USER MOD reduce.3.24.130724 H: found=0, std=0, add=805, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 803 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 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 186 GLN : amide:sc= -0.237 X(o=-0.24,f=-0.57) USER MOD Set 2.1: A 170 ASN : amide:sc= 1.01 K(o=1.5,f=-0.6) USER MOD Set 2.2: A 171 ASN : amide:sc= 0.447 K(o=1.5,f=-3.2!) USER MOD Set 3.1: A 132 SER OG : rot 180:sc= 0.041 USER MOD Set 3.2: A 163 TYR OH : rot 180:sc= 0.416 USER MOD Set 3.3: A 217 GLN : amide:sc= 0.284 K(o=0.74,f=0.2) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -154:sc= 0 (180deg=-0.532) USER MOD Single : A 134 MET CE :methyl -166:sc= -0.696 (180deg=-0.911) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS :FLIP no HD1:sc= -0.177 F(o=-0.85,f=-0.18) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.0364 F(o=-0.62,f=-0.036) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot 180:sc= -0.0188 USER MOD Single : A 153 ASN : amide:sc= 0.808 K(o=0.81,f=-2.9!) USER MOD Single : A 154 MET CE :methyl 162:sc=-0.000837 (180deg=-0.172) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 18:sc= 1.26 USER MOD Single : A 159 ASN : amide:sc= -0.533 K(o=-0.53,f=-3.6!) USER MOD Single : A 160 GLN : amide:sc= -1.52 X(o=-1.5,f=-1.3) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.487 X(o=-0.49,f=0) USER MOD Single : A 169 TYR OH : rot -11:sc= 1.52 USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 174 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 HIS : no HD1:sc=-0.000654 X(o=-0.00065,f=-0.14) USER MOD Single : A 181 ASN : amide:sc= 0.0155 X(o=0.016,f=0) USER MOD Single : A 183 THR OG1 : rot 91:sc= 1.73 USER MOD Single : A 187 HIS : no HD1:sc= -0.672 X(o=-0.67,f=-0.31) USER MOD Single : A 188 THR OG1 : rot 68:sc= 0.785 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot -179:sc= 1.5 USER MOD Single : A 192 THR OG1 : rot -35:sc= 0.00269 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -120:sc= 0 (180deg=-0.556) USER MOD Single : A 206 MET CE :methyl 173:sc= -0.007 (180deg=-0.205) USER MOD Single : A 212 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 213 MET CE :methyl -156:sc= -0.0632 (180deg=-0.402) USER MOD Single : A 216 THR OG1 : rot 83:sc= 0.0296 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 222 SER OG : rot 122:sc= 0.298 USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 40 N GLY A 124 1.254 -16.504 -1.732 1.00 0.00 N ATOM 41 CA GLY A 124 1.611 -15.517 -2.739 1.00 0.00 C ATOM 42 C GLY A 124 2.814 -14.664 -2.343 1.00 0.00 C ATOM 43 O GLY A 124 3.597 -14.289 -3.218 1.00 0.00 O ATOM 0 HA2 GLY A 124 1.828 -16.027 -3.678 1.00 0.00 H new ATOM 0 HA3 GLY A 124 0.756 -14.866 -2.920 1.00 0.00 H new ATOM 47 N LEU A 125 2.921 -14.278 -1.066 1.00 0.00 N ATOM 48 CA LEU A 125 4.119 -13.649 -0.508 1.00 0.00 C ATOM 49 C LEU A 125 5.220 -14.667 -0.168 1.00 0.00 C ATOM 50 O LEU A 125 6.312 -14.595 -0.724 1.00 0.00 O ATOM 51 CB LEU A 125 3.796 -12.741 0.694 1.00 0.00 C ATOM 52 CG LEU A 125 3.302 -13.385 2.002 1.00 0.00 C ATOM 53 CD1 LEU A 125 3.089 -12.223 2.959 1.00 0.00 C ATOM 54 CD2 LEU A 125 1.991 -14.170 1.871 1.00 0.00 C ATOM 0 H LEU A 125 2.170 -14.396 -0.386 1.00 0.00 H new ATOM 0 HA LEU A 125 4.516 -13.010 -1.297 1.00 0.00 H new ATOM 0 HB2 LEU A 125 4.695 -12.170 0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 125 3.039 -12.026 0.373 1.00 0.00 H new ATOM 0 HG LEU A 125 4.038 -14.117 2.336 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.735 -12.602 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 125 4.031 -11.693 3.103 1.00 0.00 H new ATOM 0 HD13 LEU A 125 2.348 -11.540 2.543 1.00 0.00 H new ATOM 0 HD21 LEU A 125 1.719 -14.588 2.840 1.00 0.00 H new ATOM 0 HD22 LEU A 125 1.200 -13.503 1.529 1.00 0.00 H new ATOM 0 HD23 LEU A 125 2.121 -14.978 1.151 1.00 0.00 H new ATOM 66 N GLY A 126 4.980 -15.570 0.787 1.00 0.00 N ATOM 67 CA GLY A 126 5.986 -16.490 1.295 1.00 0.00 C ATOM 68 C GLY A 126 7.000 -15.901 2.274 1.00 0.00 C ATOM 69 O GLY A 126 8.039 -16.512 2.521 1.00 0.00 O ATOM 0 H GLY A 126 4.068 -15.679 1.231 1.00 0.00 H new ATOM 0 HA2 GLY A 126 5.476 -17.319 1.786 1.00 0.00 H new ATOM 0 HA3 GLY A 126 6.529 -16.907 0.447 1.00 0.00 H new ATOM 73 N GLY A 127 6.734 -14.712 2.805 1.00 0.00 N ATOM 74 CA GLY A 127 7.599 -14.054 3.778 1.00 0.00 C ATOM 75 C GLY A 127 8.205 -12.760 3.248 1.00 0.00 C ATOM 76 O GLY A 127 9.374 -12.459 3.503 1.00 0.00 O ATOM 0 H GLY A 127 5.902 -14.172 2.569 1.00 0.00 H new ATOM 0 HA2 GLY A 127 7.026 -13.839 4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 127 8.401 -14.735 4.064 1.00 0.00 H new ATOM 80 N TYR A 128 7.413 -11.986 2.503 1.00 0.00 N ATOM 81 CA TYR A 128 7.694 -10.591 2.199 1.00 0.00 C ATOM 82 C TYR A 128 7.886 -9.829 3.513 1.00 0.00 C ATOM 83 O TYR A 128 7.374 -10.233 4.565 1.00 0.00 O ATOM 84 CB TYR A 128 6.554 -10.022 1.335 1.00 0.00 C ATOM 85 CG TYR A 128 6.565 -10.386 -0.149 1.00 0.00 C ATOM 86 CD1 TYR A 128 7.063 -11.615 -0.632 1.00 0.00 C ATOM 87 CD2 TYR A 128 6.037 -9.470 -1.074 1.00 0.00 C ATOM 88 CE1 TYR A 128 6.977 -11.938 -1.997 1.00 0.00 C ATOM 89 CE2 TYR A 128 5.967 -9.784 -2.443 1.00 0.00 C ATOM 90 CZ TYR A 128 6.404 -11.038 -2.914 1.00 0.00 C ATOM 91 OH TYR A 128 6.339 -11.361 -4.235 1.00 0.00 O ATOM 0 H TYR A 128 6.544 -12.322 2.089 1.00 0.00 H new ATOM 0 HA TYR A 128 8.614 -10.487 1.623 1.00 0.00 H new ATOM 0 HB2 TYR A 128 5.607 -10.356 1.759 1.00 0.00 H new ATOM 0 HB3 TYR A 128 6.575 -8.935 1.418 1.00 0.00 H new ATOM 0 HD1 TYR A 128 7.515 -12.315 0.055 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.680 -8.511 -0.729 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.355 -12.888 -2.346 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.575 -9.058 -3.139 1.00 0.00 H new ATOM 0 HH TYR A 128 5.913 -10.630 -4.730 1.00 0.00 H new ATOM 101 N MET A 129 8.604 -8.714 3.423 1.00 0.00 N ATOM 102 CA MET A 129 8.796 -7.784 4.504 1.00 0.00 C ATOM 103 C MET A 129 7.521 -6.953 4.570 1.00 0.00 C ATOM 104 O MET A 129 7.186 -6.199 3.655 1.00 0.00 O ATOM 105 CB MET A 129 10.021 -6.888 4.281 1.00 0.00 C ATOM 106 CG MET A 129 11.329 -7.688 4.308 1.00 0.00 C ATOM 107 SD MET A 129 12.785 -6.815 4.957 1.00 0.00 S ATOM 108 CE MET A 129 12.680 -5.182 4.173 1.00 0.00 C ATOM 0 H MET A 129 9.078 -8.434 2.564 1.00 0.00 H new ATOM 0 HA MET A 129 8.984 -8.313 5.438 1.00 0.00 H new ATOM 0 HB2 MET A 129 9.928 -6.378 3.322 1.00 0.00 H new ATOM 0 HB3 MET A 129 10.051 -6.117 5.051 1.00 0.00 H new ATOM 0 HG2 MET A 129 11.171 -8.585 4.907 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.551 -8.018 3.293 1.00 0.00 H new ATOM 0 HE1 MET A 129 13.677 -4.747 4.103 1.00 0.00 H new ATOM 0 HE2 MET A 129 12.258 -5.285 3.173 1.00 0.00 H new ATOM 0 HE3 MET A 129 12.042 -4.532 4.771 1.00 0.00 H new ATOM 118 N LEU A 130 6.761 -7.138 5.637 1.00 0.00 N ATOM 119 CA LEU A 130 5.641 -6.277 5.955 1.00 0.00 C ATOM 120 C LEU A 130 6.254 -5.028 6.604 1.00 0.00 C ATOM 121 O LEU A 130 6.969 -5.155 7.597 1.00 0.00 O ATOM 122 CB LEU A 130 4.685 -7.080 6.855 1.00 0.00 C ATOM 123 CG LEU A 130 3.320 -6.438 7.135 1.00 0.00 C ATOM 124 CD1 LEU A 130 3.473 -5.197 7.967 1.00 0.00 C ATOM 125 CD2 LEU A 130 2.503 -6.078 5.900 1.00 0.00 C ATOM 0 H LEU A 130 6.907 -7.893 6.307 1.00 0.00 H new ATOM 0 HA LEU A 130 5.045 -5.950 5.103 1.00 0.00 H new ATOM 0 HB2 LEU A 130 4.518 -8.054 6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.182 -7.259 7.809 1.00 0.00 H new ATOM 0 HG LEU A 130 2.770 -7.216 7.665 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.492 -4.760 8.152 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.942 -5.452 8.917 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.096 -4.478 7.436 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.557 -5.631 6.207 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.060 -5.366 5.290 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.307 -6.979 5.318 1.00 0.00 H new ATOM 137 N GLY A 131 6.042 -3.855 6.005 1.00 0.00 N ATOM 138 CA GLY A 131 6.546 -2.549 6.439 1.00 0.00 C ATOM 139 C GLY A 131 5.993 -2.137 7.803 1.00 0.00 C ATOM 140 O GLY A 131 5.164 -2.835 8.383 1.00 0.00 O ATOM 0 H GLY A 131 5.482 -3.786 5.155 1.00 0.00 H new ATOM 0 HA2 GLY A 131 7.635 -2.579 6.485 1.00 0.00 H new ATOM 0 HA3 GLY A 131 6.279 -1.795 5.699 1.00 0.00 H new ATOM 144 N SER A 132 6.397 -0.980 8.319 1.00 0.00 N ATOM 145 CA SER A 132 5.799 -0.489 9.545 1.00 0.00 C ATOM 146 C SER A 132 4.437 0.134 9.306 1.00 0.00 C ATOM 147 O SER A 132 4.129 0.625 8.217 1.00 0.00 O ATOM 148 CB SER A 132 6.772 0.432 10.276 1.00 0.00 C ATOM 149 OG SER A 132 7.527 1.244 9.398 1.00 0.00 O ATOM 0 H SER A 132 7.118 -0.381 7.916 1.00 0.00 H new ATOM 0 HA SER A 132 5.608 -1.337 10.203 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.215 1.069 10.963 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.451 -0.171 10.880 1.00 0.00 H new ATOM 0 HG SER A 132 8.131 1.814 9.918 1.00 0.00 H new ATOM 155 N ALA A 133 3.611 0.082 10.353 1.00 0.00 N ATOM 156 CA ALA A 133 2.327 0.738 10.356 1.00 0.00 C ATOM 157 C ALA A 133 2.530 2.246 10.451 1.00 0.00 C ATOM 158 O ALA A 133 3.361 2.707 11.240 1.00 0.00 O ATOM 159 CB ALA A 133 1.477 0.243 11.520 1.00 0.00 C ATOM 0 H ALA A 133 3.824 -0.419 11.216 1.00 0.00 H new ATOM 0 HA ALA A 133 1.803 0.503 9.430 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.512 0.749 11.506 1.00 0.00 H new ATOM 0 HB2 ALA A 133 1.325 -0.832 11.428 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.986 0.458 12.460 1.00 0.00 H new ATOM 165 N MET A 134 1.729 2.987 9.691 1.00 0.00 N ATOM 166 CA MET A 134 1.759 4.435 9.564 1.00 0.00 C ATOM 167 C MET A 134 0.350 5.020 9.747 1.00 0.00 C ATOM 168 O MET A 134 -0.629 4.287 9.930 1.00 0.00 O ATOM 169 CB MET A 134 2.359 4.766 8.187 1.00 0.00 C ATOM 170 CG MET A 134 1.534 4.174 7.026 1.00 0.00 C ATOM 171 SD MET A 134 2.421 3.006 5.959 1.00 0.00 S ATOM 172 CE MET A 134 3.460 4.175 5.054 1.00 0.00 C ATOM 0 H MET A 134 1.000 2.565 9.115 1.00 0.00 H new ATOM 0 HA MET A 134 2.376 4.886 10.341 1.00 0.00 H new ATOM 0 HB2 MET A 134 2.419 5.848 8.071 1.00 0.00 H new ATOM 0 HB3 MET A 134 3.378 4.383 8.137 1.00 0.00 H new ATOM 0 HG2 MET A 134 0.662 3.670 7.442 1.00 0.00 H new ATOM 0 HG3 MET A 134 1.164 4.994 6.410 1.00 0.00 H new ATOM 0 HE1 MET A 134 3.894 3.680 4.185 1.00 0.00 H new ATOM 0 HE2 MET A 134 2.855 5.020 4.725 1.00 0.00 H new ATOM 0 HE3 MET A 134 4.259 4.531 5.705 1.00 0.00 H new ATOM 182 N SER A 135 0.233 6.349 9.653 1.00 0.00 N ATOM 183 CA SER A 135 -1.039 7.077 9.796 1.00 0.00 C ATOM 184 C SER A 135 -1.800 7.224 8.482 1.00 0.00 C ATOM 185 O SER A 135 -2.905 7.758 8.479 1.00 0.00 O ATOM 186 CB SER A 135 -0.777 8.455 10.420 1.00 0.00 C ATOM 187 OG SER A 135 -1.791 8.830 11.344 1.00 0.00 O ATOM 0 H SER A 135 1.029 6.961 9.473 1.00 0.00 H new ATOM 0 HA SER A 135 -1.676 6.483 10.452 1.00 0.00 H new ATOM 0 HB2 SER A 135 0.188 8.444 10.927 1.00 0.00 H new ATOM 0 HB3 SER A 135 -0.714 9.203 9.630 1.00 0.00 H new ATOM 0 HG SER A 135 -1.583 9.712 11.718 1.00 0.00 H new ATOM 193 N ARG A 136 -1.212 6.740 7.385 1.00 0.00 N ATOM 194 CA ARG A 136 -1.653 6.892 6.001 1.00 0.00 C ATOM 195 C ARG A 136 -1.629 8.364 5.537 1.00 0.00 C ATOM 196 O ARG A 136 -1.846 9.291 6.325 1.00 0.00 O ATOM 197 CB ARG A 136 -3.058 6.292 5.784 1.00 0.00 C ATOM 198 CG ARG A 136 -3.215 4.780 6.020 1.00 0.00 C ATOM 199 CD ARG A 136 -3.745 4.414 7.411 1.00 0.00 C ATOM 200 NE ARG A 136 -4.378 3.083 7.396 1.00 0.00 N ATOM 201 CZ ARG A 136 -5.072 2.545 8.404 1.00 0.00 C ATOM 202 NH1 ARG A 136 -5.079 3.124 9.602 1.00 0.00 N ATOM 203 NH2 ARG A 136 -5.726 1.405 8.218 1.00 0.00 N ATOM 0 H ARG A 136 -0.354 6.193 7.448 1.00 0.00 H new ATOM 0 HA ARG A 136 -0.939 6.338 5.392 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.754 6.812 6.443 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -3.365 6.509 4.761 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -3.891 4.374 5.267 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -2.248 4.298 5.873 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -2.927 4.425 8.131 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.467 5.162 7.738 1.00 0.00 H new ATOM 0 HE ARG A 136 -4.278 2.527 6.547 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -4.553 3.984 9.756 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -5.611 2.708 10.366 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.698 0.943 7.309 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.257 0.991 8.984 1.00 0.00 H new ATOM 217 N PRO A 137 -1.391 8.629 4.244 1.00 0.00 N ATOM 218 CA PRO A 137 -1.829 9.858 3.591 1.00 0.00 C ATOM 219 C PRO A 