ATOM 37 N PRO A 4 0.409 5.337 -5.232 1.00 40.23 N ATOM 38 CA PRO A 4 -0.339 6.412 -4.574 1.00 53.43 C ATOM 39 C PRO A 4 -1.656 5.923 -3.980 1.00 44.01 C ATOM 40 O PRO A 4 -2.108 6.424 -2.950 1.00 65.51 O ATOM 41 CB PRO A 4 -0.601 7.407 -5.708 1.00 14.22 C ATOM 42 CG PRO A 4 -0.566 6.585 -6.949 1.00 61.34 C ATOM 43 CD PRO A 4 0.439 5.495 -6.696 1.00 3.40 C ATOM 44 HA PRO A 4 0.247 6.889 -3.803 1.00 3.52 H ATOM 45 HB2 PRO A 4 -1.568 7.871 -5.567 1.00 61.52 H ATOM 46 HB3 PRO A 4 0.169 8.163 -5.713 1.00 41.43 H ATOM 47 HG2 PRO A 4 -1.540 6.160 -7.136 1.00 72.15 H ATOM 48 HG3 PRO A 4 -0.254 7.195 -7.784 1.00 73.35 H ATOM 49 HD2 PRO A 4 0.139 4.583 -7.189 1.00 31.32 H ATOM 50 HD3 PRO A 4 1.420 5.802 -7.030 1.00 32.43 H ATOM 51 N VAL A 5 -2.267 4.941 -4.636 1.00 1.34 N ATOM 52 CA VAL A 5 -3.531 4.383 -4.171 1.00 50.00 C ATOM 53 C VAL A 5 -3.411 3.864 -2.743 1.00 24.23 C ATOM 54 O VAL A 5 -2.344 3.937 -2.132 1.00 63.45 O ATOM 55 CB VAL A 5 -4.008 3.237 -5.084 1.00 2.45 C ATOM 56 CG1 VAL A 5 -4.098 3.707 -6.528 1.00 25.14 C ATOM 57 CG2 VAL A 5 -3.080 2.038 -4.961 1.00 33.02 C ATOM 58 H VAL A 5 -1.857 4.584 -5.451 1.00 33.52 H ATOM 59 HA VAL A 5 -4.273 5.168 -4.197 1.00 44.31 H ATOM 60 HB VAL A 5 -4.995 2.937 -4.764 1.00 62.21 H ATOM 61 HG11 VAL A 5 -4.852 4.476 -6.609 1.00 64.14 H ATOM 62 HG12 VAL A 5 -3.142 4.103 -6.838 1.00 2.44 H ATOM 63 HG13 VAL A 5 -4.364 2.873 -7.161 1.00 14.52 H ATOM 64 HG21 VAL A 5 -3.572 1.260 -4.397 1.00 74.41 H ATOM 65 HG22 VAL A 5 -2.836 1.669 -5.947 1.00 31.35 H ATOM 66 HG23 VAL A 5 -2.174 2.333 -4.453 1.00 14.30 H ATOM 67 N TYR A 6 -4.511 3.339 -2.215 1.00 50.31 N ATOM 68 CA TYR A 6 -4.530 2.809 -0.857 1.00 42.01 C ATOM 69 C TYR A 6 -3.409 1.794 -0.653 1.00 73.11 C ATOM 70 O TYR A 6 -3.177 0.928 -1.498 1.00 10.41 O ATOM 71 CB TYR A 6 -5.882 2.159 -0.559 1.00 52.35 C ATOM 72 CG TYR A 6 -7.065 3.033 -0.912 1.00 45.31 C ATOM 73 CD1 TYR A 6 -7.494 4.036 -0.051 1.00 25.22 C ATOM 74 CD2 TYR A 6 -7.753 2.856 -2.106 1.00 12.24 C ATOM 75 CE1 TYR A 6 -8.574 4.836 -0.368 1.00 43.43 C ATOM 76 CE2 TYR A 6 -8.833 3.653 -2.432 1.00 34.00 C ATOM 77 CZ TYR A 6 -9.240 4.641 -1.560 1.00 40.51 C