ATOM 37 N PRO A 4 0.484 5.522 -5.296 1.00 64.42 N ATOM 38 CA PRO A 4 -0.306 6.598 -4.691 1.00 31.41 C ATOM 39 C PRO A 4 -1.652 6.105 -4.170 1.00 0.42 C ATOM 40 O PRO A 4 -2.165 6.610 -3.171 1.00 4.31 O ATOM 41 CB PRO A 4 -0.507 7.582 -5.845 1.00 54.44 C ATOM 42 CG PRO A 4 -0.396 6.751 -7.076 1.00 71.24 C ATOM 43 CD PRO A 4 0.598 5.669 -6.757 1.00 2.00 C ATOM 44 HA PRO A 4 0.233 7.084 -3.891 1.00 35.43 H ATOM 45 HB2 PRO A 4 -1.483 8.041 -5.764 1.00 42.34 H ATOM 46 HB3 PRO A 4 0.258 8.343 -5.812 1.00 63.23 H ATOM 47 HG2 PRO A 4 -1.356 6.319 -7.316 1.00 41.20 H ATOM 48 HG3 PRO A 4 -0.040 7.356 -7.897 1.00 10.21 H ATOM 49 HD2 PRO A 4 0.331 4.751 -7.259 1.00 65.02 H ATOM 50 HD3 PRO A 4 1.595 5.978 -7.036 1.00 52.20 H ATOM 51 N VAL A 5 -2.220 5.116 -4.853 1.00 0.34 N ATOM 52 CA VAL A 5 -3.506 4.555 -4.457 1.00 71.53 C ATOM 53 C VAL A 5 -3.465 4.045 -3.021 1.00 71.21 C ATOM 54 O VAL A 5 -2.435 4.127 -2.351 1.00 71.34 O ATOM 55 CB VAL A 5 -3.925 3.401 -5.388 1.00 65.11 C ATOM 56 CG1 VAL A 5 -3.933 3.861 -6.838 1.00 35.10 C ATOM 57 CG2 VAL A 5 -3.000 2.207 -5.205 1.00 31.23 C ATOM 58 H VAL A 5 -1.763 4.755 -5.640 1.00 44.24 H ATOM 59 HA VAL A 5 -4.249 5.336 -4.531 1.00 25.12 H ATOM 60 HB VAL A 5 -4.927 3.097 -5.124 1.00 1.52 H ATOM 61 HG11 VAL A 5 -4.649 3.276 -7.396 1.00 73.45 H ATOM 62 HG12 VAL A 5 -4.207 4.905 -6.883 1.00 64.01 H ATOM 63 HG13 VAL A 5 -2.950 3.727 -7.264 1.00 21.01 H ATOM 64 HG21 VAL A 5 -2.156 2.496 -4.597 1.00 10.13 H ATOM 65 HG22 VAL A 5 -3.538 1.406 -4.717 1.00 5.53 H ATOM 66 HG23 VAL A 5 -2.651 1.870 -6.169 1.00 71.42 H ATOM 67 N TYR A 6 -4.591 3.518 -2.554 1.00 14.11 N ATOM 68 CA TYR A 6 -4.685 2.996 -1.196 1.00 14.23 C ATOM 69 C TYR A 6 -3.574 1.988 -0.921 1.00 62.25 C ATOM 70 O TYR A 6 -3.334 1.078 -1.716 1.00 24.11 O ATOM 71 CB TYR A 6 -6.050 2.342 -0.972 1.00 24.43 C ATOM 72 CG TYR A 6 -7.214 3.208 -1.397 1.00 22.41 C ATOM 73 CD1 TYR A 6 -7.696 4.213 -0.568 1.00 11.10 C ATOM 74 CD2 TYR A 6 -7.832 3.020 -2.627 1.00 32.12 C ATOM 75 CE1 TYR A 6 -8.760 5.006 -0.952 1.00 10.41 C ATOM 76 CE2 TYR A 6 -8.896 3.809 -3.020 1.00 4.34 C ATOM 77 CZ TYR A 6 -9.356 4.801 -2.179 1.00 20.13 C ATOM 