.810 5.609 0.935 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -7.091 5.568 -0.727 1.00 0.00 C ATOM 2195 CZ PHE A 142 -8.125 6.228 -0.094 1.00 0.00 C ATOM 0 H PHE A 142 -6.158 0.103 2.552 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.217 3.045 2.941 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.186 1.939 0.523 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -7.866 1.588 0.880 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -9.001 3.850 2.125 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -5.934 3.779 -0.831 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -9.617 6.124 1.434 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -6.554 6.050 -1.530 1.00 0.00 H new ATOM 0 HZ PHE A 142 -8.398 7.226 -0.402 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.271 2.853 4.312 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.464 2.763 5.154 1.00 0.00 C ATOM 2207 C ASN A 143 -10.453 3.874 4.822 1.00 0.00 C ATOM 2208 O ASN A 143 -10.067 5.036 4.676 1.00 0.00 O ATOM 2209 CB ASN A 143 -9.083 2.834 6.635 1.00 0.00 C ATOM 2210 CG ASN A 143 -7.928 1.914 6.991 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -8.052 0.692 6.923 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -6.798 2.499 7.372 1.00 0.00 N ATOM 0 H ASN A 143 -7.702 3.683 4.475 1.00 0.00 H new ATOM 0 HA ASN A 143 -9.940 1.803 4.954 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.815 3.860 6.888 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -9.950 2.572 7.241 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -5.989 1.931 7.622 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -6.739 3.516 7.414 1.00 0.00 H new ATOM 2219 N GLN A 144 -11.730 3.512 4.706 1.00 0.00 N ATOM 2220 CA GLN A 144 -12.778 4.479 4.392 1.00 0.00 C ATOM 2221 C GLN A 144 -13.937 4.366 5.385 1.00 0.00 C ATOM 2222 O GLN A 144 -14.743 3.435 5.305 1.00 0.00 O ATOM 2223 CB GLN A 144 -13.291 4.264 2.966 1.00 0.00 C ATOM 2224 CG GLN A 144 -12.189 4.197 1.918 1.00 0.00 C ATOM 2225 CD GLN A 144 -12.476 3.179 0.832 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -11.996 2.046 0.884 1.00 0.00 O ATOM 2227 NE2 GLN A 144 -13.264 3.574 -0.162 1.00 0.00 N ATOM 0 H GLN A 144 -12.063 2.555 4.825 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.351 5.479 4.469 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -13.867 3.339 2.933 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -13.974 5.074 2.710 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -12.064 5.180 1.465 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -11.246 3.948 2.404 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -13.642 4.522 -0.168 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -13.492 2.930 -0.919 1.00 0.00 H new ATOM 2236 N PRO A 145 -14.032 5.313 6.339 1.00 0.00 N ATOM 2237 CA PRO A 145 -15.097 5.315 7.351 1.00 0.00 C ATOM 2238 C PRO A 145 -16.442 5.780 6.790 1.00 0.00 C ATOM 2239 O PRO A 145 -16.490 6.516 5.802 1.00 0.00 O ATOM 2240 CB PRO A 145 -14.581 6.306 8.395 1.00 0.00 C ATOM 2241 CG PRO A 145 -13.725 7.252 7.627 1.00 0.00 C ATOM 2242 CD PRO A 145 -13.107 6.453 6.510 1.00 0.00 C ATOM 0 HA PRO A 145 -15.289 4.316 7.743 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -15.403 6.826 8.888 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -14.011 5.800 9.174 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -14.316 8.079 7.233 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -12.956 7.686 8.266 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -13.024 7.041 5.596 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -12.102 6.118 6.766 1.00 