137 -3.348 9.967 3.564 1.00 0.00 C ATOM 220 O PRO A 137 -4.055 8.976 3.759 1.00 0.00 O ATOM 221 CB PRO A 137 -1.244 9.820 2.175 1.00 0.00 C ATOM 222 CG PRO A 137 -0.640 8.427 1.976 1.00 0.00 C ATOM 223 CD PRO A 137 -0.860 7.682 3.288 1.00 0.00 C ATOM 0 HA PRO A 137 -1.481 10.736 4.136 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -2.018 10.014 1.433 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -0.484 10.591 2.051 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -1.121 7.908 1.147 1.00 0.00 H new ATOM 0 HG3 PRO A 137 0.422 8.492 1.738 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -1.552 6.852 3.146 1.00 0.00 H new ATOM 0 HD3 PRO A 137 0.077 7.257 3.649 1.00 0.00 H new ATOM 231 N LEU A 138 -3.850 11.153 3.227 1.00 0.00 N ATOM 232 CA LEU A 138 -5.166 11.361 2.667 1.00 0.00 C ATOM 233 C LEU A 138 -4.937 12.023 1.304 1.00 0.00 C ATOM 234 O LEU A 138 -4.017 12.836 1.157 1.00 0.00 O ATOM 235 CB LEU A 138 -6.072 12.156 3.637 1.00 0.00 C ATOM 236 CG LEU A 138 -7.271 11.292 4.041 1.00 0.00 C ATOM 237 CD1 LEU A 138 -8.032 11.804 5.265 1.00 0.00 C ATOM 238 CD2 LEU A 138 -8.276 11.147 2.899 1.00 0.00 C ATOM 0 H LEU A 138 -3.326 12.020 3.344 1.00 0.00 H new ATOM 0 HA LEU A 138 -5.716 10.431 2.522 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.507 12.449 4.522 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.416 13.074 3.160 1.00 0.00 H new ATOM 0 HG LEU A 138 -6.825 10.330 4.293 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.864 11.135 5.482 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.360 11.838 6.123 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -8.414 12.805 5.063 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -9.111 10.527 3.226 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.645 12.132 2.612 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.790 10.678 2.044 1.00 0.00 H new ATOM 250 N ILE A 139 -5.700 11.618 0.293 1.00 0.00 N ATOM 251 CA ILE A 139 -5.564 11.986 -1.115 1.00 0.00 C ATOM 252 C ILE A 139 -6.997 12.264 -1.583 1.00 0.00 C ATOM 253 O ILE A 139 -7.943 11.718 -1.011 1.00 0.00 O ATOM 254 CB ILE A 139 -4.893 10.828 -1.913 1.00 0.00 C ATOM 255 CG1 ILE A 139 -3.521 10.428 -1.333 1.00 0.00 C ATOM 256 CG2 ILE A 139 -4.660 11.159 -3.401 1.00 0.00 C ATOM 257 CD1 ILE A 139 -3.098 9.005 -1.729 1.00 0.00 C ATOM 0 H ILE A 139 -6.482 10.981 0.445 1.00 0.00 H new ATOM 0 HA ILE A 139 -4.926 12.856 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 139 -5.608 10.010 -1.823 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -2.766 11.135 -1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -3.556 10.502 -0.246 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -4.190 10.308 -3.894 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -5.615 11.373 -3.880 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -4.010 12.030 -3.482 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -2.125 8.780 -1.292 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -3.835 8.291 -1.362 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -3.033 8.934 -2.815 1.00 0.00 H new ATOM 269 N HIS A 140 -7.153 13.095 -2.612 1.00 0.00 N ATOM 270 CA HIS A 140 -8.447 13.349 -3.247 1.00 0.00 C ATOM 271 C HIS A 140 -8.554 12.546 -4.542 1.00 0.00 C ATOM 272 O HIS A 140 -7.542 12.166 -5.137 1.00 0.00 O ATOM 273 CB HIS A 140 -8.623 14.844 -3.550 1.00 0.00 C ATOM 274 CG HIS A 140 -7.595 15.392 -4.509 1.00 0.00 C ATOM 275 ND1 HIS A 140 -7.548 15.168 -5.860 1.00 0.00 N flip ATOM 276 CD2 HIS A 140 -6.484 16.124 -4.165 1.00 0.00 C flip ATOM 277 CE1 HIS A 140 -6.383 15.764 -6.351 1.00 0.00 C flip ATOM 278 NE2 HIS A 140 -5.765 16.309 -5.282 1.00 0.00 N flip ATOM 0 H HIS A 140 -6.382 13.614 -3.032 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.234 13.040 -2.559 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -9.618 15.007 -3.965 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.571 15.404 -2.616 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -6.236 16.484 -3.177 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.046 15.784 -7.377 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -4.870 16.797 -5.319 1.00 0.00 H new ATOM 286 N PHE A 141 -9.774 12.397 -5.058 1.00 0.00 N ATOM 287 CA PHE A 141 -10.037 11.648 -6.291 1.00 0.00 C ATOM 288 C PHE A 141 -11.100 12.360 -7.120 1.00 0.00 C ATOM 289 O PHE A 141 -10.971 12.491 -8.336 1.00 0.00 O ATOM 290 CB PHE A 141 -10.493 10.219 -5.952 1.00 0.00 C ATOM 291 CG PHE A 141 -9.730 9.591 -4.803 1.00 0.00 C ATOM 292 CD1 PHE A 141 -8.530 8.892 -5.032 1.00 0.00 C ATOM 293 CD2 PHE A 141 -10.165 9.819 -3.484 1.00 0.00 C ATOM 294 CE1 PHE A 141 -7.784 8.407 -3.942 1.00 0.00 C ATOM 295 CE2 PHE A 141 -9.386 9.382 -2.407 1.00 0.00 C ATOM 296 CZ PHE A 141 -8.204 8.659 -2.628 1.00 0.00 C ATOM 0 H PHE A 141 -10.612 12.793 -4.632 1.00 0.00 H new ATOM 0 HA PHE A 141 -9.118 11.593 -6.875 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -11.555 10.235 -5.705 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -10.381 9.592 -6.837 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -8.183 8.728 -6.041 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.099 10.331 -3.303 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -6.883 7.838 -4.118 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.697 9.603 -1.397 1.00 0.00 H new ATOM 0 HZ PHE A 141 -7.622 8.299 -1.792 1.00 0.00 H new ATOM 306 N GLY A 142 -12.131 12.886 -6.466 1.00 0.00 N ATOM 307 CA GLY A 142 -13.289 13.505 -7.088 1.00 0.00 C ATOM 308 C GLY A 142 -13.898 14.471 -6.093 1.00 0.00 C ATOM 309 O GLY A 142 -15.097 14.457 -5.861 1.00 0.00 O ATOM 0 H GLY A 142 -12.181 12.891 -5.447 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -12.997 14.029 -7.998 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.017 12.747 -7.377 1.00 0.00 H new ATOM 313 N ASN A 143 -13.044 15.282 -5.475 1.00 0.00 N ATOM 314 CA ASN A 143 -13.378 16.309 -4.505 1.00 0.00 C ATOM 315 C ASN A 143 -13.908 15.614 -3.265 1.00 0.00 C ATOM 316 O ASN A 143 -13.812 14.391 -3.151 1.00 0.00 O ATOM 317 CB ASN A 143 -14.368 17.368 -5.054 1.00 0.00 C ATOM 318 CG ASN A 143 -14.102 17.852 -6.470 1.00 0.00 C ATOM 319 OD1 ASN A 143 -12.877 17.749 -6.956 1.00 0.00 O flip ATOM 320 ND2 ASN A 143 -14.994 18.376 -7.129 1.00 0.00 N flip ATOM 0 H ASN A 143 -12.041 15.233 -5.652 1.00 0.00 H new ATOM 0 HA ASN A 143 -12.482 16.880 -4.263 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.374 16.951 -5.016 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -14.355 18.230 -4.387 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.936 18.450 -6.744 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -14.794 18.737 -8.062 1.00 0.00 H new ATOM 327 N ASP A 144 -14.486 16.402 -2.362 1.00 0.00 N ATOM 328 CA ASP A 144 -15.074 15.960 -1.104 1.00 0.00 C ATOM 329 C ASP A 144 -15.927 14.706 -1.270 1.00 0.00 C ATOM 330 O ASP A 144 -15.968 13.845 -0.404 1.00 0.00 O ATOM 331 CB ASP A 144 -16.019 17.030 -0.595 1.00 0.00 C ATOM 332 CG ASP A 144 -16.513 16.731 0.817 1.00 0.00 C ATOM 333 OD1 ASP A 144 -15.718 16.359 1.709 1.00 0.00 O ATOM 334 OD2 ASP A 144 -17.724 16.942 1.030 1.00 0.00 O ATOM 0 H ASP A 144 -14.560 17.411 -2.495 1.00 0.00 H new ATOM 0 HA ASP A 144 -14.244 15.760 -0.426 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -15.513 17.995 -0.605 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -16.872 17.110 -1.268 1.00 0.00 H new ATOM 339 N TYR A 145 -16.627 14.604 -2.397 1.00 0.00 N ATOM 340 CA TYR A 145 -17.585 13.580 -2.680 1.00 0.00 C ATOM 341 C TYR A 145 -16.939 12.213 -2.524 1.00 0.00 C ATOM 342 O TYR A 145 -17.383 11.397 -1.714 1.00 0.00 O ATOM 343 CB TYR A 145 -18.066 13.818 -4.106 1.00 0.00 C ATOM 344 CG TYR A 145 -18.462 15.234 -4.465 1.00 0.00 C ATOM 345 CD1 TYR A 145 -19.273 16.006 -3.617 1.00 0.00 C ATOM 346 CD2 TYR A 145 -17.923 15.801 -5.631 1.00 0.00 C ATOM 347 CE1 TYR A 145 -19.524 17.353 -3.922 1.00 0.00 C ATOM 348 CE2 TYR A 145 -18.149 17.155 -5.932 1.00 0.00 C ATOM 349 CZ TYR A 145 -18.964 17.935 -5.082 1.00 0.00 C ATOM 350 OH TYR A 145 -19.163 19.259 -5.326 1.00 0.00 O ATOM 0 H TYR A 145 -16.525 15.271 -3.162 1.00 0.00 H new ATOM 0 HA TYR A 145 -18.429 13.610 -1.991 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -17.276 13.503 -4.788 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -18.923 13.169 -4.288 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -19.703 15.563 -2.731 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -17.332 15.193 -6.300 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -20.147 17.946 -3.269 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -17.701 17.597 -6.810 1.00 0.00 H new ATOM 0 HH TYR A 145 -18.714 19.509 -6.161 1.00 0.00 H new ATOM 360 N GLU A 146 -15.862 12.021 -3.280 1.00 0.00 N ATOM 361 CA GLU A 146 -15.066 10.813 -3.308 1.00 0.00 C ATOM 362 C GLU A 146 -14.054 10.806 -2.157 1.00 0.00 C ATOM 363 O GLU A 146 -13.527 9.756 -1.801 1.00 0.00 O ATOM 364 CB GLU A 146 -14.372 10.674 -4.650 1.00 0.00 C ATOM 365 CG GLU A 146 -15.328 10.929 -5.819 1.00 0.00 C ATOM 366 CD GLU A 146 -16.630 10.137 -5.753 1.00 0.00 C ATOM 367 OE1 GLU A 146 -16.583 8.887 -5.836 1.00 0.00 O ATOM 368 OE2 GLU A 146 -17.696 10.786 -5.732 1.00 0.00 O ATOM 0 H GLU A 146 -15.511 12.738 -3.915 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.725 9.955 -3.175 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -13.540 11.376 -4.702 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.950 9.673 -4.738 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.565 11.992 -5.853 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -14.816 10.687 -6.750 1.00 0.00 H new ATOM 375 N ASP A 147 -13.775 11.977 -1.576 1.00 0.00 N ATOM 376 CA ASP A 147 -12.872 12.141 -0.441 1.00 0.00 C ATOM 377 C ASP A 147 -13.478 11.504 0.797 1.00 0.00 C ATOM 378 O ASP A 147 -12.789 10.807 1.541 1.00 0.00 O ATOM 379 CB ASP A 147 -12.668 13.625 -0.180 1.00 0.00 C ATOM 380 CG ASP A 147 -11.507 13.951 0.735 1.00 0.00 C ATOM 381 OD1 ASP A 147 -10.400 14.163 0.196 1.00 0.00 O ATOM 382 OD2 ASP A 147 -11.740 14.183 1.944 1.00 0.00 O ATOM 0 H ASP A 147 -14.183 12.857 -1.893 1.00 0.00 H new ATOM 0 HA ASP A 147 -11.919 11.662 -0.667 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -12.515 14.130 -1.134 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -13.581 14.033 0.254 1.00 0.00 H new ATOM 387 N ARG A 148 -14.786 11.703 0.992 1.00 0.00 N ATOM 388 CA ARG A 148 -15.512 11.027 2.065 1.00 0.00 C ATOM 389 C ARG A 148 -15.605 9.553 1.739 1.00 0.00 C ATOM 390 O ARG A 148 -15.296 8.739 2.599 1.00 0.00 O ATOM 391 CB ARG A 148 -16.926 11.542 2.294 1.00 0.00 C ATOM 392 CG ARG A 148 -17.028 13.063 2.465 1.00 0.00 C ATOM 393 CD ARG A 148 -18.356 13.596 1.932 1.00 0.00 C ATOM 394 NE ARG A 148 -18.721 13.036 0.614 1.00 0.00 N ATOM 395 CZ ARG A 148 -19.956 12.964 0.127 1.00 0.00 C ATOM 396 NH1 ARG A 148 -20.960 13.603 0.719 1.00 0.00 N ATOM 397 NH2 ARG A 148 -20.157 12.232 -0.961 1.00 0.00 N ATOM 0 H ARG A 148 -15.359 12.325 0.422 1.00 0.00 H new ATOM 0 HA ARG A 148 -14.949 11.225 2.977 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -17.550 11.241 1.452 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -17.335 11.061 3.182 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -16.928 13.320 3.520 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -16.204 13.546 1.940 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -19.145 13.367 2.648 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -18.300 14.682 1.855 1.00 0.00 H new ATOM 0 HE ARG A 148 -17.965 12.676 0.031 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -20.788 14.157 1.558 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -21.903 13.539 0.335 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -19.376 11.745 -1.399 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -21.093 12.157 -1.359 1.00 0.00 H new ATOM 411 N TYR A 149 -15.981 9.217 0.500 1.00 0.00 N ATOM 412 CA TYR A 149 -16.102 7.842 0.036 1.00 0.00 C ATOM 413 C TYR A 149 -14.852 7.058 0.432 1.00 0.00 C ATOM 414 O TYR A 149 -14.926 5.946 0.946 1.00 0.00 O ATOM 415 CB TYR A 149 -16.320 7.837 -1.484 1.00 0.00 C ATOM 416 CG TYR A 149 -16.888 6.538 -2.005 1.00 0.00 C ATOM 417 CD1 TYR A 149 -16.059 5.412 -2.150 1.00 0.00 C ATOM 418 CD2 TYR A 149 -18.254 6.457 -2.318 1.00 0.00 C ATOM 419 CE1 TYR A 149 -16.603 4.185 -2.577 1.00 0.00 C ATOM 420 CE2 TYR A 149 -18.806 5.232 -2.745 1.00 0.00 C ATOM 421 CZ TYR A 149 -17.986 4.084 -2.861 1.00 0.00 C ATOM 422 OH TYR A 149 -18.535 2.897 -3.252 1.00 0.00 O ATOM 0 H TYR A 149 -16.212 9.907 -0.214 1.00 0.00 H new ATOM 