78 OH TYR A 6 -10.416 5.588 -2.566 1.00 0.53 O ATOM 79 H TYR A 6 -5.379 3.481 -3.135 1.00 73.34 H ATOM 80 HA TYR A 6 -4.579 3.827 -0.513 1.00 71.42 H ATOM 81 HB2 TYR A 6 -6.097 1.423 -1.535 1.00 74.23 H ATOM 82 HB3 TYR A 6 -6.167 2.120 0.079 1.00 2.31 H ATOM 83 HD1 TYR A 6 -7.227 4.372 0.392 1.00 32.34 H ATOM 84 HD2 TYR A 6 -7.469 2.242 -3.283 1.00 32.21 H ATOM 85 HE1 TYR A 6 -9.121 5.783 -0.294 1.00 2.21 H ATOM 86 HE2 TYR A 6 -9.363 3.648 -3.980 1.00 3.21 H ATOM 87 HH TYR A 6 -10.530 5.526 -3.517 1.00 34.11 H ATOM 88 N THR A 7 -2.897 2.156 0.211 1.00 74.23 N ATOM 89 CA THR A 7 -1.811 1.262 0.592 1.00 42.34 C ATOM 90 C THR A 7 -2.344 0.008 1.275 1.00 10.40 C ATOM 91 O THR A 7 -3.129 0.090 2.220 1.00 54.10 O ATOM 92 CB THR A 7 -0.813 1.962 1.534 1.00 64.55 C ATOM 93 OG1 THR A 7 -1.401 2.138 2.827 1.00 1.20 O ATOM 94 CG2 THR A 7 -0.394 3.312 0.972 1.00 11.14 C ATOM 95 H THR A 7 -3.136 2.899 0.803 1.00 43.54 H ATOM 96 HA THR A 7 -1.285 0.975 -0.307 1.00 62.22 H ATOM 97 HB THR A 7 0.066 1.340 1.628 1.00 61.51 H ATOM 98 HG1 THR A 7 -1.873 2.974 2.852 1.00 31.05 H ATOM 99 HG21 THR A 7 0.527 3.627 1.441 1.00 73.03 H ATOM 100 HG22 THR A 7 -1.167 4.040 1.172 1.00 62.44 H ATOM 101 HG23 THR A 7 -0.245 3.228 -0.093 1.00 62.14 H ATOM 102 N CYS A 8 -1.912 -1.152 0.792 1.00 13.13 N ATOM 103 CA CYS A 8 -2.346 -2.424 1.357 1.00 62.34 C ATOM 104 C CYS A 8 -1.207 -3.099 2.116 1.00 11.44 C ATOM 105 O CYS A 8 -0.045 -2.715 1.982 1.00 21.21 O ATOM 106 CB CYS A 8 -2.854 -3.350 0.250 1.00 63.43 C ATOM 107 SG CYS A 8 -4.148 -4.513 0.789 1.00 71.41 S ATOM 108 H CYS A 8 -1.286 -1.153 0.037 1.00 14.20 H ATOM 109 HA CYS A 8 -3.153 -2.224 2.045 1.00 23.51 H ATOM 110 HB2 CYS A 8 -3.264 -2.751 -0.550 1.00 71.32 H ATOM 111 HB3 CYS A 8 -2.027 -3.931 -0.131 1.00 24.43 H ATOM 112 N ARG A 9 -1.550 -4.105 2.914 1.00 4.21 N ATOM 113 CA ARG A 9 -0.557 -4.832 3.696 1.00 0.00 C ATOM 114 C ARG A 9 0.587 -5.314 2.809 1.00 43.10 C ATOM 115 O ARG A 9 0.462 -5.406 1.588 1.00 70.34 O ATOM 116 CB ARG A 9 -1.206 -6.024 4.402 1.00 41.10 C ATOM 117 CG ARG A 9 -1.791 -5.681 5.762 1.00 23.45 C ATOM 118 CD ARG A 9 -2.004 -6.928 6.607 1.00 52.11 C ATOM 