0.00 H new ATOM 2473 N PRO A 162 -16.063 12.566 -2.138 1.00 0.00 N ATOM 2474 CA PRO A 162 -15.792 11.138 -1.923 1.00 0.00 C ATOM 2475 C PRO A 162 -14.855 10.555 -2.980 1.00 0.00 C ATOM 2476 O PRO A 162 -15.173 10.551 -4.170 1.00 0.00 O ATOM 2477 CB PRO A 162 -17.180 10.494 -2.019 1.00 0.00 C ATOM 2478 CG PRO A 162 -17.969 11.419 -2.879 1.00 0.00 C ATOM 2479 CD PRO A 162 -17.449 12.801 -2.593 1.00 0.00 C ATOM 0 HA PRO A 162 -15.289 10.958 -0.973 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -17.124 9.497 -2.457 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -17.634 10.385 -1.034 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -17.850 11.168 -3.933 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -19.033 11.349 -2.653 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -17.477 13.431 -3.482 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -18.042 13.302 -1.828 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.698 10.063 -2.537 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.715 9.476 -3.446 1.00 0.00 C ATOM 2489 C TRP A 163 -13.062 8.020 -3.759 1.00 0.00 C ATOM 2490 O TRP A 163 -13.653 7.322 -2.933 1.00 0.00 O ATOM 2491 CB TRP A 163 -11.308 9.555 -2.843 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.641 10.880 -3.057 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -10.719 11.667 -4.169 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.792 11.571 -2.134 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -9.973 12.807 -3.994 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -9.392 12.771 -2.751 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.330 11.291 -0.845 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -8.557 13.689 -2.123 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.499 12.204 -0.223 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -8.120 13.390 -0.861 1.00 0.00 C ATOM 0 H TRP A 163 -13.419 10.059 -1.556 1.00 0.00 H new ATOM 0 HA TRP A 163 -12.736 10.047 -4.374 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.368 9.356 -1.773 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -10.689 8.771 -3.279 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -11.285 11.428 -5.057 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -9.868 13.558 -4.676 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -9.617 10.378 -0.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -8.264 14.605 -2.614 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -8.136 11.998 0.773 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.470 14.083 -0.348 1.00 0.00 H new ATOM 2511 N SER A 164 -12.688 7.572 -4.958 1.00 0.00 N ATOM 2512 CA SER A 164 -12.956 6.201 -5.387 1.00 0.00 C ATOM 2513 C SER A 164 -11.653 5.479 -5.754 1.00 0.00 C ATOM 2514 O SER A 164 -10.569 5.892 -5.337 1.00 0.00 O ATOM 2515 CB SER A 164 -13.922 6.205 -6.577 1.00 0.00 C ATOM 2516 OG SER A 164 -14.526 4.934 -6.746 1.00 0.00 O ATOM 0 H SER A 164 -12.198 8.140 -5.649 1.00 0.00 H new ATOM 0 HA SER A 164 -13.417 5.662 -4.559 1.00 0.00 H new ATOM 0 HB2 SER A 164 -14.693 6.960 -6.422 1.00 0.00 H new ATOM 0 HB3 SER A 164 -13.385 6.480 -7.485 1.00 0.00 H new ATOM 0 HG SER A 164 -15.139 4.962 -7.510 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.764 4.398 -6.537 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.593 3.619 -6.957 1.00 0.00 C ATOM 2524 C LEU A 165 -9.544 4.503 -7.635 1.00 0.00 C ATOM 2525 O LEU A 165 -8.348 4.220 -7.557 1.00 0.00 O ATOM 2526 CB LEU A 165 -11.008 2.490 -7.907 1.00 0.00 C ATOM 2527 CG LEU A 165 -10.618 1.081 -7.456 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -9.110 