ATOM 78 OH TYR A 6 -10.316 5.436 -1.881 1.00 15.30 O ATOM 79 H TYR A 6 -5.331 3.309 -2.751 1.00 0.31 H ATOM 80 HA TYR A 6 -4.381 3.635 -0.177 1.00 24.55 H ATOM 81 HB2 TYR A 6 -5.967 1.244 -1.125 1.00 44.42 H ATOM 82 HB3 TYR A 6 -5.940 1.932 0.495 1.00 72.31 H ATOM 83 HD1 TYR A 6 -6.970 4.186 0.882 1.00 4.11 H ATOM 84 HD2 TYR A 6 -7.432 2.081 -2.786 1.00 74.41 H ATOM 85 HE1 TYR A 6 -8.892 5.611 0.314 1.00 73.20 H ATOM 86 HE2 TYR A 6 -9.356 3.500 -3.365 1.00 4.20 H ATOM 87 HH TYR A 6 -11.033 4.888 -2.209 1.00 22.51 H ATOM 88 N THR A 7 -2.717 1.906 0.476 1.00 24.31 N ATOM 89 CA THR A 7 -1.620 1.000 0.793 1.00 30.50 C ATOM 90 C THR A 7 -2.135 -0.283 1.437 1.00 0.40 C ATOM 91 O THR A 7 -2.900 -0.241 2.401 1.00 23.53 O ATOM 92 CB THR A 7 -0.600 1.661 1.738 1.00 4.32 C ATOM 93 OG1 THR A 7 -1.169 1.817 3.043 1.00 72.22 O ATOM 94 CG2 THR A 7 -0.167 3.018 1.203 1.00 11.12 C ATOM 95 H THR A 7 -2.949 2.616 1.110 1.00 73.10 H ATOM 96 HA THR A 7 -1.116 0.750 -0.130 1.00 0.45 H ATOM 97 HB THR A 7 0.270 1.024 1.807 1.00 4.01 H ATOM 98 HG1 THR A 7 -1.773 2.563 3.041 1.00 15.14 H ATOM 99 HG21 THR A 7 -0.511 3.130 0.185 1.00 4.04 H ATOM 100 HG22 THR A 7 0.910 3.089 1.230 1.00 61.33 H ATOM 101 HG23 THR A 7 -0.594 3.798 1.815 1.00 54.44 H ATOM 102 N CYS A 8 -1.711 -1.421 0.899 1.00 61.21 N ATOM 103 CA CYS A 8 -2.129 -2.717 1.421 1.00 3.40 C ATOM 104 C CYS A 8 -0.969 -3.422 2.118 1.00 1.24 C ATOM 105 O CYS A 8 0.189 -3.032 1.967 1.00 61.31 O ATOM 106 CB CYS A 8 -2.669 -3.595 0.291 1.00 61.20 C ATOM 107 SG CYS A 8 -3.948 -4.781 0.817 1.00 3.05 S ATOM 108 H CYS A 8 -1.102 -1.390 0.131 1.00 44.42 H ATOM 109 HA CYS A 8 -2.915 -2.547 2.140 1.00 12.44 H ATOM 110 HB2 CYS A 8 -3.102 -2.963 -0.471 1.00 1.04 H ATOM 111 HB3 CYS A 8 -1.853 -4.159 -0.138 1.00 15.04 H ATOM 112 N ARG A 9 -1.289 -4.461 2.882 1.00 21.13 N ATOM 113 CA ARG A 9 -0.275 -5.220 3.604 1.00 64.23 C ATOM 114 C ARG A 9 0.844 -5.663 2.664 1.00 13.34 C ATOM 115 O ARG A 9 0.683 -5.703 1.444 1.00 25.04 O ATOM 116 CB ARG A 9 -0.904 -6.442 4.276 1.00 5.22 C ATOM 117 CG ARG A 9 -1.450 -6.158 5.666 1.00 63.20 C ATOM 118 CD ARG A 9 -2.709 -5.308 5.607 1.00 41.42 C ATOM 119 NE