119 NE ARG A 9 -3.169 -7.693 6.169 1.00 3.21 N ATOM 120 CZ ARG A 9 -3.731 -8.654 6.893 1.00 62.52 C ATOM 121 NH1 ARG A 9 -3.238 -8.967 8.083 1.00 1.13 N ATOM 122 NH2 ARG A 9 -4.789 -9.306 6.426 1.00 3.51 N ATOM 123 H ARG A 9 -2.493 -4.364 2.979 1.00 24.12 H ATOM 124 HA ARG A 9 -0.161 -4.157 4.439 1.00 4.25 H ATOM 125 HB2 ARG A 9 -2.001 -6.407 3.779 1.00 20.23 H ATOM 126 HB3 ARG A 9 -0.462 -6.795 4.538 1.00 54.34 H ATOM 127 HG2 ARG A 9 -1.111 -5.021 6.281 1.00 63.44 H ATOM 128 HG3 ARG A 9 -2.740 -5.186 5.621 1.00 5.54 H ATOM 129 HD2 ARG A 9 -1.126 -7.552 6.532 1.00 75.35 H ATOM 130 HD3 ARG A 9 -2.146 -6.630 7.635 1.00 54.31 H ATOM 131 HE ARG A 9 -3.549 -7.478 5.292 1.00 32.33 H ATOM 132 HH11 ARG A 9 -2.442 -8.477 8.438 1.00 65.31 H ATOM 133 HH12 ARG A 9 -3.664 -9.691 8.627 1.00 42.32 H ATOM 134 HH21 ARG A 9 -5.163 -9.073 5.529 1.00 12.42 H ATOM 135 HH22 ARG A 9 -5.211 -10.029 6.971 1.00 22.03 H ATOM 136 N PRO A 10 1.731 -5.628 3.436 1.00 35.10 N ATOM 137 CA PRO A 10 2.919 -6.106 2.723 1.00 0.41 C ATOM 138 C PRO A 10 2.730 -7.508 2.156 1.00 61.33 C ATOM 139 O PRO A 10 3.025 -7.761 0.989 1.00 62.35 O ATOM 140 CB PRO A 10 4.004 -6.107 3.803 1.00 32.21 C ATOM 141 CG PRO A 10 3.261 -6.254 5.086 1.00 52.30 C ATOM 142 CD PRO A 10 1.951 -5.542 4.889 1.00 32.05 C ATOM 143 HA PRO A 10 3.202 -5.432 1.927 1.00 12.15 H ATOM 144 HB2 PRO A 10 4.678 -6.936 3.639 1.00 74.42 H ATOM 145 HB3 PRO A 10 4.552 -5.178 3.769 1.00 64.02 H ATOM 146 HG2 PRO A 10 3.092 -7.299 5.295 1.00 0.03 H ATOM 147 HG3 PRO A 10 3.820 -5.794 5.888 1.00 73.41 H ATOM 148 HD2 PRO A 10 1.163 -6.046 5.429 1.00 11.25 H ATOM 149 HD3 PRO A 10 2.029 -4.512 5.206 1.00 25.54 H ATOM 150 N GLY A 11 2.236 -8.418 2.990 1.00 14.22 N ATOM 151 CA GLY A 11 2.016 -9.784 2.553 1.00 54.01 C ATOM 152 C GLY A 11 0.882 -9.897 1.553 1.00 64.15 C ATOM 153 O GLY A 11 0.926 -10.731 0.649 1.00 72.14 O ATOM 154 H GLY A 11 2.018 -8.159 3.910 1.00 4.13 H ATOM 155 HA2 GLY A 11 2.922 -10.155 2.098 1.00 32.22 H ATOM 156 HA3 GLY A 11 1.782 -10.392 3.414 1.00 34.23 H ATOM 157 N GLN A 12 -0.135 -9.057 1.715 1.00 22.35 N ATOM 158 CA GLN A 12 -1.286 -9.069 0.820 1.00 25.20 C ATOM 159 