ATOM 1 N GLY A 1 29.185 -3.304 -16.812 1.00 0.23 N ATOM 2 CA GLY A 1 30.385 -2.447 -16.964 1.00 0.52 C ATOM 3 C GLY A 1 30.059 -0.983 -16.765 1.00 0.32 C ATOM 4 O GLY A 1 29.791 -0.267 -17.729 1.00 0.19 O ATOM 5 H1 GLY A 1 29.434 -4.302 -16.955 1.00 0.35 H ATOM 6 H2 GLY A 1 28.467 -3.037 -17.512 1.00 0.48 H ATOM 7 H3 GLY A 1 28.782 -3.191 -15.861 1.00 0.16 H ATOM 8 HA2 GLY A 1 31.125 -2.744 -16.235 1.00 0.74 H ATOM 9 HA3 GLY A 1 30.790 -2.585 -17.956 1.00 0.85 H ATOM 10 N SER A 2 30.076 -0.541 -15.516 1.00 0.42 N ATOM 11 CA SER A 2 29.769 0.839 -15.184 1.00 0.34 C ATOM 12 C SER A 2 30.475 1.240 -13.891 1.00 0.28 C ATOM 13 O SER A 2 30.936 0.379 -13.140 1.00 0.53 O ATOM 14 CB SER A 2 28.252 1.019 -15.048 1.00 0.58 C ATOM 15 OG SER A 2 27.641 -0.163 -14.552 1.00 0.54 O ATOM 16 H SER A 2 30.311 -1.163 -14.793 1.00 0.61 H ATOM 17 HA SER A 2 30.127 1.464 -15.989 1.00 0.23 H ATOM 18 HB2 SER A 2 28.049 1.829 -14.363 1.00 0.75 H ATOM 19 HB3 SER A 2 27.830 1.251 -16.016 1.00 0.70 H ATOM 20 HG SER A 2 28.130 -0.474 -13.777 1.00 0.44 H ATOM 21 N HIS A 3 30.565 2.537 -13.644 1.00 0.18 N ATOM 22 CA HIS A 3 31.217 3.037 -12.444 1.00 0.13 C ATOM 23 C HIS A 3 30.203 3.744 -11.556 1.00 0.16 C ATOM 24 O HIS A 3 29.354 4.489 -12.046 1.00 0.31 O ATOM 25 CB HIS A 3 32.351 3.994 -12.817 1.00 0.26 C ATOM 26 CG HIS A 3 33.475 3.999 -11.829 1.00 0.54 C ATOM 27 ND1 HIS A 3 33.721 5.046 -10.965 1.00 1.06 N ATOM 28 CD2 HIS A 3 34.431 3.076 -11.576 1.00 1.49 C ATOM 29 CE1 HIS A 3 34.779 4.762 -10.226 1.00 1.02 C ATOM 30 NE2 HIS A 3 35.224 3.572 -10.576 1.00 1.41 N ATOM 31 H HIS A 3 30.179 3.178 -14.280 1.00 0.36 H ATOM 32 HA HIS A 3 31.627 2.194 -11.907 1.00 0.21 H ATOM 33 HB2 HIS A 3 32.753 3.705 -13.777 1.00 0.24 H ATOM 34 HB3 HIS A 3 31.959 4.998 -12.883 1.00 0.62 H ATOM 35 HD1 HIS A 3 33.204 5.880 -10.904 1.00 1.86 H ATOM 36 HD2 HIS A 3 34.540 2.119 -12.062 1.00 2.37 H ATOM 37 HE1 HIS A 3 35.202 5.394 -9.461 1.00 1.43 H ATOM 38 HE2 HIS A 3 36.090 3.193 -10.297 1.00 2.03 H ATOM 39 N MET A 4 30.289 3.513 -10.253 1.00 0.20 N ATOM 40 CA MET A 4 29.368 4.134 -9.310 1.00 0.25 C ATOM 41 C MET A 4 29.804 5.565 -8.992 1.00 0.20 C ATOM 42 O MET A 4 30.360 5.841 -7.928 1.00 0.30 O ATOM 43 CB MET A 4 29.271 3.299 -8.027 1.00 0.37 C ATOM 44 CG MET A 4 28.164 3.750 -7.086 1.00 0.43 C ATOM 45 SD MET A 4 27.967 2.661 -5.660 1.00 0.28 S ATOM 46 CE MET A 4 27.236 1.221 -6.439 1.00 0.33 C ATOM 