ARG A 9 -3.519 -5.444 6.814 1.00 3.14 N ATOM 120 CZ ARG A 9 -4.434 -4.557 7.190 1.00 45.12 C ATOM 121 NH1 ARG A 9 -4.654 -3.475 6.455 1.00 22.41 N ATOM 122 NH2 ARG A 9 -5.131 -4.751 8.302 1.00 25.11 N ATOM 123 H ARG A 9 -2.230 -4.723 2.963 1.00 22.55 H ATOM 124 HA ARG A 9 0.143 -4.577 4.364 1.00 61.13 H ATOM 125 HB2 ARG A 9 -1.716 -6.799 3.660 1.00 22.14 H ATOM 126 HB3 ARG A 9 -0.157 -7.217 4.358 1.00 45.11 H ATOM 127 HG2 ARG A 9 -1.684 -7.095 6.149 1.00 73.42 H ATOM 128 HG3 ARG A 9 -0.698 -5.635 6.238 1.00 52.52 H ATOM 129 HD2 ARG A 9 -2.423 -4.273 5.492 1.00 51.34 H ATOM 130 HD3 ARG A 9 -3.295 -5.616 4.754 1.00 13.12 H ATOM 131 HE ARG A 9 -3.372 -6.236 7.372 1.00 13.21 H ATOM 132 HH11 ARG A 9 -4.131 -3.327 5.616 1.00 22.00 H ATOM 133 HH12 ARG A 9 -5.344 -2.810 6.739 1.00 11.44 H ATOM 134 HH21 ARG A 9 -4.967 -5.565 8.858 1.00 34.34 H ATOM 135 HH22 ARG A 9 -5.818 -4.083 8.584 1.00 75.02 H ATOM 136 N PRO A 10 2.004 -6.002 3.245 1.00 64.24 N ATOM 137 CA PRO A 10 3.172 -6.448 2.478 1.00 11.31 C ATOM 138 C PRO A 10 2.966 -7.825 1.857 1.00 25.11 C ATOM 139 O PRO A 10 3.290 -8.045 0.691 1.00 72.42 O ATOM 140 CB PRO A 10 4.287 -6.494 3.526 1.00 61.24 C ATOM 141 CG PRO A 10 3.581 -6.696 4.822 1.00 61.12 C ATOM 142 CD PRO A 10 2.266 -5.978 4.693 1.00 2.04 C ATOM 143 HA PRO A 10 3.432 -5.740 1.704 1.00 31.32 H ATOM 144 HB2 PRO A 10 4.956 -7.315 3.307 1.00 53.01 H ATOM 145 HB3 PRO A 10 4.835 -5.564 3.515 1.00 13.13 H ATOM 146 HG2 PRO A 10 3.418 -7.749 4.991 1.00 22.52 H ATOM 147 HG3 PRO A 10 4.163 -6.271 5.626 1.00 11.23 H ATOM 148 HD2 PRO A 10 1.494 -6.505 5.234 1.00 70.12 H ATOM 149 HD3 PRO A 10 2.354 -4.963 5.052 1.00 41.24 H ATOM 150 N GLY A 11 2.426 -8.750 2.645 1.00 60.01 N ATOM 151 CA GLY A 11 2.187 -10.095 2.154 1.00 14.41 C ATOM 152 C GLY A 11 1.006 -10.164 1.206 1.00 32.12 C ATOM 153 O GLY A 11 1.013 -10.942 0.253 1.00 72.31 O ATOM 154 H GLY A 11 2.188 -8.517 3.567 1.00 60.32 H ATOM 155 HA2 GLY A 11 3.070 -10.440 1.638 1.00 31.44 H ATOM 156 HA3 GLY A 11 1.996 -10.744 2.996 1.00 60.00 H ATOM 157 N GLN A 12 -0.011 -9.350 1.470 1.00 52.25 N ATOM 158 CA GLN A 12 -1.205 -9.325 0.633 1.00 13.32 C ATOM 159 C