0 HA TYR A 149 -16.961 7.358 0.502 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -16.994 8.652 -1.750 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -15.370 8.034 -1.980 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -15.004 5.488 -1.934 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -18.881 7.332 -2.232 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -15.965 3.321 -2.688 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -19.857 5.169 -2.984 1.00 0.00 H new ATOM 0 HH TYR A 149 -19.496 3.015 -3.403 1.00 0.00 H new ATOM 432 N TYR A 150 -13.692 7.675 0.266 1.00 0.00 N ATOM 433 CA TYR A 150 -12.430 7.170 0.734 1.00 0.00 C ATOM 434 C TYR A 150 -12.320 7.183 2.262 1.00 0.00 C ATOM 435 O TYR A 150 -12.188 6.123 2.875 1.00 0.00 O ATOM 436 CB TYR A 150 -11.360 8.006 0.032 1.00 0.00 C ATOM 437 CG TYR A 150 -9.957 7.562 0.323 1.00 0.00 C ATOM 438 CD1 TYR A 150 -9.562 6.267 -0.029 1.00 0.00 C ATOM 439 CD2 TYR A 150 -9.052 8.448 0.924 1.00 0.00 C ATOM 440 CE1 TYR A 150 -8.285 5.807 0.309 1.00 0.00 C ATOM 441 CE2 TYR A 150 -7.771 7.998 1.278 1.00 0.00 C ATOM 442 CZ TYR A 150 -7.419 6.651 1.029 1.00 0.00 C ATOM 443 OH TYR A 150 -6.285 6.136 1.555 1.00 0.00 O ATOM 0 H TYR A 150 -13.611 8.570 -0.216 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.307 6.116 0.487 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -11.528 7.965 -1.044 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.471 9.048 0.332 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.244 5.621 -0.562 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.339 9.472 1.114 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -7.967 4.816 0.021 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.062 8.672 1.735 1.00 0.00 H new ATOM 0 HH TYR A 150 -5.791 6.842 2.022 1.00 0.00 H new ATOM 453 N ARG A 151 -12.327 8.345 2.919 1.00 0.00 N ATOM 454 CA ARG A 151 -11.980 8.460 4.334 1.00 0.00 C ATOM 455 C ARG A 151 -12.987 7.786 5.261 1.00 0.00 C ATOM 456 O ARG A 151 -12.635 7.480 6.397 1.00 0.00 O ATOM 457 CB ARG A 151 -11.743 9.939 4.671 1.00 0.00 C ATOM 458 CG ARG A 151 -13.010 10.701 5.065 1.00 0.00 C ATOM 459 CD ARG A 151 -12.791 12.212 4.918 1.00 0.00 C ATOM 460 NE ARG A 151 -11.795 12.722 5.879 1.00 0.00 N ATOM 461 CZ ARG A 151 -11.989 12.898 7.194 1.00 0.00 C ATOM 462 NH1 ARG A 151 -13.176 12.674 7.751 1.00 0.00 N ATOM 463 NH2 ARG A 151 -10.992 13.286 7.979 1.00 0.00 N ATOM 0 H ARG A 151 -12.574 9.233 2.483 1.00 0.00 H new ATOM 0 HA ARG A 151 -11.056 7.909 4.509 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -11.024 10.004 5.488 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.291 10.429 3.809 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.843 10.385 4.437 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.279 10.464 6.094 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -12.462 12.434 3.903 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.738 12.732 5.067 1.00 0.00 H new ATOM 0 HE ARG A 151 -10.875 12.963 5.510 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -13.959 12.363 7.176 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -13.304 12.814 8.753 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -10.067 13.453 7.583 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -11.151 13.417 8.978 1.00 0.00 H new ATOM 477 N GLU A 152 -14.208 7.529 4.810 1.00 0.00 N ATOM 478 CA GLU A 152 -15.239 6.859 5.588 1.00 0.00 C ATOM 479 C GLU A 152 -15.158 5.350 5.388 1.00 0.00 C ATOM 480 O GLU A 152 -15.811 4.612 6.124 1.00 0.00 O ATOM 481 CB GLU A 152 -16.631 7.322 5.149 1.00 0.00 C ATOM 482 CG GLU A 152 -16.956 8.780 5.494 1.00 0.00 C ATOM 483 CD GLU A 152 -18.391 9.109 5.073 1.00 0.00 C ATOM 484 OE1 GLU A 152 -18.694 9.023 3.859 1.00 0.00 O ATOM 485 OE2 GLU A 152 -19.208 9.455 5.957 1.00 0.00 O ATOM 0 H GLU A 152 -14.515 7.787 3.872 1.00 0.00 H new ATOM 0 HA GLU A 152 -15.077 7.109 6.636 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -16.721 7.189 4.071 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.377 6.677 5.613 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -16.835 8.945 6.565 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -16.258 9.447 4.988 1.00 0.00 H new ATOM 492 N ASN A 153 -14.399 4.864 4.399 1.00 0.00 N ATOM 493 CA ASN A 153 -14.343 3.436 4.112 1.00 0.00 C ATOM 494 C ASN A 153 -12.918 2.924 4.251 1.00 0.00 C ATOM 495 O ASN A 153 -12.711 1.714 4.262 1.00 0.00 O ATOM 496 CB ASN A 153 -14.981 3.127 2.752 1.00 0.00 C ATOM 497 CG ASN A 153 -16.474 3.476 2.761 1.00 0.00 C ATOM 498 OD1 ASN A 153 -17.331 2.632 3.014 1.00 0.00 O ATOM 499 ND2 ASN A 153 -16.799 4.740 2.548 1.00 0.00 N ATOM 0 H ASN A 153 -13.819 5.440 3.789 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.936 2.893 4.848 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -14.475 3.694 1.970 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -14.851 2.071 2.515 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -17.776 5.030 2.592 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -16.073 5.425 2.339 1.00 0.00 H new ATOM 506 N MET A 154 -11.941 3.813 4.473 1.00 0.00 N ATOM 507 CA MET A 154 -10.527 3.496 4.617 1.00 0.00 C ATOM 508 C MET A 154 -10.202 2.483 5.712 1.00 0.00 C ATOM 509 O MET A 154 -9.101 1.943 5.741 1.00 0.00 O ATOM 510 CB MET A 154 -9.760 4.797 4.856 1.00 0.00 C ATOM 511 CG MET A 154 -10.109 5.468 6.200 1.00 0.00 C ATOM 512 SD MET A 154 -8.791 5.467 7.438 1.00 0.00 S ATOM 513 CE MET A 154 -7.649 6.580 6.592 1.00 0.00 C ATOM 0 H MET A 154 -12.129 4.812 4.560 1.00 0.00 H new ATOM 0 HA MET A 154 -10.220 3.011 3.690 1.00 0.00 H new ATOM 0 HB2 MET A 154 -8.690 4.591 4.827 1.00 0.00 H new ATOM 0 HB3 MET A 154 -9.973 5.492 4.044 1.00 0.00 H new ATOM 0 HG2 MET A 154 -10.400 6.500 6.006 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.980 4.965 6.622 1.00 0.00 H new ATOM 0 HE1 MET A 154 -6.922 6.967 7.306 1.00 0.00 H new ATOM 0 HE2 MET A 154 -7.129 6.037 5.803 1.00 0.00 H new ATOM 0 HE3 MET A 154 -8.206 7.409 6.155 1.00 0.00 H new ATOM 523 N TYR A 155 -11.160 2.200 6.586 1.00 0.00 N ATOM 524 CA TYR A 155 -11.012 1.309 7.713 1.00 0.00 C ATOM 525 C TYR A 155 -10.706 -0.121 7.252 1.00 0.00 C ATOM 526 O TYR A 155 -9.927 -0.819 7.900 1.00 0.00 O ATOM 527 CB TYR A 155 -12.284 1.452 8.554 1.00 0.00 C ATOM 528 CG TYR A 155 -12.634 2.899 8.869 1.00 0.00 C ATOM 529 CD1 TYR A 155 -11.690 3.732 9.500 1.00 0.00 C ATOM 530 CD2 TYR A 155 -13.864 3.438 8.450 1.00 0.00 C ATOM 531 CE1 TYR A 155 -11.958 5.098 9.697 1.00 0.00 C ATOM 532 CE2 TYR A 155 -14.150 4.795 8.677 1.00 0.00 C ATOM 533 CZ TYR A 155 -13.202 5.632 9.298 1.00 0.00 C ATOM 534 OH TYR A 155 -13.497 6.935 9.559 1.00 0.00 O ATOM 0 H TYR A 155 -12.094 2.604 6.520 1.00 0.00 H new ATOM 0 HA TYR A 155 -10.155 1.569 8.334 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -13.117 0.991 8.023 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -12.158 0.904 9.488 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -10.751 3.317 9.836 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -14.588 2.809 7.954 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -11.215 5.736 10.152 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -15.104 5.200 8.373 1.00 0.00 H new ATOM 0 HH TYR A 155 -14.392 7.143 9.217 1.00 0.00 H new ATOM 544 N ARG A 156 -11.209 -0.543 6.083 1.00 0.00 N ATOM 545 CA ARG A 156 -10.834 -1.838 5.500 1.00 0.00 C ATOM 546 C ARG A 156 -9.420 -1.853 4.896 1.00 0.00 C ATOM 547 O ARG A 156 -8.962 -2.940 4.549 1.00 0.00 O ATOM 548 CB ARG A 156 -11.860 -2.312 4.447 1.00 0.00 C ATOM 549 CG ARG A 156 -12.092 -1.326 3.291 1.00 0.00 C ATOM 550 CD ARG A 156 -13.570 -1.103 2.931 1.00 0.00 C ATOM 551 NE ARG A 156 -14.411 -0.755 4.089 1.00 0.00 N ATOM 552 CZ ARG A 156 -15.679 -0.333 4.031 1.00 0.00 C ATOM 553 NH1 ARG A 156 -16.311 -0.200 2.871 1.00 0.00 N ATOM 554 NH2 ARG A 156 -16.321 -0.017 5.147 1.00 0.00 N ATOM 0 H ARG A 156 -11.874 -0.008 5.525 1.00 0.00 H new ATOM 0 HA ARG A 156 -10.834 -2.536 6.337 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.524 -3.263 4.034 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.812 -2.499 4.944 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -11.646 -0.367 3.553 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -11.567 -1.691 2.408 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.639 -0.307 2.190 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.963 -2.007 2.465 1.00 0.00 H new ATOM 0 HE ARG A 156 -13.991 -0.843 5.014 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.829 -0.421 2.000 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.278 0.124 2.851 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.848 -0.096 6.047 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -17.288 0.305 5.105 1.00 0.00 H new ATOM 568 N TYR A 157 -8.746 -0.715 4.700 1.00 0.00 N ATOM 569 CA TYR A 157 -7.464 -0.652 3.986 1.00 0.00 C ATOM 570 C TYR A 157 -6.317 -0.919 4.960 1.00 0.00 C ATOM 571 O TYR A 157 -6.476 -0.712 6.172 1.00 0.00 O ATOM 572 CB TYR A 157 -7.300 0.720 3.290 1.00 0.00 C ATOM 573 CG TYR A 157 -8.387 1.099 2.299 1.00 0.00 C ATOM 574 CD1 TYR A 157 -9.273 0.132 1.787 1.00 0.00 C ATOM 575 CD2 TYR A 157 -8.557 2.448 1.939 1.00 0.00 C ATOM 576 CE1 TYR A 157 -10.397 0.508 1.040 1.00 0.00 C ATOM 577 CE2 TYR A 157 -9.674 2.830 1.176 1.00 0.00 C ATOM 578 CZ TYR A 157 -10.598 1.868 0.724 1.00 0.00 C ATOM 579 OH TYR A 157 -11.676 2.274 0.006 1.00 0.00 O ATOM 0 H TYR A 157 -9.074 0.192 5.033 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.445 -1.420 3.213 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.252 1.491 4.059 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -6.342 0.729 2.769 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -9.083 -0.915 1.973 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.832 3.187 2.247 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -11.104 -0.238 0.709 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -9.825 3.872 0.934 1.00 0.00 H new ATOM 0 HH TYR A 157 -12.362 1.574 0.021 1.00 0.00 H new ATOM 589 N PRO A 158 -5.137 -1.336 4.466 1.00 0.00 N ATOM 590 CA PRO A 158 -4.002 -1.623 5.327 1.00 0.00 C ATOM 591 C PRO A 158 -3.499 -0.345 6.000 1.00 0.00 C ATOM 592 O PRO A 158 -3.866 0.780 5.642 1.00 0.00 O ATOM 593 CB PRO A 158 -2.942 -2.256 4.415 1.00 0.00 C ATOM 594 CG PRO A 158 -3.256 -1.662 3.049 1.00 0.00 C ATOM 595 CD PRO A 158 -4.774 -1.563 3.071 1.00 0.00 C ATOM 0 HA PRO A 158 -4.262 -2.300 6.141 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.932 -2.007 4.739 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.015 -3.343 4.407 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.788 -0.687 2.914 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.903 -2.300 2.239 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.122 -0.746 2.438 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -5.231 -2.477 2.692 1.00 0.00 H new ATOM 603 N ASN A 159 -2.630 -0.531 6.988 1.00 0.00 N ATOM 604 CA ASN A 159 -1.891 0.540 7.640 1.00 0.00 C ATOM 605 C ASN A 159 -0.386 0.378 7.482 1.00 0.00 C ATOM 606 O ASN A 159 0.332 1.270 7.901 1.00 0.00 O ATOM 607 CB ASN A 159 -2.287 0.662 9.115 1.00 0.00 C ATOM 608 CG ASN A 159 -1.872 -0.500 10.003 1.00 0.00 C ATOM 609 OD1 ASN A 159 -1.717 -1.630 9.551 1.00 0.00 O ATOM 610 ND2 ASN A 159 -1.759 -0.263 11.297 1.00 0.00 N ATOM 0 H ASN A 159 -2.416 -1.454 7.366 1.00 0.00 H new ATOM 0 HA ASN A 159 -2.162 1.469 7.139 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -1.850 1.577 9.516 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -3.370 0.773 9.174 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.540 -1.026 11.938 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -1.891 0.683 11.656 1.00 0.00 H new ATOM 617 N GLN A 160 0.079 -0.710 6.868 1.00 0.00 N ATOM 618 CA GLN A 160 1.461 -0.990 6.485 1.00 0.00 C ATOM 619 C GLN A 160 1.444 -1.348 4.982 1.00 0.00 C ATOM 620 O GLN A 160 0.420 -1.162 4.321 1.00 0.00 O ATOM 621 CB GLN A 160 2.042 -2.134 7.332 1.00 0.00 C ATOM 622 CG GLN A 160 1.328 -2.504 8.643 1.00 0.00 C ATOM 623 CD GLN A 160 0.292 -3.627 8.527 1.00 0.00 C ATOM 624 OE1 GLN A 160 -0.028 -4.303 9.504 1.00 0.00 O ATOM 625 NE2 GLN A 160 -0.242 -3.917 7.353 1.00 0.00 N ATOM 0 H GLN A 160 -0.546 -1.473 6.607 1.00 0.00 H new ATOM 0 HA GLN A 160 2.100 -0.125 6.661 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.075 -3.027 6.708 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.073 -1.877 7.576 1.00 0.00 H new ATOM 0 HG2 GLN A 160 2.079 -2.798 9.376 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.834 -1.614 9.032 1.00 0.00 