47 H MET A 4 30.987 2.913 -9.915 1.00 0.29 H ATOM 48 HA MET A 4 28.395 4.167 -9.778 1.00 0.29 H ATOM 49 HB2 MET A 4 29.088 2.268 -8.293 1.00 0.37 H ATOM 50 HB3 MET A 4 30.211 3.364 -7.497 1.00 0.46 H ATOM 51 HG2 MET A 4 28.396 4.743 -6.731 1.00 0.55 H ATOM 52 HG3 MET A 4 27.233 3.774 -7.634 1.00 0.49 H ATOM 53 HE1 MET A 4 27.937 0.798 -7.144 1.00 0.36 H ATOM 54 HE2 MET A 4 26.335 1.512 -6.959 1.00 0.28 H ATOM 55 HE3 MET A 4 26.995 0.485 -5.685 1.00 0.46 H ATOM 56 N THR A 5 29.570 6.463 -9.940 1.00 0.32 N ATOM 57 CA THR A 5 29.926 7.865 -9.779 1.00 0.34 C ATOM 58 C THR A 5 28.920 8.584 -8.884 1.00 0.34 C ATOM 59 O THR A 5 29.296 9.393 -8.034 1.00 0.37 O ATOM 60 CB THR A 5 29.994 8.572 -11.149 1.00 0.36 C ATOM 61 OG1 THR A 5 30.837 7.828 -12.040 1.00 0.33 O ATOM 62 CG2 THR A 5 30.524 9.993 -11.016 1.00 0.54 C ATOM 63 H THR A 5 29.158 6.170 -10.784 1.00 0.49 H ATOM 64 HA THR A 5 30.903 7.913 -9.321 1.00 0.36 H ATOM 65 HB THR A 5 28.997 8.616 -11.562 1.00 0.37 H ATOM 66 HG1 THR A 5 31.760 7.972 -11.800 1.00 0.82 H ATOM 67 HG21 THR A 5 30.632 10.429 -11.998 1.00 0.34 H ATOM 68 HG22 THR A 5 31.482 9.976 -10.523 1.00 1.34 H ATOM 69 HG23 THR A 5 29.831 10.583 -10.435 1.00 1.11 H ATOM 70 N GLU A 6 27.643 8.281 -9.075 1.00 0.35 N ATOM 71 CA GLU A 6 26.587 8.903 -8.292 1.00 0.39 C ATOM 72 C GLU A 6 25.811 7.845 -7.518 1.00 0.32 C ATOM 73 O GLU A 6 26.147 6.660 -7.564 1.00 0.30 O ATOM 74 CB GLU A 6 25.635 9.683 -9.201 1.00 0.52 C ATOM 75 CG GLU A 6 26.340 10.616 -10.172 1.00 0.53 C ATOM 76 CD GLU A 6 25.386 11.560 -10.864 1.00 1.16 C ATOM 77 OE1 GLU A 6 24.566 11.092 -11.679 1.00 1.64 O ATOM 78 OE2 GLU A 6 25.458 12.777 -10.602 1.00 1.31 O1- ATOM 79 H GLU A 6 27.404 7.614 -9.750 1.00 0.37 H ATOM 80 HA GLU A 6 27.047 9.584 -7.591 1.00 0.41 H ATOM 81 HB2 GLU A 6 25.050 8.980 -9.776 1.00 0.57 H ATOM 82 HB3 GLU A 6 24.971 10.272 -8.588 1.00 0.58 H ATOM 83 HG2 GLU A 6 27.071 11.197 -9.629 1.00 0.57 H ATOM 84 HG3 GLU A 6 26.840 10.021 -10.922 1.00 0.58 H ATOM 85 N GLN A 7 24.780 8.281 -6.811 1.00 0.30 N ATOM 86 CA GLN A 7 23.946 7.375 -6.034 1.00 0.25 C ATOM 87 C GLN A 7 22.625 7.124 -6.751 1.00 0.23 C ATOM 88 O GLN A 7 21.732 7.971 -6.741 1.00 0.29 O ATOM 89 CB GLN A 7 23.689 7.947 -4.639 1.00 0.29 C ATOM 90 CG GLN A 7 24.413 7.195 -3.534 1.00 0.42 C ATOM 91 CD GLN A 7 24.171 7.805 -2.171 1.00 1.19 C ATOM 92 OE1 GLN A 7 23.985 9.013 -2.042 1.00 1.46 O ATOM 93 NE2 GLN A 