GLN A 12 -1.060 -8.306 -0.493 1.00 21.41 C ATOM 160 O GLN A 12 -0.526 -7.215 -0.293 1.00 13.43 O ATOM 161 CB GLN A 12 -2.438 -8.997 1.477 1.00 11.33 C ATOM 162 CG GLN A 12 -2.843 -10.116 2.423 1.00 2.34 C ATOM 163 CD GLN A 12 -4.299 -10.032 2.837 1.00 70.44 C ATOM 164 OE1 GLN A 12 -5.084 -9.293 2.242 1.00 3.31 O ATOM 165 NE2 GLN A 12 -4.669 -10.793 3.860 1.00 5.15 N ATOM 166 H GLN A 12 0.043 -8.753 2.244 1.00 14.20 H ATOM 167 HA GLN A 12 -1.327 -10.306 0.200 1.00 35.05 H ATOM 168 HB2 GLN A 12 -2.233 -8.114 2.064 1.00 32.15 H ATOM 169 HB3 GLN A 12 -3.269 -8.795 0.817 1.00 64.41 H ATOM 170 HG2 GLN A 12 -2.678 -11.063 1.932 1.00 53.04 H ATOM 171 HG3 GLN A 12 -2.228 -10.060 3.310 1.00 52.13 H ATOM 172 HE21 GLN A 12 -3.989 -11.357 4.287 1.00 43.42 H ATOM 173 HE22 GLN A 12 -5.603 -10.758 4.149 1.00 34.22 H ATOM 174 N THR A 13 -1.538 -8.671 -1.679 1.00 2.51 N ATOM 175 CA THR A 13 -1.460 -7.790 -2.837 1.00 43.25 C ATOM 176 C THR A 13 -2.286 -6.526 -2.624 1.00 63.54 C ATOM 177 O THR A 13 -3.208 -6.506 -1.809 1.00 55.32 O ATOM 178 CB THR A 13 -1.947 -8.498 -4.116 1.00 24.44 C ATOM 179 OG1 THR A 13 -1.531 -9.868 -4.105 1.00 25.51 O ATOM 180 CG2 THR A 13 -1.403 -7.808 -5.357 1.00 55.25 C ATOM 181 H THR A 13 -1.952 -9.553 -1.776 1.00 22.45 H ATOM 182 HA THR A 13 -0.425 -7.513 -2.977 1.00 2.44 H ATOM 183 HB THR A 13 -3.026 -8.458 -4.142 1.00 72.03 H ATOM 184 HG1 THR A 13 -1.814 -10.295 -4.917 1.00 64.33 H ATOM 185 HG21 THR A 13 -0.338 -7.664 -5.253 1.00 13.34 H ATOM 186 HG22 THR A 13 -1.887 -6.850 -5.477 1.00 3.52 H ATOM 187 HG23 THR A 13 -1.600 -8.421 -6.224 1.00 42.53 H ATOM 188 N CYS A 14 -1.950 -5.474 -3.362 1.00 45.24 N ATOM 189 CA CYS A 14 -2.660 -4.205 -3.255 1.00 32.51 C ATOM 190 C CYS A 14 -3.389 -3.878 -4.555 1.00 62.32 C ATOM 191 O CYS A 14 -2.772 -3.775 -5.615 1.00 73.22 O ATOM 192 CB CYS A 14 -1.686 -3.079 -2.906 1.00 43.22 C ATOM 193 SG CYS A 14 -0.242 -2.975 -4.013 1.00 33.12 S ATOM 194 H CYS A 14 -1.204 -5.552 -3.995 1.00 52.34 H ATOM 195 HA CYS A 14 -3.387 -4.299 -2.463 1.00 15.41 H ATOM 196 HB2 CYS A 14 -2.207 -2.134 -2.958 1.00 3.22 H ATOM 197 HB3 CYS A 14 -1.320 -3.228 -1.901 1.00 0.20 H ATOM 