H new ATOM 0 HE21 GLN A 160 0.009 -3.370 6.530 1.00 0.00 H new ATOM 0 HE22 GLN A 160 -0.905 -4.688 7.271 1.00 0.00 H new ATOM 634 N VAL A 161 2.523 -1.930 4.451 1.00 0.00 N ATOM 635 CA VAL A 161 2.625 -2.422 3.070 1.00 0.00 C ATOM 636 C VAL A 161 3.382 -3.764 3.055 1.00 0.00 C ATOM 637 O VAL A 161 4.353 -3.897 3.795 1.00 0.00 O ATOM 638 CB VAL A 161 3.297 -1.343 2.184 1.00 0.00 C ATOM 639 CG1 VAL A 161 2.353 -0.158 1.929 1.00 0.00 C ATOM 640 CG2 VAL A 161 4.595 -0.760 2.778 1.00 0.00 C ATOM 0 H VAL A 161 3.379 -2.078 4.986 1.00 0.00 H new ATOM 0 HA VAL A 161 1.634 -2.608 2.655 1.00 0.00 H new ATOM 0 HB VAL A 161 3.538 -1.871 1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.856 0.580 1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.455 -0.511 1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 161 2.077 0.299 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 161 5.003 -0.012 2.098 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.378 -0.295 3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.323 -1.559 2.917 1.00 0.00 H new ATOM 650 N TYR A 162 2.945 -4.766 2.278 1.00 0.00 N ATOM 651 CA TYR A 162 3.603 -6.066 2.091 1.00 0.00 C ATOM 652 C TYR A 162 4.504 -6.030 0.855 1.00 0.00 C ATOM 653 O TYR A 162 3.990 -5.963 -0.267 1.00 0.00 O ATOM 654 CB TYR A 162 2.559 -7.174 1.848 1.00 0.00 C ATOM 655 CG TYR A 162 2.292 -8.087 3.015 1.00 0.00 C ATOM 656 CD1 TYR A 162 3.347 -8.843 3.557 1.00 0.00 C ATOM 657 CD2 TYR A 162 0.998 -8.193 3.551 1.00 0.00 C ATOM 658 CE1 TYR A 162 3.114 -9.699 4.643 1.00 0.00 C ATOM 659 CE2 TYR A 162 0.758 -9.056 4.639 1.00 0.00 C ATOM 660 CZ TYR A 162 1.819 -9.807 5.201 1.00 0.00 C ATOM 661 OH TYR A 162 1.599 -10.612 6.283 1.00 0.00 O ATOM 0 H TYR A 162 2.083 -4.688 1.738 1.00 0.00 H new ATOM 0 HA TYR A 162 4.180 -6.270 2.993 1.00 0.00 H new ATOM 0 HB2 TYR A 162 1.620 -6.705 1.555 1.00 0.00 H new ATOM 0 HB3 TYR A 162 2.889 -7.780 1.004 1.00 0.00 H new ATOM 0 HD1 TYR A 162 4.338 -8.764 3.136 1.00 0.00 H new ATOM 0 HD2 TYR A 162 0.189 -7.614 3.130 1.00 0.00 H new ATOM 0 HE1 TYR A 162 3.927 -10.278 5.055 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -0.239 -9.145 5.046 1.00 0.00 H new ATOM 0 HH TYR A 162 0.654 -10.567 6.537 1.00 0.00 H new ATOM 671 N TYR A 163 5.826 -6.127 1.020 1.00 0.00 N ATOM 672 CA TYR A 163 6.739 -5.974 -0.122 1.00 0.00 C ATOM 673 C TYR A 163 8.109 -6.663 0.103 1.00 0.00 C ATOM 674 O TYR A 163 8.307 -7.277 1.142 1.00 0.00 O ATOM 675 CB TYR A 163 6.814 -4.473 -0.388 1.00 0.00 C ATOM 676 CG TYR A 163 7.703 -3.742 0.567 1.00 0.00 C ATOM 677 CD1 TYR A 163 7.276 -3.371 1.854 1.00 0.00 C ATOM 678 CD2 TYR A 163 9.000 -3.477 0.139 1.00 0.00 C ATOM 679 CE1 TYR A 163 8.156 -2.691 2.712 1.00 0.00 C ATOM 680 CE2 TYR A 163 9.887 -2.818 0.993 1.00 0.00 C ATOM 681 CZ TYR A 163 9.465 -2.389 2.274 1.00 0.00 C ATOM 682 OH TYR A 163 10.267 -1.611 3.045 1.00 0.00 O ATOM 0 H TYR A 163 6.284 -6.307 1.914 1.00 0.00 H new ATOM 0 HA TYR A 163 6.369 -6.489 -1.008 1.00 0.00 H new ATOM 0 HB2 TYR A 163 7.173 -4.310 -1.404 1.00 0.00 H new ATOM 0 HB3 TYR A 163 5.810 -4.052 -0.333 1.00 0.00 H new ATOM 0 HD1 TYR A 163 6.275 -3.608 2.182 1.00 0.00 H new ATOM 0 HD2 TYR A 163 9.319 -3.779 -0.848 1.00 0.00 H new ATOM 0 HE1 TYR A 163 7.834 -2.401 3.701 1.00 0.00 H new ATOM 0 HE2 TYR A 163 10.902 -2.634 0.674 1.00 0.00 H new ATOM 0 HH TYR A 163 11.135 -1.498 2.604 1.00 0.00 H new ATOM 692 N ARG A 164 9.053 -6.668 -0.850 1.00 0.00 N ATOM 693 CA ARG A 164 10.403 -7.253 -0.651 1.00 0.00 C ATOM 694 C ARG A 164 11.433 -6.160 -0.359 1.00 0.00 C ATOM 695 O ARG A 164 11.237 -5.046 -0.840 1.00 0.00 O ATOM 696 CB ARG A 164 10.881 -8.007 -1.902 1.00 0.00 C ATOM 697 CG ARG A 164 10.530 -9.501 -1.943 1.00 0.00 C ATOM 698 CD ARG A 164 9.286 -9.768 -2.773 1.00 0.00 C ATOM 699 NE ARG A 164 9.365 -9.282 -4.160 1.00 0.00 N ATOM 700 CZ ARG A 164 9.848 -9.959 -5.215 1.00 0.00 C ATOM 701 NH1 ARG A 164 10.613 -11.039 -5.046 1.00 0.00 N ATOM 702 NH2 ARG A 164 9.566 -9.553 -6.446 1.00 0.00 N ATOM 0 H ARG A 164 8.911 -6.271 -1.779 1.00 0.00 H new ATOM 0 HA ARG A 164 10.320 -7.940 0.191 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.453 -7.526 -2.781 1.00 0.00 H new ATOM 0 HB3 ARG A 164 11.963 -7.903 -1.977 1.00 0.00 H new ATOM 0 HG2 ARG A 164 11.369 -10.060 -2.357 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.374 -9.865 -0.928 1.00 0.00 H new ATOM 0 HD2 ARG A 164 9.097 -10.841 -2.787 1.00 0.00 H new ATOM 0 HD3 ARG A 164 8.431 -9.300 -2.285 1.00 0.00 H new ATOM 0 HE ARG A 164 9.019 -8.339 -4.338 1.00 0.00 H new ATOM 0 HH11 ARG A 164 10.839 -11.362 -4.105 1.00 0.00 H new ATOM 0 HH12 ARG A 164 10.972 -11.542 -5.858 1.00 0.00 H new ATOM 0 HH21 ARG A 164 8.983 -8.728 -6.590 1.00 0.00 H new ATOM 0 HH22 ARG A 164 9.932 -10.066 -7.248 1.00 0.00 H new ATOM 716 N PRO A 165 12.572 -6.468 0.292 1.00 0.00 N ATOM 717 CA PRO A 165 13.601 -5.465 0.508 1.00 0.00 C ATOM 718 C PRO A 165 14.075 -4.846 -0.802 1.00 0.00 C ATOM 719 O PRO A 165 13.983 -5.442 -1.878 1.00 0.00 O ATOM 720 CB PRO A 165 14.780 -6.150 1.199 1.00 0.00 C ATOM 721 CG PRO A 165 14.314 -7.575 1.510 1.00 0.00 C ATOM 722 CD PRO A 165 13.024 -7.785 0.717 1.00 0.00 C ATOM 0 HA PRO A 165 13.190 -4.661 1.118 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.659 -6.158 0.555 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.058 -5.622 2.111 1.00 0.00 H new ATOM 0 HG2 PRO A 165 15.071 -8.304 1.221 1.00 0.00 H new ATOM 0 HG3 PRO A 165 14.139 -7.703 2.578 1.00 0.00 H new ATOM 0 HD2 PRO A 165 13.200 -8.430 -0.144 1.00 0.00 H new ATOM 0 HD3 PRO A 165 12.268 -8.274 1.331 1.00 0.00 H new ATOM 730 N VAL A 166 14.682 -3.675 -0.681 1.00 0.00 N ATOM 731 CA VAL A 166 15.299 -2.947 -1.790 1.00 0.00 C ATOM 732 C VAL A 166 16.438 -3.762 -2.398 1.00 0.00 C ATOM 733 O VAL A 166 16.688 -3.663 -3.594 1.00 0.00 O ATOM 734 CB VAL A 166 15.771 -1.573 -1.292 1.00 0.00 C ATOM 735 CG1 VAL A 166 16.274 -0.671 -2.418 1.00 0.00 C ATOM 736 CG2 VAL A 166 14.598 -0.888 -0.598 1.00 0.00 C ATOM 0 H VAL A 166 14.764 -3.189 0.212 1.00 0.00 H new ATOM 0 HA VAL A 166 14.567 -2.789 -2.582 1.00 0.00 H new ATOM 0 HB VAL A 166 16.608 -1.735 -0.613 1.00 0.00 H new ATOM 0 HG11 VAL A 166 16.593 0.285 -2.003 1.00 0.00 H new ATOM 0 HG12 VAL A 166 17.116 -1.149 -2.918 1.00 0.00 H new ATOM 0 HG13 VAL A 166 15.472 -0.505 -3.137 1.00 0.00 H new ATOM 0 HG21 VAL A 166 14.911 0.091 -0.236 1.00 0.00 H new ATOM 0 HG22 VAL A 166 13.777 -0.768 -1.305 1.00 0.00 H new ATOM 0 HG23 VAL A 166 14.267 -1.497 0.243 1.00 0.00 H new ATOM 746 N ASP A 167 17.031 -4.650 -1.601 1.00 0.00 N ATOM 747 CA ASP A 167 18.091 -5.587 -1.945 1.00 0.00 C ATOM 748 C ASP A 167 17.670 -6.592 -3.029 1.00 0.00 C ATOM 749 O ASP A 167 18.472 -7.413 -3.463 1.00 0.00 O ATOM 750 CB ASP A 167 18.481 -6.274 -0.625 1.00 0.00 C ATOM 751 CG ASP A 167 19.851 -6.958 -0.608 1.00 0.00 C ATOM 752 OD1 ASP A 167 20.753 -6.582 -1.386 1.00 0.00 O ATOM 753 OD2 ASP A 167 20.068 -7.801 0.294 1.00 0.00 O ATOM 0 H ASP A 167 16.759 -4.737 -0.622 1.00 0.00 H new ATOM 0 HA ASP A 167 18.941 -5.068 -2.387 1.00 0.00 H new ATOM 0 HB2 ASP A 167 18.458 -5.529 0.171 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.721 -7.019 -0.387 1.00 0.00 H new ATOM 758 N GLN A 168 16.414 -6.544 -3.483 1.00 0.00 N ATOM 759 CA GLN A 168 15.872 -7.381 -4.544 1.00 0.00 C ATOM 760 C GLN A 168 15.575 -6.576 -5.826 1.00 0.00 C ATOM 761 O GLN A 168 14.976 -7.139 -6.753 1.00 0.00 O ATOM 762 CB GLN A 168 14.596 -8.086 -4.046 1.00 0.00 C ATOM 763 CG GLN A 168 14.637 -8.667 -2.622 1.00 0.00 C ATOM 764 CD GLN A 168 15.748 -9.676 -2.370 1.00 0.00 C ATOM 765 OE1 GLN A 168 15.749 -10.760 -2.951 1.00 0.00 O ATOM 766 NE2 GLN A 168 16.650 -9.382 -1.449 1.00 0.00 N ATOM 0 H GLN A 168 15.725 -5.895 -3.103 1.00 0.00 H new ATOM 0 HA GLN A 168 16.627 -8.124 -4.801 1.00 0.00 H new ATOM 0 HB2 GLN A 168 13.772 -7.375 -4.099 1.00 0.00 H new ATOM 0 HB3 GLN A 168 14.363 -8.896 -4.737 1.00 0.00 H new ATOM 0 HG2 GLN A 168 14.745 -7.846 -1.914 1.00 0.00 H new ATOM 0 HG3 GLN A 168 13.679 -9.144 -2.413 1.00 0.00 H new ATOM 0 HE21 GLN A 168 16.626 -8.475 -0.983 1.00 0.00 H new ATOM 0 HE22 GLN A 168 17.370 -10.062 -1.205 1.00 0.00 H new ATOM 775 N TYR A 169 15.906 -5.278 -5.884 1.00 0.00 N ATOM 776 CA TYR A 169 15.484 -4.363 -6.941 1.00 0.00 C ATOM 777 C TYR A 169 16.589 -3.373 -7.304 1.00 0.00 C ATOM 778 O TYR A 169 17.344 -2.941 -6.438 1.00 0.00 O ATOM 779 CB TYR A 169 14.286 -3.533 -6.459 1.00 0.00 C ATOM 780 CG TYR A 169 13.046 -4.319 -6.107 1.00 0.00 C ATOM 781 CD1 TYR A 169 12.199 -4.778 -7.127 1.00 0.00 C ATOM 782 CD2 TYR A 169 12.735 -4.583 -4.765 1.00 0.00 C ATOM 783 CE1 TYR A 169 11.012 -5.458 -6.817 1.00 0.00 C ATOM 784 CE2 TYR A 169 11.570 -5.296 -4.443 1.00 0.00 C ATOM 785 CZ TYR A 169 10.708 -5.742 -5.470 1.00 0.00 C ATOM 786 OH TYR A 169 9.632 -6.508 -5.158 1.00 0.00 O ATOM 0 H TYR A 169 16.489 -4.830 -5.177 1.00 0.00 H new ATOM 0 HA TYR A 169 15.232 -4.973 -7.809 1.00 0.00 H new ATOM 0 HB2 TYR A 169 14.592 -2.961 -5.583 1.00 0.00 H new ATOM 0 HB3 TYR A 169 14.030 -2.813 -7.236 1.00 0.00 H new ATOM 0 HD1 TYR A 169 12.463 -4.606 -8.160 1.00 0.00 H new ATOM 0 HD2 TYR A 169 13.392 -4.238 -3.980 1.00 0.00 H new ATOM 0 HE1 TYR A 169 10.337 -5.761 -7.603 1.00 0.00 H new ATOM 0 HE2 TYR A 169 11.332 -5.504 -3.410 1.00 0.00 H new ATOM 0 HH TYR A 169 9.078 -6.635 -5.956 1.00 0.00 H new ATOM 796 N ASN A 170 16.589 -2.894 -8.553 1.00 0.00 N ATOM 797 CA ASN A 170 17.378 -1.732 -8.985 1.00 0.00 C ATOM 798 C ASN A 170 16.534 -0.455 -8.960 1.00 0.00 C ATOM 799 O ASN A 170 17.093 0.641 -8.855 1.00 0.00 O ATOM 800 CB ASN A 170 17.982 -1.864 -10.408 1.00 0.00 C ATOM 801 CG ASN A 170 17.918 -3.243 -11.044 1.00 0.00 C ATOM 802 OD1 ASN A 170 18.915 -3.952 -11.126 1.00 0.00 O ATOM 803 ND2 ASN A 170 16.770 -3.634 -11.565 1.00 0.00 N ATOM 0 H ASN A 170 16.034 -3.307 -9.303 1.00 0.00 H new ATOM 0 HA ASN A 170 18.200 -1.683 -8.271 1.00 0.00 H new ATOM 0 HB2 ASN A 170 17.468 -1.161 -11.064 1.00 0.00 H new ATOM 0 HB3 ASN A 170 19.027 -1.555 -10.366 1.00 0.00 H new ATOM 0 HD21 ASN A 170 16.706 -4.534 -12.041 1.00 0.00 H new ATOM 0 HD22 ASN A 170 15.947 -3.037 -11.491 1.00 0.00 H new ATOM 810 N ASN A 171 15.210 -0.559 -9.124 1.00 0.00 N ATOM 811 CA ASN A 171 14.344 0.516 -9.564 1.00 0.00 C ATOM 812 C ASN A 171 13.075 0.511 -8.757 1.00 0.00 C ATOM 813 O ASN A 171 12.336 -0.478 -8.721 1.00 0.00 O ATOM 814 CB ASN A 171 13.953 0.445 -11.054 1.00 0.00 C ATOM 815 CG ASN A 171 13.867 -0.924 -11.735 1.00 0.00 C ATOM 816 OD1 ASN A 171 14.592 -1.865 -11.433 1.00 0.00 O ATOM 817 ND2 ASN A 171 12.988 -1.100 -12.697 1.00 0.00 N ATOM 0 H ASN A 171 14.705 -1.427 -8.945 1.00 0.00 H new ATOM 0 HA ASN A 171 14.921 1.429 -9.419 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.982 0.928 -11.163 1.00 0.00 H new ATOM 0 HB3 ASN A 171 14.672 1.045 -11.612 1.00 0.00 H new ATOM 0 HD21 ASN A 171 12.923 -2.001 -13.170 1.00 0.00 H new ATOM 0 HD22 ASN A 171 12.371 -0.335 -12.970 1.00 0.00 H new ATOM 824 N GLN A 172 12.771 1.687 -8.221 1.00 0.00 N ATOM 825 CA GLN A 172 11.543 1.916 -7.512 1.00 0.00 C ATOM 826 C GLN A 172 10.334 1.567 -8.386 1.00 0.00 C ATOM 827 O GLN A 172 9.373 0.996 -7.876 1.00 0.00 O ATOM 828 CB GLN A 172 11.474 3.376 -7.055 1.00 0.00 C ATOM 829 CG GLN A 172 10.212 3.595 -6.222 1.00 0.00 C ATOM 830 CD GLN A 172 9.656 4.987 -6.419 1.00 0.00 C ATOM 831 OE1 GLN A 172 10.189 5.955 -5.892 1.00 0.00 O ATOM 832 NE2 GLN A 172 8.594 5.110 -7.196 1.00 0.00 N ATOM 0 H GLN A 172 13.379 2.504 -8.273 1.00 0.00 H new ATOM 0 HA GLN A 172 11.519 1.268 -6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 172 12.357 3.625 -6.467 1.00 0.00 H new ATOM 0 HB3 GLN A 172 11.470 4.038 -7.921 1.00 0.00 H new ATOM 0 HG2 GLN A 172 9.459 2.858 -6.500 1.00 0.00 H new ATOM 0 HG3 GLN A 172 10.438 3.438 -5.167 1.00 0.00 H new ATOM 0 HE21 GLN A 172 8.174 4.283 -7.620 1.00 0.00 H new ATOM 0 HE22 GLN A 172 8.195 6.032 -7.372 1.00 0.00 H new ATOM 841 N ASN A 173 10.326 1.893 -9.685 1.00 0.00 N ATOM 842 CA ASN A 173 9.083 1.779 -10.481 1.00 0.00 C ATOM 843 C ASN A 173 8.547 0.363 -10.627 1.00 0.00 C ATOM 844 O ASN A 173 7.420 0.131 -11.059 1.00 0.00 O ATOM 845 CB ASN A 173 9.309 2.348 -11.877 1.00 0.00 C ATOM 846 CG ASN A 173 8.281 3.436 -12.111 1.00 0.00 C ATOM 847 OD1 ASN A 173 7.161 3.173 -12.540 1.00 0.00 O ATOM 848 ND2 ASN A 173 8.574 4.652 -11.701 1.00 0.00 N ATOM 0 H ASN A 173 11.139 2.229 -10.202 1.00 0.00 H new ATOM 0 HA ASN A 173 8.336 2.344 -9.924 1.00 0.00 H new ATOM 0 HB2 ASN A 173 10.318 2.751 -11.965 1.00 0.00 H new ATOM 0 HB3 ASN A 173 9.212 1.564 -12.628 1.00 0.00 H new ATOM 0 HD21 ASN A 173 7.867 5.387 -11.738 1.00 0.00 H new ATOM 0 HD22 ASN A 173 9.508 4.860 -11.346 1.00 0.00 H new ATOM 855 N THR A 174 9.390 -0.568 -10.237 1.00 0.00 N ATOM 856 CA THR A 174 9.154 -2.000 -10.286 1.00 0.00 C ATOM 857 C THR A 174 8.983 -2.570 -8.874 1.00 0.00 C ATOM 858 O THR A 174 8.260 -3.548 -8.710 1.00 0.00 O ATOM 859 CB THR A 174 10.280 -2.619 -11.130 1.00 0.00 C ATOM 860 OG1 THR A 174 9.837 -2.962 -12.432 1.00 0.00 O ATOM 861 CG2 THR A 174 11.000 -3.803 -10.506 1.00 0.00 C ATOM 0 H THR A 174 10.308 -0.337 -9.857 1.00 0.00 H new ATOM 0 HA THR A 174 8.213 -2.254 -10.774 1.00 0.00 H new ATOM 0 HB THR A 174 11.019 -1.819 -11.183 1.00 0.00 H new ATOM 0 HG1 THR A 174 10.580 -3.351 -12.939 1.00 0.00 H new ATOM 0 HG21 THR A 174 11.773 -4.159 -11.187 1.00 0.00 H new ATOM 0 HG22 THR A 174 11.458 -3.496 -9.566 1.00 0.00 H new ATOM 0 HG23 THR A 174 10.286 -4.605 -10.317 1.00 0.00 H new ATOM 869 N PHE A 175 9.572 -1.940 -7.856 1.00 0.00 N ATOM 870 CA PHE A 175 9.209 -2.141 -6.466 1.00 0.00 C ATOM 871 C PHE A 175 7.762 -1.686 -6.237 1.00 0.00 C ATOM 872 O PHE A 175 6.961 -2.504 -5.809 1.00 0.00 O ATOM 873 CB PHE A 175 10.195 -1.388 -5.566 1.00 0.00 C ATOM 874 CG PHE A 175 9.573 -0.883 -4.283 1.00 0.00 C ATOM 875 CD1 PHE A 175 9.047 -1.777 -3.334 1.00 0.00 C ATOM 876 CD2 PHE A 175 9.351 0.497 -4.138 1.00 0.00 C ATOM 877 CE1 PHE A 175 8.281 -1.281 -2.272 1.00 0.00 C ATOM 878 CE2 PHE A 175 8.535 0.981 -3.108 1.00 0.00 C ATOM 879 CZ PHE A 175 7.998 0.084 -2.178 1.00 0.00 C ATOM 0 H PHE A 175 10.327 -1.266 -7.984 1.00 0.00 H new ATOM 0 HA PHE A 175 9.266 -3.200 -6.213 1.00 0.00 H new ATOM 0 HB2 PHE A 175 11.029 -2.047 -5.322 1.00 0.00 H new ATOM 0 HB3 PHE A 175 10.607 -0.543 -6.118 1.00 0.00 H new ATOM 0 HD1 PHE A 175 9.232 -2.837 -3.423 1.00 0.00 H new ATOM 0 HD2 PHE A 175 9.813 1.189 -4.826 1.00 0.00 H new ATOM 0 HE1 PHE A 175 7.906 -1.959 -1.520 1.00 0.00 H new ATOM 0 HE2 PHE A 175 8.322 2.037 -3.032 1.00 0.00 H new ATOM 0 HZ PHE A 175 7.362 0.448 -1.384 1.00 0.00 H new ATOM 889 N VAL A 176 7.397 -0.418 -6.484 1.00 0.00 N ATOM 890 CA VAL A 176 6.090 0.097 -6.065 1.00 0.00 C ATOM 891 C VAL A 176 5.000 -0.719 -6.728 1.00 0.00 C ATOM 892 O VAL A 176 4.077 -1.143 -6.043 1.00 0.00 O ATOM 893 CB VAL A 176 5.926 1.599 -6.381 1.00 0.00 C ATOM 894 CG1 VAL A 176 4.499 2.126 -6.168 1.00 0.00 C ATOM 895 CG2 VAL A 176 6.819 2.455 -5.490 1.00 0.00 C ATOM 0 H VAL A 176 7.984 0.262 -6.967 1.00 0.00 H new ATOM 0 HA VAL A 176 6.013 0.000 -4.982 1.00 0.00 H new ATOM 0 HB VAL A 176 6.195 1.677 -7.434 1.00 0.00 H new ATOM 0 HG11 VAL A 176 4.463 3.188 -6.410 1.00 0.00 H new ATOM 0 HG12 VAL A 176 3.810 1.583 -6.815 1.00 0.00 H new ATOM 0 HG13 VAL A 176 4.209 1.982 -5.127 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.679 3.507 -5.738 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.555 2.291 -4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.862 2.180 -5.649 1.00 0.00 H new ATOM 905 N HIS A 177 5.110 -0.965 -8.034 1.00 0.00 N ATOM 906 CA HIS A 177 4.097 -1.747 -8.728 1.00 0.00 C ATOM 907 C HIS A 177 3.884 -3.123 -8.079 1.00 0.00 C ATOM 908 O HIS A 177 2.748 -3.592 -8.022 1.00 0.00 O ATOM 909 CB HIS A 177 4.477 -1.850 -10.208 1.00 0.00 C ATOM 910 CG HIS A 177 4.279 -0.558 -10.967 1.00 0.00 C ATOM 911 ND1 HIS A 177 4.131 0.714 -10.442 1.00 0.00 N ATOM 912 CD2 HIS A 177 4.163 -0.455 -12.324 1.00 0.00 C ATOM 913 CE1 HIS A 177 3.951 1.561 -11.464 1.00 0.00 C ATOM 914 NE2 HIS A 177 3.970 0.897 -12.632 1.00 0.00 N ATOM 0 H HIS A 177 5.878 -0.639 -8.621 1.00 0.00 H new ATOM 0 HA HIS A 177 3.136 -1.239 -8.648 1.00 0.00 H new ATOM 0 HB2 HIS A 177 5.521 -2.154 -10.288 1.00 0.00 H new ATOM 0 HB3 HIS A 177 3.880 -2.633 -10.676 1.00 0.00 H new ATOM 0 HD2 HIS A 177 4.211 -1.269 -13.032 1.00 0.00 H new ATOM 0 HE1 HIS A 177 3.810 2.627 -11.363 1.00 0.00 H new ATOM 0 HE2 HIS A 177 3.864 1.300 -13.563 1.00 0.00 H new ATOM 922 N ASP A 178 4.946 -3.731 -7.545 1.00 0.00 N ATOM 923 CA ASP A 178 4.930 -5.057 -6.925 1.00 0.00 C ATOM 924 C ASP A 178 4.343 -4.941 -5.515 1.00 0.00 C ATOM 925 O ASP A 178 3.401 -5.642 -5.161 1.00 0.00 O ATOM 926 CB ASP A 178 6.390 -5.544 -6.888 1.00 0.00 C ATOM 927 CG ASP A 178 6.660 -7.005 -6.530 1.00 0.00 C ATOM 928 OD1 ASP A 178 5.812 -7.704 -5.934 1.00 0.00 O ATOM 929 OD2 ASP A 178 7.822 -7.432 -6.738 1.00 0.00 O ATOM 0 H ASP A 178 5.870 -3.300 -7.532 1.00 0.00 H new ATOM 0 HA ASP A 178 4.316 -5.766 -7.480 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.828 -5.356 -7.868 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.929 -4.922 -6.174 1.00 0.00 H new ATOM 934 N CYS A 179 4.873 -4.016 -4.714 1.00 0.00 N ATOM 935 CA CYS A 179 4.464 -3.672 -3.355 1.00 0.00 C ATOM 936 C CYS A 179 2.977 -3.382 -3.299 1.00 0.00 C ATOM 937 O CYS A 179 2.288 -3.953 -2.461 1.00 0.00 O ATOM 938 CB CYS A 179 5.251 -2.416 -2.942 1.00 0.00 C ATOM 939 SG CYS A 179 4.892 -1.671 -1.321 1.00 0.00 S ATOM 0 H CYS A 179 5.659 -3.445 -5.024 1.00 0.00 H new ATOM 0 HA CYS A 179 4.668 -4.504 -2.681 1.00 0.00 H new ATOM 0 HB2 CYS A 179 6.312 -2.665 -2.967 1.00 0.00 H new ATOM 0 HB3 CYS A 179 5.085 -1.654 -3.703 1.00 0.00 H new ATOM 944 N VAL A 180 2.478 -2.532 -4.191 1.00 0.00 N ATOM 945 CA VAL A 180 1.063 -2.221 -4.320 1.00 0.00 C ATOM 946 C VAL A 180 0.309 -3.496 -4.622 1.00 0.00 C ATOM 947 O VAL A 180 -0.573 -3.848 -3.843 1.00 0.00 O ATOM 948 CB VAL A 180 0.873 -1.102 -5.373 1.00 0.00 C ATOM 949 CG1 VAL A 180 -0.599 -0.848 -5.689 1.00 0.00 C ATOM 950 CG2 VAL A 180 1.469 0.244 -4.929 1.00 0.00 C ATOM 0 H VAL A 180 3.062 -2.030 -4.859 1.00 0.00 H new ATOM 0 HA VAL A 180 0.650 -1.828 -3.391 1.00 0.00 H new ATOM 0 HB VAL A 180 1.398 -1.471 -6.254 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.680 -0.055 -6.432 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.050 -1.760 -6.081 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.120 -0.548 -4.780 1.00 0.00 H new ATOM 0 HG21 VAL A 180 1.305 0.989 -5.708 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.986 0.570 -4.008 1.00 0.00 H new ATOM 0 HG23 VAL A 180 2.539 0.129 -4.756 1.00 0.00 H new ATOM 960 N ASN A 181 0.668 -4.205 -5.690 1.00 0.00 N ATOM 961 CA ASN A 181 -0.080 -5.373 -6.121 1.00 0.00 C ATOM 962 C ASN A 181 -0.186 -6.428 -5.042 1.00 0.00 C ATOM 963 O ASN A 181 -1.237 -7.050 -4.900 1.00 0.00 O ATOM 964 CB ASN A 181 0.591 -6.003 -7.345 1.00 0.00 C ATOM 965 CG ASN A 181 -0.213 -5.705 -8.578 1.00 0.00 C ATOM 966 OD1 ASN A 181 -0.960 -6.564 -9.042 1.00 0.00 O ATOM 967 ND2 ASN A 181 -0.140 -4.470 -9.032 1.00 0.00 N ATOM 0 H ASN A 181 1.477 -3.986 -6.272 1.00 0.00 H new ATOM 0 HA ASN A 181 -1.085 -5.026 -6.361 1.00 0.00 H new ATOM 0 HB2 ASN A 181 1.603 -5.613 -7.457 1.00 0.00 H new ATOM 0 HB3 ASN A 181 0.678 -7.081 -7.209 1.00 0.00 H new ATOM 0 HD21 ASN A 181 -0.726 -4.179 -9.815 1.00 0.00 H new ATOM 0 HD22 ASN A 181 0.502 -3.805 -8.601 1.00 0.00 H new ATOM 974 N ILE A 182 0.893 -6.692 -4.317 1.00 0.00 N ATOM 975 CA ILE A 182 0.879 -7.642 -3.243 1.00 0.00 C ATOM 976 C ILE A 182 0.158 -7.060 -2.036 1.00 0.00 C ATOM 977 O ILE A 182 -0.609 -7.810 -1.448 1.00 0.00 O ATOM 978 CB ILE A 182 2.335 -8.032 -2.979 1.00 0.00 C ATOM 979 CG1 ILE A 182 2.985 -8.704 -4.219 1.00 0.00 C ATOM 980 CG2 ILE A 182 2.508 -8.906 -1.730 1.00 0.00 C ATOM 981 CD1 ILE A 182 2.103 -9.378 -5.282 1.00 0.00 C ATOM 0 H ILE A 182 1.798 -6.246 -4.467 1.00 0.00 H new ATOM 0 HA ILE A 182 0.322 -8.545 -3.491 1.00 0.00 H new ATOM 0 HB ILE A 182 2.860 -7.097 -2.783 1.00 0.00 H new ATOM 0 HG12 ILE A 182 3.578 -7.943 -4.726 1.00 0.00 H new ATOM 0 HG13 ILE A 182 3.681 -9.458 -3.851 1.00 0.00 H new ATOM 0 HG21 ILE A 182 3.563 -9.148 -1.598 1.00 0.00 H new ATOM 0 HG22 ILE A 182 2.148 -8.365 -0.855 1.00 0.00 H new ATOM 0 HG23 ILE A 182 1.937 -9.827 -1.848 1.00 0.00 H new ATOM 0 HD11 ILE A 182 2.733 -9.790 -6.070 1.00 0.00 H new ATOM 0 HD12 ILE A 182 1.527 -10.180 -4.821 1.00 0.00 H new ATOM 0 HD13 ILE A 182 1.422 -8.642 -5.710 1.00 0.00 H new ATOM 993 N THR A 183 0.344 -5.792 -1.667 1.00 0.00 N ATOM 994 CA THR A 183 -0.340 -5.202 -0.531 1.00 0.00 C ATOM 995 C THR A 183 -1.837 -5.339 -0.746 1.00 0.00 C ATOM 996 O THR A 183 -2.463 -6.035 0.056 1.00 0.00 O ATOM 997 CB THR A 183 0.119 -3.763 -0.277 1.00 0.00 C ATOM 998 OG1 THR A 183 1.490 -3.761 0.048 1.00 0.00 O ATOM 999 CG2 THR A 183 -0.645 -3.120 0.885 1.00 0.00 C ATOM 0 H THR A 183 0.973 -5.151 -2.151 1.00 0.00 H new ATOM 0 HA THR A 183 -0.081 -5.736 0.383 1.00 0.00 H new ATOM 0 HB THR A 183 -0.074 -3.191 -1.185 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.020 -3.653 -0.769 1.00 0.00 H new ATOM 0 HG21 THR A 183 -0.290 -2.100 1.033 1.00 0.00 H new ATOM 0 HG22 THR A 183 -1.710 -3.104 0.655 1.00 0.00 H new ATOM 0 HG23 THR A 183 -0.478 -3.698 1.794 1.00 0.00 H new ATOM 1007 N VAL A 184 -2.424 -4.765 -1.807 1.00 0.00 N ATOM 1008 CA VAL A 184 -3.795 -4.836 -2.069 1.00 0.00 C ATOM 1009 C VAL A 184 -4.275 -6.282 -2.112 1.00 0.00 C ATOM 1010 O VAL A 184 -5.178 -6.642 -1.363 1.00 0.00 O ATOM 1011 CB VAL A 184 -3.903 -4.039 -3.363 1.00 0.00 C ATOM 1012 CG1 VAL A 184 -3.591 -2.538 -3.213 1.00 0.00 C ATOM 1013 CG2 VAL A 184 -3.513 -4.622 -4.716 1.00 0.00 C ATOM 0 H VAL A 184 -1.906 -4.231 -2.504 1.00 0.00 H new ATOM 0 HA VAL A 184 -4.453 -4.421 -1.306 1.00 0.00 H new ATOM 0 HB VAL A 184 -4.977 -4.179 -3.483 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -3.692 -2.047 -4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -4.288 -2.090 -2.505 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -2.572 -2.413 -2.847 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -3.673 -3.875 -5.494 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -2.462 -4.909 -4.699 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -4.125 -5.500 -4.924 1.00 0.00 H new ATOM 1023 N LYS A 185 -3.622 -7.141 -2.897 1.00 0.00 N ATOM 1024 CA LYS A 185 -4.025 -8.531 -3.024 1.00 0.00 C ATOM 1025 C LYS A 185 -4.016 -9.254 -1.688 1.00 0.00 C ATOM 1026 O LYS A 185 -5.016 -9.876 -1.350 1.00 0.00 O ATOM 1027 CB LYS A 185 -3.144 -9.217 -4.062 1.00 0.00 C ATOM 1028 CG LYS A 185 -3.632 -10.646 -4.337 1.00 0.00 C ATOM 1029 CD LYS A 185 -2.860 -11.344 -5.460 1.00 0.00 C ATOM 1030 CE LYS A 185 -1.363 -11.527 -5.180 1.00 0.00 C ATOM 1031 NZ LYS A 185 -1.094 -12.558 -4.161 1.00 0.00 N ATOM 0 H LYS A 185 -2.806 -6.890 -3.456 1.00 0.00 H new ATOM 0 HA LYS A 185 -5.059 -8.568 -3.367 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -3.151 -8.642 -4.988 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -2.113 -9.242 -3.710 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -3.543 -11.235 -3.424 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -4.690 -10.618 -4.596 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -3.306 -12.322 -5.638 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -2.978 -10.768 -6.378 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.855 -11.797 -6.106 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -0.941 -10.578 -4.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -0.068 -12.639 -4.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -1.554 -12.291 -3.