7 24.179 6.978 -1.140 1.00 1.77 N ATOM 94 H GLN A 7 24.566 9.236 -6.816 1.00 0.35 H ATOM 95 HA GLN A 7 24.475 6.438 -5.939 1.00 0.23 H ATOM 96 HB2 GLN A 7 24.017 8.975 -4.620 1.00 0.36 H ATOM 97 HB3 GLN A 7 22.627 7.912 -4.436 1.00 0.54 H ATOM 98 HG2 GLN A 7 24.068 6.172 -3.525 1.00 1.09 H ATOM 99 HG3 GLN A 7 25.473 7.216 -3.740 1.00 0.35 H ATOM 100 HE21 GLN A 7 24.339 6.025 -1.310 1.00 1.56 H ATOM 101 HE22 GLN A 7 24.022 7.352 -0.247 1.00 2.42 H ATOM 102 N PRO A 8 22.497 5.962 -7.403 1.00 0.18 N ATOM 103 CA PRO A 8 21.284 5.592 -8.126 1.00 0.17 C ATOM 104 C PRO A 8 20.244 4.959 -7.202 1.00 0.19 C ATOM 105 O PRO A 8 20.431 4.916 -5.984 1.00 0.25 O ATOM 106 CB PRO A 8 21.807 4.577 -9.142 1.00 0.18 C ATOM 107 CG PRO A 8 22.937 3.900 -8.443 1.00 0.20 C ATOM 108 CD PRO A 8 23.527 4.912 -7.491 1.00 0.18 C ATOM 109 HA PRO A 8 20.850 6.439 -8.639 1.00 0.18 H ATOM 110 HB2 PRO A 8 21.025 3.878 -9.396 1.00 0.21 H ATOM 111 HB3 PRO A 8 22.143 5.091 -10.029 1.00 0.17 H ATOM 112 HG2 PRO A 8 22.566 3.047 -7.894 1.00 0.24 H ATOM 113 HG3 PRO A 8 23.678 3.589 -9.164 1.00 0.22 H ATOM 114 HD2 PRO A 8 23.697 4.461 -6.523 1.00 0.21 H ATOM 115 HD3 PRO A 8 24.449 5.310 -7.888 1.00 0.18 H ATOM 116 N LYS A 9 19.148 4.470 -7.778 1.00 0.17 N ATOM 117 CA LYS A 9 18.095 3.833 -6.999 1.00 0.20 C ATOM 118 C LYS A 9 18.593 2.495 -6.460 1.00 0.23 C ATOM 119 O LYS A 9 18.476 1.460 -7.118 1.00 0.30 O ATOM 120 CB LYS A 9 16.839 3.627 -7.852 1.00 0.14 C ATOM 121 CG LYS A 9 16.309 4.906 -8.495 1.00 0.33 C ATOM 122 CD LYS A 9 14.965 4.678 -9.168 1.00 0.76 C ATOM 123 CE LYS A 9 14.554 5.861 -10.031 1.00 1.45 C ATOM 124 NZ LYS A 9 14.368 7.104 -9.235 1.00 2.23 N1+ ATOM 125 H LYS A 9 19.048 4.534 -8.753 1.00 0.15 H ATOM 126 HA LYS A 9 17.859 4.479 -6.169 1.00 0.27 H ATOM 127 HB2 LYS A 9 17.067 2.922 -8.638 1.00 0.12 H ATOM 128 HB3 LYS A 9 16.060 3.214 -7.228 1.00 0.26 H ATOM 129 HG2 LYS A 9 16.192 5.661 -7.732 1.00 1.12 H ATOM 130 HG3 LYS A 9 17.015 5.248 -9.236 1.00 0.99 H ATOM 131 HD2 LYS A 9 15.028 3.798 -9.791 1.00 0.93 H ATOM 132 HD3 LYS A 9 14.214 4.525 -8.407 1.00 1.18 H ATOM 133 HE2 LYS A 9 15.318 6.031 -10.773 1.00 2.08 H ATOM 134 HE3 LYS A 9 13.624 5.621 -10.523 1.00 1.11 H ATOM 135 HZ1 LYS A 9 15.285 7.449 -8.883 1.00 2.64 H ATOM 136 HZ2 LYS A 9 13.747 6.924 -8.420 1.00 2.13 H ATOM 137 HZ3 LYS A 9 13.938 7.846 -9.822 1.00 2.93 H ATOM 138 N THR A 10 19.171 2.534 -5.271 1.00 0.30 N ATOM 