C GLN A 12 -1.085 -8.096 -0.337 1.00 11.11 C ATOM 160 O GLN A 12 -0.386 -7.091 -0.203 1.00 54.43 O ATOM 161 CB GLN A 12 -2.559 -8.712 1.588 1.00 55.13 C ATOM 162 CG GLN A 12 -3.050 -9.822 2.503 1.00 70.33 C ATOM 163 CD GLN A 12 -3.174 -11.154 1.790 1.00 65.44 C ATOM 164 OE1 GLN A 12 -3.617 -11.219 0.642 1.00 5.25 O ATOM 165 NE2 GLN A 12 -2.781 -12.227 2.467 1.00 72.24 N ATOM 166 H GLN A 12 -0.111 -8.416 2.455 1.00 51.41 H ATOM 167 HA GLN A 12 -1.385 -10.067 0.421 1.00 23.32 H ATOM 168 HB2 GLN A 12 -2.369 -7.836 2.190 1.00 72.03 H ATOM 169 HB3 GLN A 12 -3.342 -8.488 0.878 1.00 33.00 H ATOM 170 HG2 GLN A 12 -2.353 -9.933 3.320 1.00 44.32 H ATOM 171 HG3 GLN A 12 -4.019 -9.548 2.893 1.00 51.24 H ATOM 172 HE21 GLN A 12 -2.440 -12.100 3.377 1.00 21.21 H ATOM 173 HE22 GLN A 12 -2.851 -13.101 2.030 1.00 3.13 H ATOM 174 N THR A 13 -1.702 -8.401 -1.474 1.00 53.13 N ATOM 175 CA THR A 13 -1.591 -7.554 -2.655 1.00 65.43 C ATOM 176 C THR A 13 -2.390 -6.267 -2.487 1.00 25.12 C ATOM 177 O THR A 13 -3.315 -6.200 -1.677 1.00 24.01 O ATOM 178 CB THR A 13 -2.079 -8.286 -3.920 1.00 21.55 C ATOM 179 OG1 THR A 13 -1.716 -9.670 -3.855 1.00 72.31 O ATOM 180 CG2 THR A 13 -1.485 -7.659 -5.172 1.00 20.14 C ATOM 181 H THR A 13 -2.245 -9.216 -1.519 1.00 1.43 H ATOM 182 HA THR A 13 -0.548 -7.305 -2.789 1.00 41.23 H ATOM 183 HB THR A 13 -3.155 -8.206 -3.970 1.00 74.23 H ATOM 184 HG1 THR A 13 -2.456 -10.180 -3.515 1.00 50.44 H ATOM 185 HG21 THR A 13 -1.375 -8.415 -5.936 1.00 0.45 H ATOM 186 HG22 THR A 13 -0.518 -7.238 -4.939 1.00 71.13 H ATOM 187 HG23 THR A 13 -2.141 -6.880 -5.529 1.00 1.42 H ATOM 188 N CYS A 14 -2.028 -5.246 -3.257 1.00 24.52 N ATOM 189 CA CYS A 14 -2.711 -3.960 -3.193 1.00 63.24 C ATOM 190 C CYS A 14 -3.417 -3.654 -4.511 1.00 34.12 C ATOM 191 O CYS A 14 -2.785 -3.584 -5.564 1.00 53.24 O ATOM 192 CB CYS A 14 -1.715 -2.846 -2.865 1.00 50.12 C ATOM 193 SG CYS A 14 -0.253 -2.811 -3.951 1.00 70.44 S ATOM 194 H CYS A 14 -1.282 -5.361 -3.884 1.00 2.14 H ATOM 195 HA CYS A 14 -3.449 -4.015 -2.408 1.00 4.54 H ATOM 196 HB2 CYS A 14 -2.213 -1.891 -2.955 1.00 64.11 H ATOM 197 HB3 CYS A 14 -1.368 -2.971 -1.850 1.00 53.11 H ATOM 