0.967 -7.290 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -11.328 0.723 -6.159 1.00 0.00 C ATOM 0 H LEU A 165 -12.652 4.044 -6.892 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.150 3.189 -6.059 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -12.090 2.526 -8.037 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -10.563 2.677 -8.884 1.00 0.00 H new ATOM 0 HG LEU A 165 -10.929 0.376 -8.226 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -8.855 -0.043 -6.969 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -8.622 1.180 -8.241 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -8.771 1.683 -6.541 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -11.040 -0.282 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -11.047 1.434 -5.382 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -12.407 0.760 -6.312 1.00 0.00 H new ATOM 2541 N GLY A 166 -9.999 5.573 -8.294 1.00 0.00 N ATOM 2542 CA GLY A 166 -9.086 6.483 -8.968 1.00 0.00 C ATOM 2543 C GLY A 166 -7.995 6.998 -8.047 1.00 0.00 C ATOM 2544 O GLY A 166 -6.832 7.083 -8.441 1.00 0.00 O ATOM 0 H GLY A 166 -10.985 5.823 -8.371 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.630 5.973 -9.817 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.648 7.327 -9.368 1.00 0.00 H new ATOM 2548 N ASP A 167 -8.373 7.334 -6.812 1.00 0.00 N ATOM 2549 CA ASP A 167 -7.417 7.833 -5.827 1.00 0.00 C ATOM 2550 C ASP A 167 -6.428 6.737 -5.436 1.00 0.00 C ATOM 2551 O ASP A 167 -5.223 6.980 -5.347 1.00 0.00 O ATOM 2552 CB ASP A 167 -8.146 8.355 -4.584 1.00 0.00 C ATOM 2553 CG ASP A 167 -7.381 9.471 -3.896 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -7.442 10.619 -4.384 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -6.723 9.197 -2.872 1.00 0.00 O ATOM 0 H ASP A 167 -9.333 7.269 -6.473 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.864 8.657 -6.277 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -9.134 8.717 -4.870 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -8.297 7.535 -3.882 1.00 0.00 H new ATOM 2560 N PHE A 168 -6.945 5.528 -5.213 1.00 0.00 N ATOM 2561 CA PHE A 168 -6.109 4.386 -4.845 1.00 0.00 C ATOM 2562 C PHE A 168 -5.074 4.102 -5.934 1.00 0.00 C ATOM 2563 O PHE A 168 -3.911 3.821 -5.636 1.00 0.00 O ATOM 2564 CB PHE A 168 -6.976 3.143 -4.610 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.203 1.940 -4.140 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -5.428 1.205 -5.024 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -6.256 1.542 -2.814 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -4.719 0.100 -4.593 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.550 0.439 -2.377 1.00 0.00 C ATOM 2570 CZ PHE A 168 -4.780 -0.283 -3.267 1.00 0.00 C ATOM 0 H PHE A 168 -7.940 5.315 -5.281 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.585 4.631 -3.921 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -7.743 3.381 -3.872 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.492 2.892 -5.537 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -5.378 1.500 -6.062 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -6.857 2.102 -2.113 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -4.118 -0.463 -5.292 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.600 0.141 -1.340 1.00 0.00 H new ATOM 0 HZ PHE A 168 -4.226 -1.146 -2.927 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.506 4.181 -7.195 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.620 3.940 -8.335 1.00 0.00 C ATOM 2582 C GLU A 169 -3.372 4.819 -8.248 1.00 0.00 C ATOM 2583 O GLU A 169 -2.266 4.368 -8.548 