139 CA THR A 10 19.712 1.348 -4.637 1.00 0.36 C ATOM 140 C THR A 10 18.604 0.448 -4.096 1.00 0.30 C ATOM 141 O THR A 10 17.479 0.894 -3.841 1.00 0.27 O ATOM 142 CB THR A 10 20.685 1.732 -3.497 1.00 0.49 C ATOM 143 OG1 THR A 10 21.463 0.595 -3.099 1.00 0.62 O ATOM 144 CG2 THR A 10 19.936 2.284 -2.287 1.00 0.60 C ATOM 145 H THR A 10 19.241 3.395 -4.805 1.00 0.36 H ATOM 146 HA THR A 10 20.270 0.802 -5.383 1.00 0.39 H ATOM 147 HB THR A 10 21.352 2.499 -3.863 1.00 0.44 H ATOM 148 HG1 THR A 10 21.145 0.274 -2.247 1.00 0.41 H ATOM 149 HG21 THR A 10 19.231 1.547 -1.933 1.00 0.66 H ATOM 150 HG22 THR A 10 19.408 3.183 -2.568 1.00 0.71 H ATOM 151 HG23 THR A 10 20.643 2.512 -1.503 1.00 0.57 H ATOM 152 N ARG A 11 18.932 -0.823 -3.929 1.00 0.30 N ATOM 153 CA ARG A 11 17.988 -1.793 -3.408 1.00 0.26 C ATOM 154 C ARG A 11 18.250 -2.027 -1.931 1.00 0.21 C ATOM 155 O ARG A 11 19.401 -2.069 -1.493 1.00 0.22 O ATOM 156 CB ARG A 11 18.060 -3.115 -4.180 1.00 0.32 C ATOM 157 CG ARG A 11 19.466 -3.665 -4.354 1.00 0.40 C ATOM 158 CD ARG A 11 19.439 -5.089 -4.880 1.00 0.55 C ATOM 159 NE ARG A 11 20.643 -5.405 -5.648 1.00 0.68 N ATOM 160 CZ ARG A 11 20.632 -5.814 -6.917 1.00 1.07 C ATOM 161 NH1 ARG A 11 19.481 -6.010 -7.548 1.00 1.36 N1+ ATOM 162 NH2 ARG A 11 21.773 -6.048 -7.553 1.00 1.17 N ATOM 163 H ARG A 11 19.839 -1.112 -4.149 1.00 0.33 H ATOM 164 HA ARG A 11 16.998 -1.377 -3.520 1.00 0.24 H ATOM 165 HB2 ARG A 11 17.473 -3.853 -3.655 1.00 0.31 H ATOM 166 HB3 ARG A 11 17.632 -2.966 -5.162 1.00 0.32 H ATOM 167 HG2 ARG A 11 19.999 -3.046 -5.059 1.00 0.32 H ATOM 168 HG3 ARG A 11 19.973 -3.649 -3.400 1.00 0.47 H ATOM 169 HD2 ARG A 11 19.366 -5.768 -4.044 1.00 0.59 H ATOM 170 HD3 ARG A 11 18.576 -5.206 -5.515 1.00 0.55 H ATOM 171 HE ARG A 11 21.509 -5.288 -5.192 1.00 0.47 H ATOM 172 HH11 ARG A 11 18.611 -5.854 -7.073 1.00 1.28 H ATOM 173 HH12 ARG A 11 19.475 -6.313 -8.503 1.00 1.66 H ATOM 174 HH21 ARG A 11 22.650 -5.918 -7.082 1.00 0.95 H ATOM 175 HH22 ARG A 11 21.761 -6.352 -8.510 1.00 1.47 H ATOM 176 N VAL A 12 17.187 -2.178 -1.171 1.00 0.16 N ATOM 177 CA VAL A 12 17.295 -2.397 0.256 1.00 0.12 C ATOM 178 C VAL A 12 16.729 -3.768 0.618 1.00 0.14 C ATOM 179 O VAL A 12 15.754 -4.227 0.017 1.00 0.18 O ATOM 180 CB VAL A 12 16.571 -1.279 1.050 1.00 0.09 C ATOM 181 CG1 VAL A 12 15.076 -1.279 0.766 1.00 0.08 C ATOM 182 CG2 VAL A 12 16.838 -1.406 2.542 1.00 0.12 C ATOM 183 H VAL A 12 