198 N ALA A 15 -4.732 -3.473 -4.442 1.00 52.44 N ATOM 199 CA ALA A 15 -5.525 -3.172 -5.628 1.00 44.22 C ATOM 200 C ALA A 15 -6.001 -1.723 -5.617 1.00 61.33 C ATOM 201 O ALA A 15 -6.033 -1.078 -4.569 1.00 61.41 O ATOM 202 CB ALA A 15 -6.711 -4.119 -5.724 1.00 74.01 C ATOM 203 H ALA A 15 -5.179 -3.541 -3.573 1.00 75.44 H ATOM 204 HA ALA A 15 -4.900 -3.328 -6.496 1.00 24.22 H ATOM 205 HB1 ALA A 15 -7.579 -3.574 -6.067 1.00 61.04 H ATOM 206 HB2 ALA A 15 -6.484 -4.911 -6.422 1.00 31.23 H ATOM 207 HB3 ALA A 15 -6.913 -4.542 -4.752 1.00 15.05 H ATOM 208 N ARG A 16 -6.369 -1.218 -6.790 1.00 14.42 N ATOM 209 CA ARG A 16 -6.842 0.156 -6.915 1.00 31.12 C ATOM 210 C ARG A 16 -8.215 0.200 -7.580 1.00 3.01 C ATOM 211 O ARG A 16 -8.365 -0.172 -8.743 1.00 24.32 O ATOM 212 CB ARG A 16 -5.845 0.989 -7.722 1.00 53.42 C ATOM 213 CG ARG A 16 -5.386 0.315 -9.005 1.00 3.34 C ATOM 214 CD ARG A 16 -5.140 1.330 -10.110 1.00 61.02 C ATOM 215 NE ARG A 16 -5.090 0.702 -11.428 1.00 4.41 N ATOM 216 CZ ARG A 16 -4.764 1.352 -12.540 1.00 3.44 C ATOM 217 NH1 ARG A 16 -4.460 2.642 -12.493 1.00 15.24 N ATOM 218 NH2 ARG A 16 -4.740 0.712 -13.701 1.00 73.15 N ATOM 219 H ARG A 16 -6.321 -1.781 -7.590 1.00 75.12 H ATOM 220 HA ARG A 16 -6.923 0.571 -5.921 1.00 71.33 H ATOM 221 HB2 ARG A 16 -6.308 1.930 -7.982 1.00 43.32 H ATOM 222 HB3 ARG A 16 -4.977 1.181 -7.111 1.00 3.23 H ATOM 223 HG2 ARG A 16 -4.467 -0.219 -8.811 1.00 11.54 H ATOM 224 HG3 ARG A 16 -6.147 -0.379 -9.328 1.00 23.33 H ATOM 225 HD2 ARG A 16 -5.939 2.056 -10.098 1.00 41.14 H ATOM 226 HD3 ARG A 16 -4.200 1.827 -9.922 1.00 23.51 H ATOM 227 HE ARG A 16 -5.310 -0.250 -11.486 1.00 31.34 H ATOM 228 HH11 ARG A 16 -4.476 3.127 -11.618 1.00 53.14 H ATOM 229 HH12 ARG A 16 -4.214 3.129 -13.331 1.00 52.10 H ATOM 230 HH21 ARG A 16 -4.968 -0.261 -13.741 1.00 11.52 H ATOM 231 HH22 ARG A 16 -4.495 1.202 -14.537 1.00 71.14 H ATOM 232 N GLY A 17 -9.215 0.658 -6.832 1.00 63.43 N ATOM 233 CA GLY A 17 -10.562 0.741 -7.366 1.00 3.32 C ATOM 234 C GLY A 17 -11.231 -0.615 -7.465 1.00 14.13 C ATOM 235 O GLY A 17 -11.219 -1.246 -8.522 1.00 73.14 O ATOM 236 H GLY A 17 -9.036 0.941 -5.911 1.00 71.30 H