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -1.470 -13.472 -4.484 1.00 0.00 H new ATOM 1045 N GLN A 186 -2.925 -9.201 -0.921 1.00 0.00 N ATOM 1046 CA GLN A 186 -2.871 -9.838 0.388 1.00 0.00 C ATOM 1047 C GLN A 186 -3.959 -9.282 1.304 1.00 0.00 C ATOM 1048 O GLN A 186 -4.455 -9.997 2.171 1.00 0.00 O ATOM 1049 CB GLN A 186 -1.500 -9.694 1.065 1.00 0.00 C ATOM 1050 CG GLN A 186 -0.350 -10.451 0.385 1.00 0.00 C ATOM 1051 CD GLN A 186 -0.657 -11.899 0.010 1.00 0.00 C ATOM 1052 OE1 GLN A 186 -1.382 -12.630 0.673 1.00 0.00 O ATOM 1053 NE2 GLN A 186 -0.137 -12.348 -1.121 1.00 0.00 N ATOM 0 H GLN A 186 -2.066 -8.721 -1.189 1.00 0.00 H new ATOM 0 HA GLN A 186 -3.041 -10.901 0.219 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -1.243 -8.636 1.106 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -1.583 -10.042 2.095 1.00 0.00 H new ATOM 0 HG2 GLN A 186 -0.065 -9.911 -0.518 1.00 0.00 H new ATOM 0 HG3 GLN A 186 0.514 -10.440 1.049 1.00 0.00 H new ATOM 0 HE21 GLN A 186 0.468 -11.745 -1.679 1.00 0.00 H new ATOM 0 HE22 GLN A 186 -0.341 -13.297 -1.435 1.00 0.00 H new ATOM 1062 N HIS A 187 -4.332 -8.014 1.120 1.00 0.00 N ATOM 1063 CA HIS A 187 -5.411 -7.382 1.871 1.00 0.00 C ATOM 1064 C HIS A 187 -6.807 -7.755 1.353 1.00 0.00 C ATOM 1065 O HIS A 187 -7.772 -7.487 2.063 1.00 0.00 O ATOM 1066 CB HIS A 187 -5.242 -5.850 1.949 1.00 0.00 C ATOM 1067 CG HIS A 187 -5.401 -5.348 3.364 1.00 0.00 C ATOM 1068 ND1 HIS A 187 -4.618 -5.728 4.427 1.00 0.00 N ATOM 1069 CD2 HIS A 187 -6.374 -4.518 3.845 1.00 0.00 C ATOM 1070 CE1 HIS A 187 -5.116 -5.164 5.538 1.00 0.00 C ATOM 1071 NE2 HIS A 187 -6.195 -4.422 5.235 1.00 0.00 N ATOM 0 H HIS A 187 -3.889 -7.395 0.441 1.00 0.00 H new ATOM 0 HA HIS A 187 -5.335 -7.781 2.882 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -4.258 -5.572 1.571 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -5.978 -5.368 1.306 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -7.140 -4.026 3.264 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -4.709 -5.288 6.531 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -6.772 -3.892 5.888 1.00 0.00 H new ATOM 1079 N THR A 188 -6.933 -8.369 0.175 1.00 0.00 N ATOM 1080 CA THR A 188 -8.193 -8.846 -0.407 1.00 0.00 C ATOM 1081 C THR A 188 -8.403 -10.345 -0.146 1.00 0.00 C ATOM 1082 O THR A 188 -9.488 -10.743 0.286 1.00 0.00 O ATOM 1083 CB THR A 188 -8.217 -8.530 -1.913 1.00 0.00 C ATOM 1084 OG1 THR A 188 -7.901 -7.172 -2.158 1.00 0.00 O ATOM 1085 CG2 THR A 188 -9.577 -8.804 -2.550 1.00 0.00 C ATOM 0 H THR A 188 -6.129 -8.556 -0.425 1.00 0.00 H new ATOM 0 HA THR A 188 -9.020 -8.324 0.075 1.00 0.00 H new ATOM 0 HB THR A 188 -7.470 -9.188 -2.358 1.00 0.00 H new ATOM 0 HG1 THR A 188 -6.962 -7.008 -1.930 1.00 0.00 H new ATOM 0 HG21 THR A 188 -9.536 -8.564 -3.612 1.00 0.00 H new ATOM 0 HG22 THR A 188 -9.832 -9.857 -2.426 1.00 0.00 H new ATOM 0 HG23 THR A 188 -10.336 -8.188 -2.067 1.00 0.00 H new ATOM 1093 N VAL A 189 -7.367 -11.171 -0.328 1.00 0.00 N ATOM 1094 CA VAL A 189 -7.343 -12.632 -0.156 1.00 0.00 C ATOM 1095 C VAL A 189 -7.486 -13.053 1.321 1.00 0.00 C ATOM 1096 O VAL A 189 -7.019 -14.109 1.739 1.00 0.00 O ATOM 1097 CB VAL A 189 -6.075 -13.223 -0.822 1.00 0.00 C ATOM 1098 CG1 VAL A 189 -5.967 -12.925 -2.328 1.00 0.00 C ATOM 1099 CG2 VAL A 189 -4.787 -12.818 -0.095 1.00 0.00 C ATOM 0 H VAL A 189 -6.458 -10.813 -0.620 1.00 0.00 H new ATOM 0 HA VAL A 189 -8.215 -13.048 -0.661 1.00 0.00 H new ATOM 0 HB VAL A 189 -6.193 -14.302 -0.726 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -5.054 -13.371 -2.723 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -6.829 -13.346 -2.845 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -5.941 -11.847 -2.485 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -3.929 -13.259 -0.602 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.693 -11.732 -0.099 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -4.823 -13.175 0.934 1.00 0.00 H new ATOM 1109 N THR A 190 -8.118 -12.221 2.138 1.00 0.00 N ATOM 1110 CA THR A 190 -8.248 -12.345 3.574 1.00 0.00 C ATOM 1111 C THR A 190 -9.644 -11.827 3.948 1.00 0.00 C ATOM 1112 O THR A 190 -10.410 -12.562 4.564 1.00 0.00 O ATOM 1113 CB THR A 190 -7.033 -11.653 4.226 1.00 0.00 C ATOM 1114 OG1 THR A 190 -6.920 -11.918 5.602 1.00 0.00 O ATOM 1115 CG2 THR A 190 -7.030 -10.135 4.040 1.00 0.00 C ATOM 0 H THR A 190 -8.584 -11.385 1.785 1.00 0.00 H new ATOM 0 HA THR A 190 -8.211 -13.365 3.956 1.00 0.00 H new ATOM 0 HB THR A 190 -6.180 -12.083 3.701 1.00 0.00 H new ATOM 0 HG1 THR A 190 -6.133 -11.456 5.961 1.00 0.00 H new ATOM 0 HG21 THR A 190 -6.149 -9.711 4.522 1.00 0.00 H new ATOM 0 HG22 THR A 190 -7.010 -9.899 2.976 1.00 0.00 H new ATOM 0 HG23 THR A 190 -7.929 -9.712 4.489 1.00 0.00 H new ATOM 1123 N THR A 191 -10.079 -10.665 3.439 1.00 0.00 N ATOM 1124 CA THR A 191 -11.462 -10.198 3.588 1.00 0.00 C ATOM 1125 C THR A 191 -12.464 -11.182 2.998 1.00 0.00 C ATOM 1126 O THR A 191 -13.559 -11.354 3.526 1.00 0.00 O ATOM 1127 CB THR A 191 -11.672 -8.837 2.910 1.00 0.00 C ATOM 1128 OG1 THR A 191 -10.491 -8.336 2.324 1.00 0.00 O ATOM 1129 CG2 THR A 191 -12.187 -7.840 3.930 1.00 0.00 C ATOM 0 H THR A 191 -9.483 -10.025 2.914 1.00 0.00 H new ATOM 0 HA THR A 191 -11.633 -10.109 4.661 1.00 0.00 H new ATOM 0 HB THR A 191 -12.398 -8.981 2.110 1.00 0.00 H new ATOM 0 HG1 THR A 191 -10.670 -7.459 1.925 1.00 0.00 H new ATOM 0 HG21 THR A 191 -12.337 -6.873 3.450 1.00 0.00 H new ATOM 0 HG22 THR A 191 -13.134 -8.193 4.338 1.00 0.00 H new ATOM 0 HG23 THR A 191 -11.461 -7.736 4.736 1.00 0.00 H new ATOM 1137 N THR A 192 -12.034 -11.882 1.955 1.00 0.00 N ATOM 1138 CA THR A 192 -12.778 -12.870 1.201 1.00 0.00 C ATOM 1139 C THR A 192 -13.135 -14.099 2.064 1.00 0.00 C ATOM 1140 O THR A 192 -13.844 -15.001 1.626 1.00 0.00 O ATOM 1141 CB THR A 192 -11.928 -13.213 -0.038 1.00 0.00 C ATOM 1142 OG1 THR A 192 -12.631 -13.913 -1.042 1.00 0.00 O ATOM 1143 CG2 THR A 192 -10.722 -14.062 0.349 1.00 0.00 C ATOM 0 H THR A 192 -11.088 -11.762 1.592 1.00 0.00 H new ATOM 0 HA THR A 192 -13.744 -12.480 0.882 1.00 0.00 H new ATOM 0 HB THR A 192 -11.627 -12.246 -0.441 1.00 0.00 H new ATOM 0 HG1 THR A 192 -13.277 -14.521 -0.626 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.137 -14.291 -0.542 1.00 0.00 H new ATOM 0 HG22 THR A 192 -10.103 -13.512 1.058 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.063 -14.990 0.808 1.00 0.00 H new ATOM 1151 N THR A 193 -12.577 -14.173 3.274 1.00 0.00 N ATOM 1152 CA THR A 193 -12.807 -15.190 4.284 1.00 0.00 C ATOM 1153 C THR A 193 -13.687 -14.607 5.412 1.00 0.00 C ATOM 1154 O THR A 193 -14.266 -15.335 6.224 1.00 0.00 O ATOM 1155 CB THR A 193 -11.400 -15.635 4.758 1.00 0.00 C ATOM 1156 OG1 THR A 193 -11.149 -17.014 4.585 1.00 0.00 O ATOM 1157 CG2 THR A 193 -11.083 -15.241 6.198 1.00 0.00 C ATOM 0 H THR A 193 -11.907 -13.472 3.589 1.00 0.00 H new ATOM 0 HA THR A 193 -13.352 -16.057 3.911 1.00 0.00 H new ATOM 0 HB THR A 193 -10.731 -15.083 4.098 1.00 0.00 H new ATOM 0 HG1 THR A 193 -10.246 -17.224 4.902 1.00 0.00 H new ATOM 0 HG21 THR A 193 -10.082 -15.586 6.458 1.00 0.00 H new ATOM 0 HG22 THR A 193 -11.130 -14.157 6.297 1.00 0.00 H new ATOM 0 HG23 THR A 193 -11.810 -15.698 6.869 1.00 0.00 H new ATOM 1165 N LYS A 194 -13.743 -13.273 5.524 1.00 0.00 N ATOM 1166 CA LYS A 194 -14.520 -12.585 6.557 1.00 0.00 C ATOM 1167 C LYS A 194 -15.975 -12.421 6.152 1.00 0.00 C ATOM 1168 O LYS A 194 -16.782 -12.007 6.977 1.00 0.00 O ATOM 1169 CB LYS A 194 -13.893 -11.230 6.918 1.00 0.00 C ATOM 1170 CG LYS A 194 -12.444 -11.427 7.353 1.00 0.00 C ATOM 1171 CD LYS A 194 -11.874 -10.135 7.945 1.00 0.00 C ATOM 1172 CE LYS A 194 -10.555 -10.413 8.683 1.00 0.00 C ATOM 1173 NZ LYS A 194 -10.161 -9.317 9.599 1.00 0.00 N ATOM 0 H LYS A 194 -13.247 -12.640 4.896 1.00 0.00 H new ATOM 0 HA LYS A 194 -14.497 -13.213 7.447 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -13.936 -10.559 6.060 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -14.461 -10.759 7.720 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -12.387 -12.227 8.091 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -11.842 -11.738 6.499 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -11.706 -9.408 7.151 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -12.596 -9.695 8.633 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -10.652 -11.338 9.252 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -9.762 -10.570 7.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -9.265 -9.561 10.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -10.040 -8.438 9.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -10.901 -9.181 10.317 1.00 0.00 H new ATOM 1187 N GLY A 195 -16.286 -12.754 4.904 1.00 0.00 N ATOM 1188 CA GLY A 195 -17.597 -12.550 4.320 1.00 0.00 C ATOM 1189 C GLY A 195 -17.693 -11.164 3.691 1.00 0.00 C ATOM 1190 O GLY A 195 -18.802 -10.713 3.406 1.00 0.00 O ATOM 0 H GLY A 195 -15.618 -13.181 4.262 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -17.787 -13.312 3.565 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -18.364 -12.662 5.086 1.00 0.00 H new ATOM 1194 N GLU A 196 -16.564 -10.479 3.464 1.00 0.00 N ATOM 1195 CA GLU A 196 -16.539 -9.200 2.770 1.00 0.00 C ATOM 1196 C GLU A 196 -15.700 -9.346 1.506 1.00 0.00 C ATOM 1197 O GLU A 196 -15.058 -10.366 1.257 1.00 0.00 O ATOM 1198 CB GLU A 196 -15.994 -8.094 3.686 1.00 0.00 C ATOM 1199 CG GLU A 196 -16.965 -7.657 4.797 1.00 0.00 C ATOM 1200 CD GLU A 196 -18.099 -6.762 4.288 1.00 0.00 C ATOM 1201 OE1 GLU A 196 -18.993 -7.262 3.568 1.00 0.00 O ATOM 1202 OE2 GLU A 196 -18.080 -5.544 4.590 1.00 0.00 O ATOM 0 H GLU A 196 -15.644 -10.804 3.760 1.00 0.00 H new ATOM 0 HA GLU A 196 -17.552 -8.910 2.492 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -15.068 -8.441 4.145 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -15.742 -7.226 3.077 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -17.393 -8.543 5.266 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -16.409 -7.125 5.568 1.00 0.00 H new ATOM 1209 N ASN A 197 -15.751 -8.323 0.674 1.00 0.00 N ATOM 1210 CA ASN A 197 -15.204 -8.254 -0.673 1.00 0.00 C ATOM 1211 C ASN A 197 -15.224 -6.780 -1.075 1.00 0.00 C ATOM 1212 O ASN A 197 -15.952 -5.976 -0.489 1.00 0.00 O ATOM 1213 CB ASN A 197 -16.042 -9.093 -1.662 1.00 0.00 C ATOM 1214 CG ASN A 197 -17.529 -8.789 -1.542 1.00 0.00 C ATOM 1215 OD1 ASN A 197 -18.049 -7.852 -2.136 1.00 0.00 O ATOM 1216 ND2 ASN A 197 -18.239 -9.534 -0.715 1.00 0.00 N ATOM 0 H ASN A 197 -16.210 -7.452 0.940 1.00 0.00 H new ATOM 0 HA ASN A 197 -14.193 -8.660 -0.697 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -15.711 -8.892 -2.681 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.871 -10.153 -1.475 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -19.228 -9.331 -0.567 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -17.799 -10.312 -0.224 1.00 0.00 H new ATOM 1223 N PHE A 198 -14.425 -6.427 -2.072 1.00 0.00 N ATOM 1224 CA PHE A 198 -14.240 -5.065 -2.557 1.00 0.00 C ATOM 1225 C PHE A 198 -14.555 -5.008 -4.057 1.00 0.00 C ATOM 1226 O PHE A 198 -14.809 -6.043 -4.684 1.00 0.00 O ATOM 1227 CB PHE A 198 -12.796 -4.631 -2.272 1.00 0.00 C ATOM 1228 CG PHE A 198 -12.258 -4.854 -0.865 1.00 0.00 C ATOM 1229 CD1 PHE A 198 -12.836 -4.226 0.259 1.00 0.00 C ATOM 1230 CD2 PHE A 198 -11.083 -5.613 -0.693 1.00 0.00 C ATOM 1231 CE1 PHE A 198 -12.248 -4.369 1.521 1.00 0.00 C ATOM 1232 CE2 PHE A 198 -10.494 -5.748 0.577 1.00 0.00 C ATOM 1233 CZ PHE A 198 -11.081 -5.132 1.692 1.00 0.00 C ATOM 0 H PHE A 198 -13.866 -7.108 -2.586 1.00 0.00 H new ATOM 0 HA PHE A 198 -14.917 -4.381 -2.046 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -12.143 -5.157 -2.969 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -12.714 -3.568 -2.499 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -13.733 -3.635 0.145 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -10.630 -6.096 -1.546 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -12.698 -3.886 2.376 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -9.589 -6.326 0.694 1.00 0.00 H new ATOM 0 HZ PHE A 198 -10.640 -5.243 2.672 1.00 0.00 H new ATOM 1243 N THR A 199 -14.497 -3.821 -4.654 1.00 0.00 N ATOM 1244 CA THR A 199 -14.678 -3.611 -6.085 1.00 0.00 C ATOM 1245 C THR A 199 -13.429 -2.979 -6.677 1.00 0.00 C ATOM 1246 O THR A 199 -12.564 -2.495 -5.951 1.00 0.00 O ATOM 1247 CB THR A 199 -15.944 -2.776 -6.332 1.00 0.00 C ATOM 1248 OG1 THR A 199 -16.063 -1.662 -5.463 1.00 0.00 O ATOM 1249 CG2 THR A 199 -17.178 -3.663 -6.188 1.00 0.00 C ATOM 0 H THR A 199 -14.318 -2.957 -4.142 1.00 0.00 H new ATOM 0 HA THR A 199 -14.821 -4.566 -6.591 1.00 0.00 H new ATOM 0 HB THR A 199 -15.864 -2.381 -7.345 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.885 -1.171 -5.671 1.00 0.00 H new ATOM 0 HG21 THR A 199 -18.075 -3.069 -6.363 1.00 0.00 H new ATOM 0 HG22 THR A 199 -17.131 -4.473 -6.916 1.00 0.00 H new ATOM 0 HG23 THR A 199 -17.210 -4.081 -5.182 1.00 0.00 H new ATOM 1257 N GLU A 200 -13.359 -2.924 -8.003 1.00 0.00 N ATOM 1258 CA GLU A 200 -12.300 -2.265 -8.735 1.00 0.00 C ATOM 1259 C GLU A 200 -12.208 -0.787 -8.341 1.00 0.00 C ATOM 1260 O GLU A 200 -11.119 -0.240 -8.216 1.00 0.00 O ATOM 1261 CB GLU A 200 -12.634 -2.448 -10.219 1.00 0.00 C ATOM 1262 CG GLU A 200 -11.407 -2.310 -11.118 1.00 0.00 C ATOM 1263 CD GLU A 200 -11.363 -3.299 -12.293 1.00 0.00 C ATOM 1264 OE1 GLU A 200 -12.403 -3.891 -12.662 1.00 0.00 O ATOM 1265 OE2 GLU A 200 -10.281 -3.441 -12.911 1.00 0.00 O ATOM 0 H GLU A 200 -14.060 -3.351 -8.609 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.323 -2.692 -8.510 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.081 -3.431 -10.369 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.380 -1.710 -10.513 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.374 -1.295 -11.513 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -10.511 -2.445 -10.512 1.00 0.00 H new ATOM 1272 N THR A 201 -13.348 -0.158 -8.052 1.00 0.00 N ATOM 1273 CA THR A 201 -13.424 1.189 -7.502 1.00 0.00 C ATOM 1274 C THR A 201 -12.592 1.315 -6.213 1.00 0.00 C ATOM 1275 O THR A 201 -11.978 2.358 -5.965 1.00 0.00 