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.356 4.204 -9.653 1.00 0.00 C ATOM 2585 CG GLU A 169 -6.082 2.982 -10.201 1.00 0.00 C ATOM 2586 CD GLU A 169 -6.785 3.250 -11.519 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -7.352 4.352 -11.684 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -6.772 2.353 -12.389 1.00 0.00 O ATOM 0 H GLU A 169 -6.466 4.411 -7.452 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.311 2.895 -8.307 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.077 5.007 -9.502 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -4.639 4.554 -10.396 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -5.366 2.171 -10.336 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -6.814 2.642 -9.468 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.557 6.071 -7.827 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.445 7.008 -7.686 1.00 0.00 C ATOM 2597 C GLN A 170 -1.448 6.511 -6.636 1.00 0.00 C ATOM 2598 O GLN A 170 -0.233 6.677 -6.789 1.00 0.00 O ATOM 2599 CB GLN A 170 -2.970 8.400 -7.312 1.00 0.00 C ATOM 2600 CG GLN A 170 -1.892 9.474 -7.241 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.212 9.716 -8.574 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -1.671 10.528 -9.380 1.00 0.00 O ATOM 2603 NE2 GLN A 170 -0.113 9.012 -8.815 1.00 0.00 N ATOM 0 H GLN A 170 -4.467 6.458 -7.578 1.00 0.00 H new ATOM 0 HA GLN A 170 -1.926 7.075 -8.642 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -3.720 8.702 -8.043 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -3.472 8.340 -6.346 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -2.337 10.406 -6.891 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -1.143 9.182 -6.505 1.00 0.00 H new ATOM 0 HE21 GLN A 170 0.232 8.351 -8.119 1.00 0.00 H new ATOM 0 HE22 GLN A 170 0.387 9.132 -9.696 1.00 0.00 H new ATOM 2612 N LEU A 171 -1.962 5.889 -5.571 1.00 0.00 N ATOM 2613 CA LEU A 171 -1.106 5.360 -4.512 1.00 0.00 C ATOM 2614 C LEU A 171 -0.206 4.247 -5.046 1.00 0.00 C ATOM 2615 O LEU A 171 0.919 4.075 -4.582 1.00 0.00 O ATOM 2616 CB LEU A 171 -1.946 4.843 -3.339 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.444 5.250 -1.949 1.00 0.00 C ATOM 2618 CD1 LEU A 171 -0.087 4.622 -1.658 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -1.367 6.766 -1.829 1.00 0.00 C ATOM 0 H LEU A 171 -2.960 5.741 -5.422 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.476 6.174 -4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -2.968 5.202 -3.458 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -1.983 3.755 -3.391 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.156 4.881 -1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.249 4.925 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.173 3.536 -1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.635 4.955 -2.403 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -1.009 7.035 -0.835 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.680 7.156 -2.580 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -2.357 7.194 -1.986 1.00 0.00 H new ATOM 2631 N VAL A 172 -0.699 3.498 -6.035 1.00 0.00 N ATOM 2632 CA VAL A 172 0.082 2.419 -6.631 1.00 0.00 C ATOM 2633 C VAL A 172 1.304 2.988 -7.352 1.00 0.00 C ATOM 2634 O VAL A 172 2.383 2.393 -7.333 1.00 0.00 O ATOM 2635 CB VAL A 172 -0.750 1.580 -7.627 1.00 0.00 C ATOM 2636 CG1 VAL A 172 0.057 0.391 -8.135 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.056 1.115 -6.989 1.00 0.00 C ATOM 0 H VAL A 172 -1.629 3.620 -6.436 1.00 0.00 H new ATOM 0 HA VAL A 172 0.397 1.765 -5.818 1.00 0.00 H new ATOM 0 HB VAL A 172 -0.998 2.213 -8.479 