16.295 -2.162 -1.588 1.00 0.16 H ATOM 184 HA VAL A 12 18.344 -2.375 0.516 1.00 0.10 H ATOM 185 HB VAL A 12 16.968 -0.326 0.721 1.00 0.09 H ATOM 186 HG11 VAL A 12 14.573 -0.635 1.472 1.00 0.10 H ATOM 187 HG12 VAL A 12 14.695 -2.285 0.860 1.00 0.11 H ATOM 188 HG13 VAL A 12 14.900 -0.920 -0.238 1.00 0.06 H ATOM 189 HG21 VAL A 12 16.232 -0.690 3.079 1.00 0.15 H ATOM 190 HG22 VAL A 12 17.881 -1.213 2.740 1.00 0.13 H ATOM 191 HG23 VAL A 12 16.589 -2.405 2.867 1.00 0.11 H ATOM 192 N SER A 13 17.360 -4.429 1.573 1.00 0.14 N ATOM 193 CA SER A 13 16.917 -5.741 2.012 1.00 0.17 C ATOM 194 C SER A 13 16.295 -5.636 3.399 1.00 0.12 C ATOM 195 O SER A 13 17.000 -5.518 4.401 1.00 0.15 O ATOM 196 CB SER A 13 18.097 -6.718 2.016 1.00 0.25 C ATOM 197 OG SER A 13 18.810 -6.653 0.789 1.00 0.56 O ATOM 198 H SER A 13 18.139 -4.020 2.008 1.00 0.12 H ATOM 199 HA SER A 13 16.170 -6.090 1.315 1.00 0.20 H ATOM 200 HB2 SER A 13 18.768 -6.464 2.823 1.00 0.18 H ATOM 201 HB3 SER A 13 17.730 -7.725 2.153 1.00 0.35 H ATOM 202 HG SER A 13 18.802 -5.746 0.464 1.00 0.92 H ATOM 203 N VAL A 14 14.974 -5.652 3.449 1.00 0.06 N ATOM 204 CA VAL A 14 14.263 -5.548 4.714 1.00 0.08 C ATOM 205 C VAL A 14 13.755 -6.911 5.153 1.00 0.08 C ATOM 206 O VAL A 14 13.845 -7.884 4.406 1.00 0.12 O ATOM 207 CB VAL A 14 13.076 -4.563 4.640 1.00 0.09 C ATOM 208 CG1 VAL A 14 13.558 -3.157 4.317 1.00 0.10 C ATOM 209 CG2 VAL A 14 12.038 -5.025 3.623 1.00 0.09 C ATOM 210 H VAL A 14 14.462 -5.763 2.617 1.00 0.05 H ATOM 211 HA VAL A 14 14.961 -5.183 5.455 1.00 0.12 H ATOM 212 HB VAL A 14 12.604 -4.538 5.609 1.00 0.13 H ATOM 213 HG11 VAL A 14 14.073 -3.160 3.369 1.00 0.10 H ATOM 214 HG12 VAL A 14 14.232 -2.820 5.092 1.00 0.11 H ATOM 215 HG13 VAL A 14 12.709 -2.489 4.263 1.00 0.11 H ATOM 216 HG21 VAL A 14 12.348 -4.733 2.630 1.00 0.07 H ATOM 217 HG22 VAL A 14 11.084 -4.571 3.850 1.00 0.13 H ATOM 218 HG23 VAL A 14 11.944 -6.100 3.668 1.00 0.09 H ATOM 219 N ARG A 15 13.231 -6.985 6.367 1.00 0.05 N ATOM 220 CA ARG A 15 12.709 -8.234 6.886 1.00 0.05 C ATOM 221 C ARG A 15 11.280 -8.044 7.388 1.00 0.04 C ATOM 222 O ARG A 15 11.027 -7.230 8.276 1.00 0.07 O ATOM 223 CB ARG A 15 13.599 -8.762 8.015 1.00 0.06 C ATOM 224 CG ARG A 15 13.656 -10.280 8.080 1.00 0.06 C ATOM 225 CD ARG A 15 14.290 -10.761 9.373 1.00 0.11 C ATOM 226 NE ARG A 15 13.347 -10.725 10.492 1.00 0.16 N ATOM 227 CZ ARG A 15 13.410 -11.535 11.549 1.00 0.20 C ATOM 228 