O ATOM 1276 CB THR A 201 -14.916 1.460 -7.240 1.00 0.00 C ATOM 1277 OG1 THR A 201 -15.578 1.823 -8.440 1.00 0.00 O ATOM 1278 CG2 THR A 201 -15.165 2.528 -6.189 1.00 0.00 C ATOM 0 H THR A 201 -14.263 -0.584 -8.199 1.00 0.00 H new ATOM 0 HA THR A 201 -13.010 1.922 -8.195 1.00 0.00 H new ATOM 0 HB THR A 201 -15.320 0.525 -6.852 1.00 0.00 H new ATOM 0 HG1 THR A 201 -16.526 1.990 -8.253 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.238 2.665 -6.057 1.00 0.00 H new ATOM 0 HG22 THR A 201 -14.720 2.219 -5.243 1.00 0.00 H new ATOM 0 HG23 THR A 201 -14.716 3.467 -6.511 1.00 0.00 H new ATOM 1286 N ASP A 202 -12.630 0.284 -5.372 1.00 0.00 N ATOM 1287 CA ASP A 202 -12.074 0.297 -4.031 1.00 0.00 C ATOM 1288 C ASP A 202 -10.604 -0.092 -4.049 1.00 0.00 C ATOM 1289 O ASP A 202 -9.785 0.570 -3.419 1.00 0.00 O ATOM 1290 CB ASP A 202 -12.879 -0.678 -3.181 1.00 0.00 C ATOM 1291 CG ASP A 202 -12.493 -0.586 -1.716 1.00 0.00 C ATOM 1292 OD1 ASP A 202 -13.000 0.336 -1.035 1.00 0.00 O ATOM 1293 OD2 ASP A 202 -11.733 -1.454 -1.245 1.00 0.00 O ATOM 0 H ASP A 202 -13.062 -0.607 -5.617 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.135 1.301 -3.612 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -13.943 -0.468 -3.292 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -12.716 -1.695 -3.538 1.00 0.00 H new ATOM 1298 N ILE A 203 -10.257 -1.084 -4.865 1.00 0.00 N ATOM 1299 CA ILE A 203 -8.886 -1.390 -5.256 1.00 0.00 C ATOM 1300 C ILE A 203 -8.211 -0.121 -5.788 1.00 0.00 C ATOM 1301 O ILE A 203 -7.084 0.179 -5.399 1.00 0.00 O ATOM 1302 CB ILE A 203 -8.925 -2.541 -6.283 1.00 0.00 C ATOM 1303 CG1 ILE A 203 -9.360 -3.874 -5.635 1.00 0.00 C ATOM 1304 CG2 ILE A 203 -7.597 -2.715 -7.030 1.00 0.00 C ATOM 1305 CD1 ILE A 203 -8.313 -4.496 -4.700 1.00 0.00 C ATOM 0 H ILE A 203 -10.942 -1.714 -5.283 1.00 0.00 H new ATOM 0 HA ILE A 203 -8.288 -1.723 -4.408 1.00 0.00 H new ATOM 0 HB ILE A 203 -9.676 -2.257 -7.020 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -10.279 -3.708 -5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -9.594 -4.588 -6.424 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -7.683 -3.539 -7.739 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -7.359 -1.797 -7.567 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -6.803 -2.933 -6.315 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -8.700 -5.428 -4.289 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -7.400 -4.698 -5.260 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -8.095 -3.804 -3.887 1.00 0.00 H new ATOM 1317 N LYS A 204 -8.892 0.659 -6.633 1.00 0.00 N ATOM 1318 CA LYS A 204 -8.355 1.904 -7.185 1.00 0.00 C ATOM 1319 C LYS A 204 -8.034 2.881 -6.065 1.00 0.00 C ATOM 1320 O LYS A 204 -6.941 3.456 -6.039 1.00 0.00 O ATOM 1321 CB LYS A 204 -9.366 2.521 -8.154 1.00 0.00 C ATOM 1322 CG LYS A 204 -9.243 1.959 -9.579 1.00 0.00 C ATOM 1323 CD LYS A 204 -10.415 2.439 -10.447 1.00 0.00 C ATOM 1324 CE LYS A 204 -10.161 3.885 -10.883 1.00 0.00 C ATOM 1325 NZ LYS A 204 -11.370 4.623 -11.295 1.00 0.00 N ATOM 0 H LYS A 204 -9.836 0.442 -6.954 1.00 0.00 H new ATOM 0 HA LYS A 204 -7.435 1.684 -7.726 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -10.375 2.341 -7.783 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -9.224 3.601 -8.181 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -8.300 2.278 -10.022 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -9.228 0.870 -9.547 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -10.522 1.797 -11.321 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -11.348 2.374 -9.887 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -9.687 4.421 -10.061 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -9.453 3.882 -11.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -11.108 5.590 -11.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -11.814 4.139 -12.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -12.041 4.661 -10.501 1.00 0.00 H new ATOM 1339 N MET A 205 -8.991 3.122 -5.167 1.00 0.00 N ATOM 1340 CA MET A 205 -8.768 3.921 -3.971 1.00 0.00 C ATOM 1341 C MET A 205 -7.557 3.430 -3.174 1.00 0.00 C ATOM 1342 O MET A 205 -6.679 4.237 -2.861 1.00 0.00 O ATOM 1343 CB MET A 205 -10.049 3.917 -3.145 1.00 0.00 C ATOM 1344 CG MET A 205 -11.119 4.747 -3.844 1.00 0.00 C ATOM 1345 SD MET A 205 -11.080 6.496 -3.393 1.00 0.00 S ATOM 1346 CE MET A 205 -12.483 7.170 -4.321 1.00 0.00 C ATOM 0 H MET A 205 -9.943 2.766 -5.253 1.00 0.00 H new ATOM 0 HA MET A 205 -8.530 4.946 -4.254 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.401 2.894 -3.009 1.00 0.00 H new ATOM 0 HB3 MET A 205 -9.853 4.322 -2.152 1.00 0.00 H new ATOM 0 HG2 MET A 205 -10.993 4.655 -4.923 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.100 4.339 -3.602 1.00 0.00 H new ATOM 0 HE1 MET A 205 -12.129 7.938 -5.008 1.00 0.00 H new ATOM 0 HE2 MET A 205 -12.963 6.371 -4.886 1.00 0.00 H new ATOM 0 HE3 MET A 205 -13.202 7.607 -3.628 1.00 0.00 H new ATOM 1356 N MET A 206 -7.485 2.131 -2.869 1.00 0.00 N ATOM 1357 CA MET A 206 -6.403 1.553 -2.086 1.00 0.00 C ATOM 1358 C MET A 206 -5.067 1.770 -2.789 1.00 0.00 C ATOM 1359 O MET A 206 -4.140 2.261 -2.159 1.00 0.00 O ATOM 1360 CB MET A 206 -6.651 0.058 -1.824 1.00 0.00 C ATOM 1361 CG MET A 206 -5.696 -0.482 -0.754 1.00 0.00 C ATOM 1362 SD MET A 206 -5.987 -2.146 -0.074 1.00 0.00 S ATOM 1363 CE MET A 206 -6.994 -2.912 -1.365 1.00 0.00 C ATOM 0 H MET A 206 -8.185 1.450 -3.164 1.00 0.00 H new ATOM 0 HA MET A 206 -6.369 2.057 -1.120 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.682 -0.092 -1.504 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.520 -0.503 -2.749 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.690 -0.469 -1.173 1.00 0.00 H new ATOM 0 HG3 MET A 206 -5.704 0.221 0.079 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.138 -3.968 -1.136 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.963 -2.416 -1.413 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.489 -2.815 -2.326 1.00 0.00 H new ATOM 1373 N GLU A 207 -4.941 1.445 -4.076 1.00 0.00 N ATOM 1374 CA GLU A 207 -3.678 1.561 -4.801 1.00 0.00 C ATOM 1375 C GLU A 207 -3.063 2.947 -4.660 1.00 0.00 C ATOM 1376 O GLU A 207 -1.848 3.065 -4.526 1.00 0.00 O ATOM 1377 CB GLU A 207 -3.874 1.289 -6.291 1.00 0.00 C ATOM 1378 CG GLU A 207 -3.883 -0.193 -6.649 1.00 0.00 C ATOM 1379 CD GLU A 207 -3.589 -0.333 -8.143 1.00 0.00 C ATOM 1380 OE1 GLU A 207 -4.384 0.207 -8.950 1.00 0.00 O ATOM 1381 OE2 GLU A 207 -2.572 -0.940 -8.543 1.00 0.00 O ATOM 0 H GLU A 207 -5.712 1.094 -4.644 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.010 0.820 -4.362 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -4.815 1.737 -6.612 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -3.079 1.783 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -3.135 -0.729 -6.064 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -4.851 -0.634 -6.410 1.00 0.00 H new ATOM 1388 N ARG A 208 -3.883 3.999 -4.669 1.00 0.00 N ATOM 1389 CA ARG A 208 -3.430 5.360 -4.548 1.00 0.00 C ATOM 1390 C ARG A 208 -2.702 5.578 -3.232 1.00 0.00 C ATOM 1391 O ARG A 208 -1.601 6.125 -3.233 1.00 0.00 O ATOM 1392 CB ARG A 208 -4.659 6.266 -4.665 1.00 0.00 C ATOM 1393 CG ARG A 208 -4.275 7.539 -5.405 1.00 0.00 C ATOM 1394 CD ARG A 208 -4.034 7.276 -6.901 1.00 0.00 C ATOM 1395 NE ARG A 208 -2.633 7.537 -7.273 1.00 0.00 N ATOM 1396 CZ ARG A 208 -2.073 7.360 -8.470 1.00 0.00 C ATOM 1397 NH1 ARG A 208 -2.790 6.892 -9.487 1.00 0.00 N ATOM 1398 NH2 ARG A 208 -0.791 7.644 -8.631 1.00 0.00 N ATOM 0 H ARG A 208 -4.895 3.914 -4.763 1.00 0.00 H new ATOM 0 HA ARG A 208 -2.716 5.595 -5.337 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -5.457 5.749 -5.197 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.042 6.509 -3.674 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -5.066 8.280 -5.288 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -3.374 7.961 -4.960 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -4.288 6.242 -7.136 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -4.694 7.909 -7.494 1.00 0.00 H new ATOM 0 HE ARG A 208 -2.025 7.892 -6.535 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -3.776 6.666 -9.355 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -2.354 6.759 -10.400 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -0.243 7.994 -7.845 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -0.350 7.513 -9.541 1.00 0.00 H new ATOM 1412 N VAL A 209 -3.303 5.165 -2.114 1.00 0.00 N ATOM 1413 CA VAL A 209 -2.633 5.291 -0.833 1.00 0.00 C ATOM 1414 C VAL A 209 -1.414 4.387 -0.805 1.00 0.00 C ATOM 1415 O VAL A 209 -0.351 4.807 -0.355 1.00 0.00 O ATOM 1416 CB VAL A 209 -3.611 5.041 0.330 1.00 0.00 C ATOM 1417 CG1 VAL A 209 -3.794 3.612 0.850 1.00 0.00 C ATOM 1418 CG2 VAL A 209 -3.123 5.816 1.548 1.00 0.00 C ATOM 0 H VAL A 209 -4.234 4.749 -2.076 1.00 0.00 H new ATOM 0 HA VAL A 209 -2.278 6.313 -0.701 1.00 0.00 H new ATOM 0 HB VAL A 209 -4.564 5.340 -0.107 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -4.515 3.612 1.667 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.159 2.975 0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -2.838 3.230 1.209 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -3.805 5.650 2.382 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -2.125 5.473 1.821 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -3.089 6.880 1.313 1.00 0.00 H new ATOM 1428 N VAL A 210 -1.575 3.152 -1.275 1.00 0.00 N ATOM 1429 CA VAL A 210 -0.559 2.128 -1.149 1.00 0.00 C ATOM 1430 C VAL A 210 0.685 2.560 -1.928 1.00 0.00 C ATOM 1431 O VAL A 210 1.776 2.380 -1.408 1.00 0.00 O ATOM 1432 CB VAL A 210 -1.140 0.747 -1.519 1.00 0.00 C ATOM 1433 CG1 VAL A 210 -0.074 -0.342 -1.461 1.00 0.00 C ATOM 1434 CG2 VAL A 210 -2.198 0.300 -0.490 1.00 0.00 C ATOM 0 H VAL A 210 -2.419 2.839 -1.754 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.231 2.011 -0.116 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.553 0.863 -2.521 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -0.519 -1.301 -1.727 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.726 -0.106 -2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.333 -0.399 -0.452 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -2.592 -0.676 -0.774 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.740 0.234 0.497 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -3.011 1.026 -0.465 1.00 0.00 H new ATOM 1444 N GLU A 211 0.553 3.217 -3.084 1.00 0.00 N ATOM 1445 CA GLU A 211 1.669 3.812 -3.812 1.00 0.00 C ATOM 1446 C GLU A 211 2.464 4.738 -2.891 1.00 0.00 C ATOM 1447 O GLU A 211 3.682 4.602 -2.785 1.00 0.00 O ATOM 1448 CB GLU A 211 1.150 4.566 -5.054 1.00 0.00 C ATOM 1449 CG GLU A 211 2.233 5.438 -5.712 1.00 0.00 C ATOM 1450 CD GLU A 211 1.725 6.182 -6.943 1.00 0.00 C ATOM 1451 OE1 GLU A 211 1.224 7.321 -6.794 1.00 0.00 O ATOM 1452 OE2 GLU A 211 1.880 5.656 -8.069 1.00 0.00 O ATOM 0 H GLU A 211 -0.347 3.350 -3.544 1.00 0.00 H new ATOM 0 HA GLU A 211 2.338 3.022 -4.153 1.00 0.00 H new ATOM 0 HB2 GLU A 211 0.777 3.846 -5.782 1.00 0.00 H new ATOM 0 HB3 GLU A 211 0.307 5.195 -4.767 1.00 0.00 H new ATOM 0 HG2 GLU A 211 2.604 6.160 -4.984 1.00 0.00 H new ATOM 0 HG3 GLU A 211 3.077 4.809 -5.996 1.00 0.00 H new ATOM 1459 N GLN A 212 1.785 5.692 -2.250 1.00 0.00 N ATOM 1460 CA GLN A 212 2.437 6.730 -1.466 1.00 0.00 C ATOM 1461 C GLN A 212 3.163 6.080 -0.277 1.00 0.00 C ATOM 1462 O GLN A 212 4.343 6.340 -0.049 1.00 0.00 O ATOM 1463 CB GLN A 212 1.396 7.768 -1.011 1.00 0.00 C ATOM 1464 CG GLN A 212 0.595 8.478 -2.093 1.00 0.00 C ATOM 1465 CD GLN A 212 1.356 9.634 -2.678 1.00 0.00 C ATOM 1466 OE1 GLN A 212 1.534 10.681 -2.054 1.00 0.00 O ATOM 1467 NE2 GLN A 212 1.804 9.486 -3.900 1.00 0.00 N ATOM 0 H GLN A 212 0.767 5.762 -2.263 1.00 0.00 H new ATOM 0 HA GLN A 212 3.178 7.255 -2.069 1.00 0.00 H new ATOM 0 HB2 GLN A 212 0.693 7.270 -0.344 1.00 0.00 H new ATOM 0 HB3 GLN A 212 1.912 8.526 -0.422 1.00 0.00 H new ATOM 0 HG2 GLN A 212 0.343 7.771 -2.883 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -0.346 8.836 -1.674 1.00 0.00 H new ATOM 0 HE21 GLN A 212 1.646 8.610 -4.399 1.00 0.00 H new ATOM 0 HE22 GLN A 212 2.311 10.246 -4.353 1.00 0.00 H new ATOM 1476 N MET A 213 2.479 5.192 0.451 1.00 0.00 N ATOM 1477 CA MET A 213 3.010 4.449 1.584 1.00 0.00 C ATOM 1478 C MET A 213 4.194 3.568 1.184 1.00 0.00 C ATOM 1479 O MET A 213 5.209 3.589 1.881 1.00 0.00 O ATOM 1480 CB MET A 213 1.875 3.598 2.188 1.00 0.00 C ATOM 1481 CG MET A 213 0.730 4.468 2.737 1.00 0.00 C ATOM 1482 SD MET A 213 -0.467 3.706 3.871 1.00 0.00 S ATOM 1483 CE MET A 