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -0.547 -0.186 -8.835 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.954 0.749 -8.640 1.00 0.00 H new ATOM 0 HG13 VAL A 172 0.342 -0.241 -7.294 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.624 0.527 -7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -1.836 0.503 -6.114 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -2.642 1.983 -6.687 1.00 0.00 H new ATOM 2647 N THR A 173 1.128 4.154 -7.973 1.00 0.00 N ATOM 2648 CA THR A 173 2.214 4.820 -8.686 1.00 0.00 C ATOM 2649 C THR A 173 3.131 5.579 -7.723 1.00 0.00 C ATOM 2650 O THR A 173 4.146 6.143 -8.139 1.00 0.00 O ATOM 2651 CB THR A 173 1.659 5.781 -9.735 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.480 6.422 -9.270 1.00 0.00 O ATOM 2653 CG2 THR A 173 1.336 5.107 -11.049 1.00 0.00 C ATOM 0 H THR A 173 0.241 4.657 -7.996 1.00 0.00 H new ATOM 0 HA THR A 173 2.801 4.048 -9.183 1.00 0.00 H new ATOM 0 HB THR A 173 2.453 6.509 -9.904 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.502 6.478 -8.292 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.946 5.845 -11.750 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.241 4.658 -11.460 1.00 0.00 H new ATOM 0 HG23 THR A 173 0.588 4.331 -10.886 1.00 0.00 H new ATOM 2661 N SER A 174 2.776 5.585 -6.436 1.00 0.00 N ATOM 2662 CA SER A 174 3.570 6.267 -5.414 1.00 0.00 C ATOM 2663 C SER A 174 4.926 5.581 -5.165 1.00 0.00 C ATOM 2664 O SER A 174 5.655 5.960 -4.247 1.00 0.00 O ATOM 2665 CB SER A 174 2.782 6.349 -4.107 1.00 0.00 C ATOM 2666 OG SER A 174 1.630 7.154 -4.268 1.00 0.00 O ATOM 0 H SER A 174 1.940 5.123 -6.077 1.00 0.00 H new ATOM 0 HA SER A 174 3.778 7.270 -5.786 1.00 0.00 H new ATOM 0 HB2 SER A 174 2.491 5.348 -3.789 1.00 0.00 H new ATOM 0 HB3 SER A 174 3.414 6.762 -3.321 1.00 0.00 H new ATOM 0 HG SER A 174 1.318 7.457 -3.390 1.00 0.00 H new ATOM 2672 N LEU A 175 5.273 4.582 -5.972 1.00 0.00 N ATOM 2673 CA LEU A 175 6.549 3.895 -5.812 1.00 0.00 C ATOM 2674 C LEU A 175 7.395 4.016 -7.087 1.00 0.00 C ATOM 2675 O LEU A 175 8.120 3.088 -7.455 1.00 0.00 O ATOM 2676 CB LEU A 175 6.318 2.423 -5.451 1.00 0.00 C ATOM 2677 CG LEU A 175 7.568 1.648 -5.016 1.00 0.00 C ATOM 2678 CD1 LEU A 175 7.652 1.569 -3.499 1.00 0.00 C ATOM 2679 CD2 LEU A 175 7.563 0.254 -5.629 1.00 0.00 C ATOM 0 H LEU A 175 4.694 4.233 -6.736 1.00 0.00 H new ATOM 0 HA LEU A 175 7.097 4.369 -4.998 1.00 0.00 H new ATOM 0 HB2 LEU A 175 5.583 2.375 -4.647 1.00 0.00 H new ATOM 0 HB3 LEU A 175 5.881 1.919 -6.313 1.00 0.00 H new ATOM 0 HG LEU A 175 8.448 2.181 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 175 8.546 1.015 -3.212 1.00 0.00 H new ATOM 0 HD12 LEU A 175 7.700 2.576 -3.084 1.00 0.00 H new ATOM 0 HD13 LEU A 175 6.770 1.059 -3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 175 8.455 -0.286 -5.313 1.00 0.00 H new ATOM 0 HD22 LEU A 175 6.676 -0.286 -5.298 1.00 0.00 H new ATOM 0 HD23 LEU A 175 7.554 0.335 -6.716 1.00 0.00 H new ATOM 2691 N THR A 176 7.301 5.170 -7.757 1.00 0.00 N ATOM 2692 CA THR A 176 8.062 5.411 -8.984 1.00 0.00 C ATOM 2693 C THR A 176 9.561 5.368 -8.699 1.00 0.00 C ATOM 2694 O THR A 176 10.090 6.215 -7.976 1.00 0.00 O ATOM 2695 CB THR A 176 7.684 6.759 -9.611 1.00 0.00 C ATOM 2696 OG1 THR A 176 7.886 7.827 -8.698 1.00 0.00 O ATOM 2697 CG2 THR A 176 6.248 6.820 -10.084 1.00 0.00 C ATOM 0 H THR A 176 6.707 5.948 -7.470 1.00 0.00 H new ATOM 0 HA THR A 176 7.814 4.621 -9.693 1.00 0.00 H new ATOM 0 HB THR A 176 8.340 6.860 -10.476 1.00 0.00 H new ATOM 0 HG1 THR A 176 8.314 8.577 -9.161 1.00 0.00 H new ATOM 0 HG21 THR A 176 6.049 7.801 -10.516 1.00 0.00 H new ATOM 0 HG22 THR A 176 6.080 