198 N ALA A 15 -4.705 -3.716 -4.465 1.00 22.11 N ATOM 199 CA ALA A 15 -5.517 -3.398 -5.633 1.00 33.54 C ATOM 200 C ALA A 15 -6.015 -1.958 -5.580 1.00 21.03 C ATOM 201 O ALA A 15 -6.043 -1.340 -4.516 1.00 10.35 O ATOM 202 CB ALA A 15 -6.691 -4.361 -5.737 1.00 11.05 C ATOM 203 H ALA A 15 -5.139 -3.811 -3.592 1.00 32.02 H ATOM 204 HA ALA A 15 -4.902 -3.524 -6.512 1.00 24.03 H ATOM 205 HB1 ALA A 15 -6.645 -5.072 -4.924 1.00 71.25 H ATOM 206 HB2 ALA A 15 -7.616 -3.807 -5.679 1.00 74.50 H ATOM 207 HB3 ALA A 15 -6.643 -4.886 -6.679 1.00 31.34 H ATOM 208 N ARG A 16 -6.406 -1.429 -6.735 1.00 30.34 N ATOM 209 CA ARG A 16 -6.901 -0.060 -6.820 1.00 22.55 C ATOM 210 C ARG A 16 -8.260 -0.016 -7.511 1.00 14.33 C ATOM 211 O ARG A 16 -8.458 -0.636 -8.554 1.00 74.34 O ATOM 212 CB ARG A 16 -5.903 0.819 -7.576 1.00 32.04 C ATOM 213 CG ARG A 16 -5.860 0.545 -9.070 1.00 20.21 C ATOM 214 CD ARG A 16 -6.756 1.504 -9.838 1.00 64.34 C ATOM 215 NE ARG A 16 -6.095 2.780 -10.098 1.00 14.31 N ATOM 216 CZ ARG A 16 -5.110 2.933 -10.975 1.00 61.03 C ATOM 217 NH1 ARG A 16 -4.673 1.894 -11.674 1.00 51.31 N ATOM 218 NH2 ARG A 16 -4.559 4.127 -11.156 1.00 34.24 N ATOM 219 H ARG A 16 -6.360 -1.972 -7.549 1.00 71.23 H ATOM 220 HA ARG A 16 -7.009 0.316 -5.814 1.00 10.35 H ATOM 221 HB2 ARG A 16 -6.172 1.855 -7.430 1.00 4.12 H ATOM 222 HB3 ARG A 16 -4.916 0.651 -7.172 1.00 51.10 H ATOM 223 HG2 ARG A 16 -4.844 0.661 -9.419 1.00 34.23 H ATOM 224 HG3 ARG A 16 -6.191 -0.467 -9.250 1.00 54.13 H ATOM 225 HD2 ARG A 16 -7.022 1.049 -10.781 1.00 12.31 H ATOM 226 HD3 ARG A 16 -7.649 1.682 -9.260 1.00 14.15 H ATOM 227 HE ARG A 16 -6.403 3.561 -9.592 1.00 44.15 H ATOM 228 HH11 ARG A 16 -5.087 0.994 -11.541 1.00 63.21 H ATOM 229 HH12 ARG A 16 -3.932 2.012 -12.335 1.00 44.21 H ATOM 230 HH21 ARG A 16 -4.886 4.912 -10.631 1.00 12.22 H ATOM 231 HH22 ARG A 16 -3.818 4.241 -11.816 1.00 22.31 H ATOM 232 N GLY A 17 -9.195 0.723 -6.920 1.00 50.01 N ATOM 233 CA GLY A 17 -10.524 0.834 -7.492 1.00 40.54 C ATOM 234 C GLY A 17 -11.192 -0.514 -7.674 1.00 62.05 C ATOM 235 O GLY A 17 -11.199 -1.068 -8.775 1.00 34.04 O ATOM 236 H GLY A 17 -8.980 1.196 -6.089 1.00 13.11 H