213 -0.596 2.018 3.229 1.00 0.00 C ATOM 0 H MET A 213 1.504 4.967 0.255 1.00 0.00 H new ATOM 0 HA MET A 213 3.384 5.155 2.326 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.484 2.923 1.427 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.275 2.977 2.990 1.00 0.00 H new ATOM 0 HG2 MET A 213 1.177 5.320 3.249 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.176 4.863 1.886 1.00 0.00 H new ATOM 0 HE1 MET A 213 -1.554 1.589 3.524 1.00 0.00 H new ATOM 0 HE2 MET A 213 -0.526 2.036 2.141 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.214 1.412 3.635 1.00 0.00 H new ATOM 1493 N CYS A 214 4.093 2.835 0.071 1.00 0.00 N ATOM 1494 CA CYS A 214 5.175 2.050 -0.510 1.00 0.00 C ATOM 1495 C CYS A 214 6.388 2.961 -0.717 1.00 0.00 C ATOM 1496 O CYS A 214 7.474 2.650 -0.237 1.00 0.00 O ATOM 1497 CB CYS A 214 4.723 1.388 -1.831 1.00 0.00 C ATOM 1498 SG CYS A 214 3.660 -0.087 -1.696 1.00 0.00 S ATOM 0 H CYS A 214 3.227 2.773 -0.464 1.00 0.00 H new ATOM 0 HA CYS A 214 5.453 1.242 0.167 1.00 0.00 H new ATOM 0 HB2 CYS A 214 4.192 2.136 -2.420 1.00 0.00 H new ATOM 0 HB3 CYS A 214 5.615 1.113 -2.394 1.00 0.00 H new ATOM 1503 N ILE A 215 6.221 4.099 -1.395 1.00 0.00 N ATOM 1504 CA ILE A 215 7.311 5.040 -1.650 1.00 0.00 C ATOM 1505 C ILE A 215 7.916 5.516 -0.320 1.00 0.00 C ATOM 1506 O ILE A 215 9.138 5.547 -0.193 1.00 0.00 O ATOM 1507 CB ILE A 215 6.828 6.187 -2.574 1.00 0.00 C ATOM 1508 CG1 ILE A 215 6.518 5.632 -3.983 1.00 0.00 C ATOM 1509 CG2 ILE A 215 7.890 7.293 -2.698 1.00 0.00 C ATOM 1510 CD1 ILE A 215 5.714 6.584 -4.876 1.00 0.00 C ATOM 0 H ILE A 215 5.325 4.393 -1.783 1.00 0.00 H new ATOM 0 HA ILE A 215 8.118 4.545 -2.190 1.00 0.00 H new ATOM 0 HB ILE A 215 5.929 6.613 -2.130 1.00 0.00 H new ATOM 0 HG12 ILE A 215 7.458 5.393 -4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 215 5.966 4.698 -3.879 1.00 0.00 H new ATOM 0 HG21 ILE A 215 7.519 8.082 -3.353 1.00 0.00 H new ATOM 0 HG22 ILE A 215 8.100 7.708 -1.712 1.00 0.00 H new ATOM 0 HG23 ILE A 215 8.805 6.874 -3.117 1.00 0.00 H new ATOM 0 HD11 ILE A 215 5.541 6.115 -5.845 1.00 0.00 H new ATOM 0 HD12 ILE A 215 4.757 6.804 -4.404 1.00 0.00 H new ATOM 0 HD13 ILE A 215 6.272 7.510 -5.015 1.00 0.00 H new ATOM 1522 N THR A 216 7.104 5.878 0.674 1.00 0.00 N ATOM 1523 CA THR A 216 7.592 6.366 1.959 1.00 0.00 C ATOM 1524 C THR A 216 8.328 5.281 2.762 1.00 0.00 C ATOM 1525 O THR A 216 9.303 5.618 3.433 1.00 0.00 O ATOM 1526 CB THR A 216 6.406 6.991 2.719 1.00 0.00 C ATOM 1527 OG1 THR A 216 5.992 8.153 2.019 1.00 0.00 O ATOM 1528 CG2 THR A 216 6.762 7.455 4.134 1.00 0.00 C ATOM 0 H THR A 216 6.087 5.840 0.608 1.00 0.00 H new ATOM 0 HA THR A 216 8.348 7.134 1.796 1.00 0.00 H new ATOM 0 HB THR A 216 5.640 6.218 2.786 1.00 0.00 H new ATOM 0 HG1 THR A 216 5.398 7.897 1.282 1.00 0.00 H new ATOM 0 HG21 THR A 216 5.880 7.884 4.609 1.00 0.00 H new ATOM 0 HG22 THR A 216 7.111 6.604 4.719 1.00 0.00 H new ATOM 0 HG23 THR A 216 7.549 8.208 4.083 1.00 0.00 H new ATOM 1536 N GLN A 217 7.929 4.005 2.711 1.00 0.00 N ATOM 1537 CA GLN A 217 8.730 2.951 3.339 1.00 0.00 C ATOM 1538 C GLN A 217 10.017 2.736 2.545 1.00 0.00 C ATOM 1539 O GLN A 217 11.093 2.643 3.131 1.00 0.00 O ATOM 1540 CB GLN A 217 7.953 1.629 3.462 1.00 0.00 C ATOM 1541 CG GLN A 217 7.763 1.207 4.924 1.00 0.00 C ATOM 1542 CD GLN A 217 9.068 1.053 5.723 1.00 0.00 C ATOM 1543 OE1 GLN A 217 9.151 1.540 6.846 1.00 0.00 O ATOM 1544 NE2 GLN A 217 10.099 0.383 5.226 1.00 0.00 N ATOM 0 H GLN A 217 7.077 3.683 2.253 1.00 0.00 H new ATOM 0 HA GLN A 217 8.973 3.278 4.350 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.978 1.736 2.986 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.486 0.844 2.925 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.133 1.944 5.422 1.00 0.00 H new ATOM 0 HG3 GLN A 217 7.225 0.260 4.947 1.00 0.00 H new ATOM 0 HE21 GLN A 217 10.040 -0.026 4.293 1.00 0.00 H new ATOM 0 HE22 GLN A 217 10.951 0.276 5.776 1.00 0.00 H new ATOM 1553 N TYR A 218 9.911 2.663 1.219 1.00 0.00 N ATOM 1554 CA TYR A 218 11.045 2.416 0.356 1.00 0.00 C ATOM 1555 C TYR A 218 12.106 3.477 0.536 1.00 0.00 C ATOM 1556 O TYR A 218 13.255 3.103 0.693 1.00 0.00 O ATOM 1557 CB TYR A 218 10.577 2.280 -1.081 1.00 0.00 C ATOM 1558 CG TYR A 218 11.662 2.166 -2.136 1.00 0.00 C ATOM 1559 CD1 TYR A 218 12.235 3.333 -2.678 1.00 0.00 C ATOM 1560 CD2 TYR A 218 12.055 0.905 -2.624 1.00 0.00 C ATOM 1561 CE1 TYR A 218 13.191 3.239 -3.702 1.00 0.00 C ATOM 1562 CE2 TYR A 218 12.988 0.807 -3.673 1.00 0.00 C ATOM 1563 CZ TYR A 218 13.560 1.978 -4.220 1.00 0.00 C ATOM 1564 OH TYR A 218 14.424 1.892 -5.269 1.00 0.00 O ATOM 0 H TYR A 218 9.029 2.775 0.720 1.00 0.00 H new ATOM 0 HA TYR A 218 11.515 1.473 0.634 1.00 0.00 H new ATOM 0 HB2 TYR A 218 9.939 1.399 -1.151 1.00 0.00 H new ATOM 0 HB3 TYR A 218 9.956 3.143 -1.321 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.938 4.302 -2.305 1.00 0.00 H new ATOM 0 HD2 TYR A 218 11.638 0.008 -2.191 1.00 0.00 H new ATOM 0 HE1 TYR A 218 13.647 4.136 -4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 218 13.267 -0.162 -4.060 1.00 0.00 H new ATOM 0 HH TYR A 218 14.569 0.950 -5.497 1.00 0.00 H new ATOM 1574 N GLN A 219 11.757 4.766 0.605 1.00 0.00 N ATOM 1575 CA GLN A 219 12.665 5.855 0.924 1.00 0.00 C ATOM 1576 C GLN A 219 13.597 5.537 2.084 1.00 0.00 C ATOM 1577 O GLN A 219 14.784 5.852 2.013 1.00 0.00 O ATOM 1578 CB GLN A 219 11.811 7.064 1.309 1.00 0.00 C ATOM 1579 CG GLN A 219 11.490 7.909 0.086 1.00 0.00 C ATOM 1580 CD GLN A 219 10.574 9.076 0.413 1.00 0.00 C ATOM 1581 OE1 GLN A 219 10.343 9.439 1.562 1.00 0.00 O ATOM 1582 NE2 GLN A 219 10.047 9.690 -0.625 1.00 0.00 N ATOM 0 H GLN A 219 10.803 5.082 0.434 1.00 0.00 H new ATOM 0 HA GLN A 219 13.292 6.039 0.051 1.00 0.00 H new ATOM 0 HB2 GLN A 219 10.886 6.727 1.777 1.00 0.00 H new ATOM 0 HB3 GLN A 219 12.340 7.669 2.046 1.00 0.00 H new ATOM 0 HG2 GLN A 219 12.417 8.288 -0.344 1.00 0.00 H new ATOM 0 HG3 GLN A 219 11.020 7.283 -0.672 1.00 0.00 H new ATOM 0 HE21 GLN A 219 10.257 9.367 -1.569 1.00 0.00 H new ATOM 0 HE22 GLN A 219 9.429 10.489 -0.485 1.00 0.00 H new ATOM 1591 N ARG A 220 13.052 4.937 3.142 1.00 0.00 N ATOM 1592 CA ARG A 220 13.818 4.597 4.339 1.00 0.00 C ATOM 1593 C ARG A 220 14.938 3.640 3.961 1.00 0.00 C ATOM 1594 O ARG A 220 16.112 3.932 4.175 1.00 0.00 O ATOM 1595 CB ARG A 220 12.944 4.002 5.459 1.00 0.00 C ATOM 1596 CG ARG A 220 11.592 4.705 5.690 1.00 0.00 C ATOM 1597 CD ARG A 220 11.673 6.235 5.645 1.00 0.00 C ATOM 1598 NE ARG A 220 10.665 6.892 6.491 1.00 0.00 N ATOM 1599 CZ ARG A 220 10.923 7.769 7.470 1.00 0.00 C ATOM 1600 NH1 ARG A 220 12.169 8.047 7.843 1.00 0.00 N ATOM 1601 NH2 ARG A 220 9.920 8.361 8.105 1.00 0.00 N ATOM 0 H ARG A 220 12.068 4.674 3.193 1.00 0.00 H new ATOM 0 HA ARG A 220 14.237 5.520 4.740 1.00 0.00 H new ATOM 0 HB2 ARG A 220 12.754 2.954 5.229 1.00 0.00 H new ATOM 0 HB3 ARG A 220 13.510 4.027 6.390 1.00 0.00 H new ATOM 0 HG2 ARG A 220 10.883 4.366 4.934 1.00 0.00 H new ATOM 0 HG3 ARG A 220 11.196 4.400 6.658 1.00 0.00 H new ATOM 0 HD2 ARG A 220 12.667 6.550 5.964 1.00 0.00 H new ATOM 0 HD3 ARG A 220 11.548 6.569 4.615 1.00 0.00 H new ATOM 0 HE ARG A 220 9.687 6.660 6.318 1.00 0.00 H new ATOM 0 HH11 ARG A 220 12.954 7.588 7.381 1.00 0.00 H new ATOM 0 HH12 ARG A 220 12.339 8.719 8.591 1.00 0.00 H new ATOM 0 HH21 ARG A 220 8.956 8.148 7.847 1.00 0.00 H new ATOM 0 HH22 ARG A 220 10.112 9.029 8.851 1.00 0.00 H new ATOM 1615 N GLU A 221 14.579 2.516 3.347 1.00 0.00 N ATOM 1616 CA GLU A 221 15.559 1.510 2.987 1.00 0.00 C ATOM 1617 C GLU A 221 16.477 1.983 1.857 1.00 0.00 C ATOM 1618 O GLU A 221 17.643 1.615 1.809 1.00 0.00 O ATOM 1619 CB GLU A 221 14.872 0.255 2.485 1.00 0.00 C ATOM 1620 CG GLU A 221 14.171 -0.578 3.552 1.00 0.00 C ATOM 1621 CD GLU A 221 14.367 -2.060 3.206 1.00 0.00 C ATOM 1622 OE1 GLU A 221 13.597 -2.556 2.348 1.00 0.00 O ATOM 1623 OE2 GLU A 221 15.376 -2.657 3.650 1.00 0.00 O ATOM 0 H GLU A 221 13.619 2.284 3.091 1.00 0.00 H new ATOM 0 HA GLU A 221 16.140 1.318 3.889 1.00 0.00 H new ATOM 0 HB2 GLU A 221 14.139 0.540 1.731 1.00 0.00 H new ATOM 0 HB3 GLU A 221 15.614 -0.371 1.989 1.00 0.00 H new ATOM 0 HG2 GLU A 221 14.583 -0.360 4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 221 13.110 -0.333 3.589 1.00 0.00 H new ATOM 1630 N SER A 222 15.938 2.774 0.934 1.00 0.00 N ATOM 1631 CA SER A 222 16.628 3.397 -0.199 1.00 0.00 C ATOM 1632 C SER A 222 17.808 4.210 0.336 1.00 0.00 C ATOM 1633 O SER A 222 18.857 4.305 -0.307 1.00 0.00 O ATOM 1634 CB SER A 222 15.651 4.304 -0.986 1.00 0.00 C ATOM 1635 OG SER A 222 16.026 4.542 -2.336 1.00 0.00 O ATOM 0 H SER A 222 14.947 3.014 0.955 1.00 0.00 H new ATOM 0 HA SER A 222 16.994 2.629 -0.880 1.00 0.00 H new ATOM 0 HB2 SER A 222 14.661 3.848 -0.972 1.00 0.00 H new ATOM 0 HB3 SER A 222 15.569 5.261 -0.471 1.00 0.00 H new ATOM 0 HG SER A 222 15.310 4.240 -2.933 1.00 0.00 H new ATOM 1641 N GLU A 223 17.644 4.809 1.515 1.00 0.00 N ATOM 1642 CA GLU A 223 18.711 5.475 2.233 1.00 0.00 C ATOM 1643 C GLU A 223 19.574 4.418 2.900 1.00 0.00 C ATOM 1644 O GLU A 223 20.768 4.407 2.638 1.00 0.00 O ATOM 1645 CB GLU A 223 18.163 6.512 3.203 1.00 0.00 C ATOM 1646 CG GLU A 223 17.490 7.622 2.376 1.00 0.00 C ATOM 1647 CD GLU A 223 18.216 8.961 2.279 1.00 0.00 C ATOM 1648 OE1 GLU A 223 19.436 9.053 2.552 1.00 0.00 O ATOM 1649 OE2 GLU A 223 17.545 9.950 1.888 1.00 0.00 O ATOM 0 H GLU A 223 16.747 4.841 2.000 1.00 0.00 H new ATOM 0 HA GLU A 223 19.339 6.039 1.543 1.00 0.00 H new ATOM 0 HB2 GLU A 223 17.445 6.055 3.885 1.00 0.00 H new ATOM 0 HB3 GLU A 223 18.966 6.925 3.814 1.00 0.00 H new ATOM 0 HG2 GLU A 223 17.341 7.245 1.364 1.00 0.00 H new ATOM 0 HG3 GLU A 223 16.501 7.804 2.797 1.00 0.00 H new ATOM 1656 N ALA A 224 18.997 3.500 3.684 1.00 0.00 N ATOM 1657 CA ALA A 224 19.715 2.471 4.439 1.00 0.00 C ATOM 1658 C ALA A 224 20.559 1.501 3.582 1.00 0.00 C ATOM 1659 O ALA A 224 21.383 0.760 4.123 1.00 0.00 O ATOM 1660 CB ALA A 224 18.720 1.695 5.304 1.00 0.00 C ATOM 0 H ALA A 224 17.986 3.453 3.813 1.00 0.00 H new ATOM 0 HA ALA A 224 20.442 2.999 5.056 1.00 0.00 H new ATOM 0 HB1 ALA A 224 19.250 0.927 5.868 1.00 0.00 H new ATOM 0 HB2 ALA A 224 18.228 2.379 5.995 1.00 0.00 H new ATOM 0 HB3 ALA A 224 17.972 1.225 4.665 1.00 0.00 H new ATOM 1666 N TYR A 225 20.372 1.479 2.264 1.00 0.00 N ATOM 1667 CA TYR A 225 21.166 0.752 1.273 1.00 0.00 C ATOM 1668 C TYR A 225 22.486 1.477 0.955 1.00 0.00 C ATOM 1669 O TYR A 225 23.455 0.851 0.528 1.00 0.00 O ATOM 1670 CB TYR A 225 20.292 0.586 0.009 1.00 0.00 C ATOM 1671 CG TYR A 225 20.983 0.783 -1.327 1.00 0.00 C ATOM 1672 CD1 TYR A 225 21.102 2.083 -1.847 1.00 0.00 C ATOM 1673 CD2 TYR A 225 21.485 -0.305 -2.061 1.00 0.00 C ATOM 1674 CE1 TYR A 225 21.750 2.305 -3.071 1.00 0.00 C ATOM 1675 CE2 TYR A 225 22.108 -0.095 -3.305 1.00 0.00 C ATOM 1676 CZ TYR A 225 22.260 1.215 -3.808 1.00 0.00 C ATOM 1677 OH TYR A 225 22.901 1.424 -4.987 1.00 0.00 O ATOM 0 H TYR A 225 19.612 2.003 1.830 1.00 0.00 H new ATOM 0 HA TYR A 225 21.450 -0.224 1.667 1.00 0.00 H new ATOM 0 HB2 TYR A 225 19.859 -0.414 0.024 1.00 0.00 H new ATOM 0 HB3 TYR A 225 19.465 1.293 0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 225 20.691 2.918 -1.300 1.00 0.00 H new ATOM 0 HD2 TYR A 225 21.392 -1.307 -1.669 1.00 0.00 H new ATOM 0 HE1 TYR A 225 21.859 3.311 -3.450 1.00 0.00 H new ATOM 0 HE2 TYR A 225 22.470 -0.937 -3.876 1.00 0.00 H new ATOM 0 HH TYR A 225 23.188 0.564 -5.360 1.00 0.00 H new ATOM 1687 N TYR A 226 22.511 2.797 1.138 1.00 0.00 N ATOM 1688 CA TYR A 226 23.539 3.710 0.662 1.00 0.00 C ATOM 1689 C TYR A 226 24.216 4.389 1.846 1.00 0.00 C ATOM 1690 O TYR A 226 25.421 4.251 2.010 1.00 0.00 O ATOM 1691 CB TYR A 226 22.866 4.772 -0.208 1.00 0.00 C ATOM 1692 CG TYR A 226 23.826 5.805 -0.769 1.00 0.00 C ATOM 1693 CD1 TYR A 226 24.115 6.963 -0.027 1.00 0.00 C ATOM 1694 CD2 TYR A 226 24.458 5.604 -2.011 1.00 0.00 C ATOM 1695 CE1 TYR A 226 25.037 7.903 -0.503 1.00 0.00 C ATOM 1696 CE2 TYR A 226 25.370 6.557 -2.507 1.00 0.00 C ATOM 1697 CZ TYR A 226 25.667 7.714 -1.751 1.00 0.00 C ATOM 1698 OH TYR A 226 26.511 8.669 -2.228 1.00 0.00 O ATOM 0 H TYR A 226 21.773 3.280 1.650 1.00 0.00 H new ATOM 0 HA TYR A 226 24.289 3.163 0.091 1.00 0.00 H new ATOM 0 HB2 TYR A 226 22.354 4.280 -1.035 1.00 0.00 H new ATOM 0 HB3 TYR A 226 22.104 5.281 0.382 1.00 0.00 H new ATOM 0 HD1 TYR A 226 23.621 7.129 0.919 1.00 0.00 H new ATOM 0 HD2 TYR A 226 24.243 4.716 -2.586 1.00 0.00 H new ATOM 0 HE1 TYR A 226 25.267 8.777 0.088 1.00 0.00 H new ATOM 0 HE2 TYR A 226 25.843 6.403 -3.466 1.00 0.00 H new ATOM 0 HH TYR A 226 26.864 8.388 -3.098 1.00 0.00 H new