6.050 -10.837 1.00 0.00 H new ATOM 0 HG23 THR A 176 5.579 6.653 -9.239 1.00 0.00 H new ATOM 2705 N LEU A 177 10.240 4.371 -9.262 1.00 0.00 N ATOM 2706 CA LEU A 177 11.676 4.214 -9.060 1.00 0.00 C ATOM 2707 C LEU A 177 12.461 5.152 -9.975 1.00 0.00 C ATOM 2708 O LEU A 177 12.499 4.963 -11.191 1.00 0.00 O ATOM 2709 CB LEU A 177 12.094 2.761 -9.305 1.00 0.00 C ATOM 2710 CG LEU A 177 13.596 2.482 -9.200 1.00 0.00 C ATOM 2711 CD1 LEU A 177 14.160 3.048 -7.902 1.00 0.00 C ATOM 2712 CD2 LEU A 177 13.865 0.990 -9.295 1.00 0.00 C ATOM 0 H LEU A 177 9.818 3.661 -9.861 1.00 0.00 H new ATOM 0 HA LEU A 177 11.904 4.475 -8.027 1.00 0.00 H new ATOM 0 HB2 LEU A 177 11.573 2.125 -8.589 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.756 2.466 -10.298 1.00 0.00 H new ATOM 0 HG LEU A 177 14.097 2.977 -10.032 1.00 0.00 H new ATOM 0 HD11 LEU A 177 15.228 2.839 -7.848 1.00 0.00 H new ATOM 0 HD12 LEU A 177 14.000 4.126 -7.875 1.00 0.00 H new ATOM 0 HD13 LEU A 177 13.656 2.585 -7.054 1.00 0.00 H new ATOM 0 HD21 LEU A 177 14.937 0.808 -9.219 1.00 0.00 H new ATOM 0 HD22 LEU A 177 13.351 0.475 -8.483 1.00 0.00 H new ATOM 0 HD23 LEU A 177 13.500 0.615 -10.251 1.00 0.00 H new ATOM 2724 N HIS A 178 13.085 6.164 -9.374 1.00 0.00 N ATOM 2725 CA HIS A 178 13.878 7.138 -10.122 1.00 0.00 C ATOM 2726 C HIS A 178 15.356 7.013 -9.763 1.00 0.00 C ATOM 2727 O HIS A 178 16.197 6.791 -10.635 1.00 0.00 O ATOM 2728 CB HIS A 178 13.391 8.561 -9.833 1.00 0.00 C ATOM 2729 CG HIS A 178 11.974 8.805 -10.247 1.00 0.00 C ATOM 2730 ND1 HIS A 178 11.614 9.170 -11.527 1.00 0.00 N ATOM 2731 CD2 HIS A 178 10.821 8.733 -9.541 1.00 0.00 C ATOM 2732 CE1 HIS A 178 10.301 9.312 -11.590 1.00 0.00 C ATOM 2733 NE2 HIS A 178 9.799 9.053 -10.398 1.00 0.00 N ATOM 0 H HIS A 178 13.056 6.331 -8.368 1.00 0.00 H new ATOM 0 HA HIS A 178 13.755 6.932 -11.185 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.488 8.760 -8.766 1.00 0.00 H new ATOM 0 HB3 HIS A 178 14.039 9.270 -10.349 1.00 0.00 H new ATOM 0 HD1 HIS A 178 12.260 9.309 -12.304 1.00 0.00 H new ATOM 0 HD2 HIS A 178 10.724 8.472 -8.497 1.00 0.00 H new ATOM 0 HE1 HIS A 178 9.736 9.592 -12.467 1.00 0.00 H new ATOM 2742 N ASP A 179 15.660 7.155 -8.474 1.00 0.00 N ATOM 2743 CA ASP A 179 17.031 7.056 -7.990 1.00 0.00 C ATOM 2744 C ASP A 179 17.186 5.843 -7.073 1.00 0.00 C ATOM 2745 O ASP A 179 16.785 5.883 -5.908 1.00 0.00 O ATOM 2746 CB ASP A 179 17.423 8.335 -7.244 1.00 0.00 C ATOM 2747 CG ASP A 179 17.488 9.541 -8.161 1.00 0.00 C ATOM 2748 OD1 ASP A 179 16.442 10.199 -8.352 1.00 0.00 O ATOM 2749 OD2 ASP A 179 18.583 9.827 -8.690 1.00 0.00 O ATOM 0 H ASP A 179 14.970 7.340 -7.745 1.00 0.00 H new ATOM 0 HA ASP A 179 17.693 6.932 -8.847 1.00 0.00 H new ATOM 0 HB2 ASP A 179 16.702 8.525 -6.449 1.00 0.00 H new ATOM 0 HB3 ASP A 179 18.393 8.192 -6.767 1.00 0.00 H new ATOM 2754 N PRO A 180 17.769 4.740 -7.590 1.00 0.00 N ATOM 2755 CA PRO A 180 17.973 3.510 -6.812 1.00 0.00 C ATOM 2756 C PRO A 180 19.066 3.662 -5.751 1.00 0.00 C ATOM 2757 O PRO A 180 20.098 2.988 -5.803 1.00 0.00 O ATOM 2758 CB PRO A 180 18.384 2.486 -7.876 1.00 0.00 C ATOM 2759 CG PRO A 180 19.016 3.299 -8.949 1.00 0.00 C ATOM 2760 CD PRO A 180 18.273 4.607 -8.973 1.00 0.00 C ATOM 0 HA PRO A 180 17.082 3.227 -6.252 1.00 0.00 H new ATOM 0 HB2 PRO A 180 19.081 1.751 -7.472 1.00 0.00 H new ATOM 0 HB3 PRO A 180 17.522 1.935 -8.251 1.00 0.00 H new ATOM 0 HG2 PRO A 180 20.075 3.456 -8.746 1.00 0.00 H new ATOM 0 HG3 PRO A 180 18.947 2.794 -9.912 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.927 5.436 -9.244 1.00 0.00 H new ATOM 0 HD3 PRO A 180 17.459 4.594 -9.698 1.00 0.00 H new