ATOM 237 HA2 GLY A 17 -11.153 1.377 -6.724 1.00 4.23 H ATOM 238 HA3 GLY A 17 -10.519 1.181 -8.351 1.00 54.54 H ATOM 239 N LEU A 18 -11.816 -1.066 -6.360 1.00 71.04 N ATOM 240 CA LEU A 18 -12.493 -2.358 -6.326 1.00 40.21 C ATOM 241 C LEU A 18 -13.898 -2.221 -5.748 1.00 23.45 C ATOM 242 O LEU A 18 -14.105 -2.393 -4.546 1.00 21.02 O ATOM 243 CB LEU A 18 -11.683 -3.358 -5.499 1.00 74.11 C ATOM 244 CG LEU A 18 -10.534 -4.057 -6.227 1.00 54.52 C ATOM 245 CD1 LEU A 18 -9.779 -4.972 -5.277 1.00 64.41 C ATOM 246 CD2 LEU A 18 -11.058 -4.840 -7.422 1.00 41.23 C ATOM 247 H LEU A 18 -11.793 -0.518 -5.549 1.00 23.34 H ATOM 248 HA LEU A 18 -12.568 -2.719 -7.341 1.00 32.42 H ATOM 249 HB2 LEU A 18 -11.267 -2.829 -4.656 1.00 31.34 H ATOM 250 HB3 LEU A 18 -12.363 -4.120 -5.145 1.00 14.35 H ATOM 251 HG LEU A 18 -9.842 -3.311 -6.592 1.00 42.35 H ATOM 252 HD11 LEU A 18 -10.483 -5.525 -4.674 1.00 63.51 H ATOM 253 HD12 LEU A 18 -9.143 -4.380 -4.636 1.00 23.11 H ATOM 254 HD13 LEU A 18 -9.173 -5.661 -5.847 1.00 64.32 H ATOM 255 HD21 LEU A 18 -10.633 -4.437 -8.330 1.00 32.10 H ATOM 256 HD22 LEU A 18 -12.135 -4.759 -7.462 1.00 43.40 H ATOM 257 HD23 LEU A 18 -10.778 -5.878 -7.323 1.00 1.21 H ATOM 258 N HIS A 19 -14.860 -1.914 -6.611 1.00 14.52 N ATOM 259 CA HIS A 19 -16.247 -1.757 -6.186 1.00 0.11 C ATOM 260 C HIS A 19 -16.356 -0.741 -5.053 1.00 35.23 C ATOM 261 O HIS A 19 -17.171 -0.896 -4.143 1.00 65.14 O ATOM 262 CB HIS A 19 -16.820 -3.102 -5.738 1.00 52.22 C ATOM 263 CG HIS A 19 -16.531 -4.222 -6.689 1.00 34.41 C ATOM 264 ND1 HIS A 19 -17.331 -4.514 -7.774 1.00 10.02 N ATOM 265 CD2 HIS A 19 -15.522 -5.124 -6.714 1.00 34.42 C ATOM 266 CE1 HIS A 19 -16.827 -5.548 -8.424 1.00 14.11 C ATOM 267 NE2 HIS A 19 -15.729 -5.937 -7.801 1.00 54.14 N ATOM 268 H HIS A 19 -14.633 -1.789 -7.556 1.00 30.33 H ATOM 269 HA HIS A 19 -16.814 -1.397 -7.031 1.00 31.21 H ATOM 270 HB2 HIS A 19 -16.398 -3.364 -4.779 1.00 74.01 H ATOM 271 HB3 HIS A 19 -17.893 -3.015 -5.643 1.00 10.24 H ATOM 272 HD1 HIS A 19 -18.147 -4.035 -8.028 1.00 70.52 H ATOM 273 HD2 HIS A 19 -14.706 -5.193 -6.009 1.00 24.30 H ATOM 274 HE1 HIS A 19 -17.242 -5.999 -9.313 1.00 41.52 H