ATOM 237 HA2 GLY A 17 -11.135 1.442 -6.841 1.00 44.13 H ATOM 238 HA3 GLY A 17 -10.449 1.319 -8.455 1.00 34.01 H ATOM 239 N LEU A 18 -11.753 -1.045 -6.594 1.00 24.32 N ATOM 240 CA LEU A 18 -12.425 -2.339 -6.638 1.00 71.24 C ATOM 241 C LEU A 18 -13.812 -2.254 -6.009 1.00 40.03 C ATOM 242 O LEU A 18 -13.980 -2.506 -4.816 1.00 34.13 O ATOM 243 CB LEU A 18 -11.589 -3.396 -5.915 1.00 65.01 C ATOM 244 CG LEU A 18 -10.629 -4.206 -6.788 1.00 54.13 C ATOM 245 CD1 LEU A 18 -9.817 -5.170 -5.937 1.00 53.41 C ATOM 246 CD2 LEU A 18 -11.396 -4.959 -7.866 1.00 10.02 C ATOM 247 H LEU A 18 -11.714 -0.557 -5.746 1.00 13.15 H ATOM 248 HA LEU A 18 -12.530 -2.622 -7.675 1.00 70.32 H ATOM 249 HB2 LEU A 18 -11.004 -2.894 -5.159 1.00 62.55 H ATOM 250 HB3 LEU A 18 -12.270 -4.088 -5.440 1.00 42.14 H ATOM 251 HG LEU A 18 -9.940 -3.531 -7.277 1.00 12.22 H ATOM 252 HD11 LEU A 18 -9.042 -5.617 -6.540 1.00 43.43 H ATOM 253 HD12 LEU A 18 -10.465 -5.943 -5.552 1.00 60.31 H ATOM 254 HD13 LEU A 18 -9.370 -4.633 -5.114 1.00 4.34 H ATOM 255 HD21 LEU A 18 -11.774 -4.258 -8.595 1.00 44.50 H ATOM 256 HD22 LEU A 18 -12.223 -5.489 -7.415 1.00 65.42 H ATOM 257 HD23 LEU A 18 -10.737 -5.663 -8.351 1.00 22.32 H ATOM 258 N HIS A 19 -14.803 -1.899 -6.821 1.00 34.05 N ATOM 259 CA HIS A 19 -16.177 -1.784 -6.344 1.00 11.51 C ATOM 260 C HIS A 19 -16.256 -0.861 -5.131 1.00 44.03 C ATOM 261 O HIS A 19 -17.036 -1.096 -4.209 1.00 63.14 O ATOM 262 CB HIS A 19 -16.733 -3.162 -5.987 1.00 71.42 C ATOM 263 CG HIS A 19 -16.569 -4.175 -7.079 1.00 13.05 C ATOM 264 ND1 HIS A 19 -17.516 -4.384 -8.059 1.00 44.05 N ATOM 265 CD2 HIS A 19 -15.560 -5.038 -7.341 1.00 52.04 C ATOM 266 CE1 HIS A 19 -17.097 -5.333 -8.877 1.00 45.14 C ATOM 267 NE2 HIS A 19 -15.912 -5.746 -8.464 1.00 31.20 N ATOM 268 H HIS A 19 -14.606 -1.711 -7.762 1.00 15.13 H ATOM 269 HA HIS A 19 -16.770 -1.361 -7.141 1.00 32.12 H ATOM 270 HB2 HIS A 19 -16.222 -3.534 -5.111 1.00 42.23 H ATOM 271 HB3 HIS A 19 -17.788 -3.073 -5.772 1.00 32.44 H ATOM 272 HD1 HIS A 19 -18.368 -3.909 -8.143 1.00 12.24 H ATOM 273 HD2 HIS A 19 -14.647 -5.150 -6.774 1.00 11.15 H ATOM 274 HE1 HIS A 19 -17.630 -5.707 -9.738 1.00 73.11 H