NH1 ARG A 15 14.370 -12.449 11.633 1.00 0.20 N1+ ATOM 229 NH2 ARG A 15 12.504 -11.439 12.515 1.00 0.26 N ATOM 230 H ARG A 15 13.194 -6.181 6.926 1.00 0.05 H ATOM 231 HA ARG A 15 12.702 -8.949 6.078 1.00 0.04 H ATOM 232 HB2 ARG A 15 14.602 -8.391 7.871 1.00 0.06 H ATOM 233 HB3 ARG A 15 13.221 -8.397 8.960 1.00 0.10 H ATOM 234 HG2 ARG A 15 12.651 -10.672 8.018 1.00 0.06 H ATOM 235 HG3 ARG A 15 14.238 -10.649 7.246 1.00 0.07 H ATOM 236 HD2 ARG A 15 14.630 -11.776 9.235 1.00 0.14 H ATOM 237 HD3 ARG A 15 15.133 -10.127 9.604 1.00 0.10 H ATOM 238 HE ARG A 15 12.622 -10.059 10.447 1.00 0.18 H ATOM 239 HH11 ARG A 15 15.048 -12.536 10.903 1.00 0.19 H ATOM 240 HH12 ARG A 15 14.421 -13.056 12.432 1.00 0.23 H ATOM 241 HH21 ARG A 15 11.767 -10.761 12.455 1.00 0.29 H ATOM 242 HH22 ARG A 15 12.555 -12.044 13.315 1.00 0.29 H ATOM 243 N ILE A 16 10.352 -8.785 6.801 1.00 0.03 N ATOM 244 CA ILE A 16 8.950 -8.717 7.185 1.00 0.04 C ATOM 245 C ILE A 16 8.415 -10.127 7.419 1.00 0.04 C ATOM 246 O ILE A 16 8.646 -11.023 6.604 1.00 0.04 O ATOM 247 CB ILE A 16 8.090 -8.017 6.104 1.00 0.05 C ATOM 248 CG1 ILE A 16 8.661 -6.637 5.776 1.00 0.08 C ATOM 249 CG2 ILE A 16 6.643 -7.898 6.565 1.00 0.06 C ATOM 250 CD1 ILE A 16 8.176 -6.080 4.456 1.00 0.07 C ATOM 251 H ILE A 16 10.619 -9.415 6.091 1.00 0.03 H ATOM 252 HA ILE A 16 8.880 -8.153 8.104 1.00 0.05 H ATOM 253 HB ILE A 16 8.103 -8.621 5.214 1.00 0.05 H ATOM 254 HG12 ILE A 16 8.379 -5.943 6.551 1.00 0.08 H ATOM 255 HG13 ILE A 16 9.738 -6.704 5.732 1.00 0.11 H ATOM 256 HG21 ILE A 16 6.308 -8.849 6.948 1.00 0.07 H ATOM 257 HG22 ILE A 16 6.023 -7.607 5.730 1.00 0.07 H ATOM 258 HG23 ILE A 16 6.575 -7.150 7.342 1.00 0.06 H ATOM 259 HD11 ILE A 16 8.466 -6.746 3.656 1.00 0.13 H ATOM 260 HD12 ILE A 16 8.618 -5.108 4.292 1.00 0.17 H ATOM 261 HD13 ILE A 16 7.102 -5.987 4.476 1.00 0.07 H ATOM 262 N TYR A 17 7.740 -10.325 8.548 1.00 0.08 N ATOM 263 CA TYR A 17 7.160 -11.622 8.898 1.00 0.11 C ATOM 264 C TYR A 17 8.235 -12.699 9.046 1.00 0.19 C ATOM 265 O TYR A 17 7.974 -13.885 8.840 1.00 0.56 O ATOM 266 CB TYR A 17 6.127 -12.044 7.847 1.00 0.04 C ATOM 267 CG TYR A 17 4.763 -12.348 8.425 1.00 0.09 C ATOM 268 CD1 TYR A 17 4.123 -11.443 9.261 1.00 0.18 C ATOM 269 CD2 TYR A 17 4.114 -13.539 8.131 1.00 0.08 C ATOM 270 CE1 TYR A 17 2.875 -11.718 9.789 1.00 0.23 C ATOM 271 CE2 TYR A 17 2.867 -13.822 8.653 1.00 0.12 C ATOM 272 CZ TYR A 17 2.251 -12.907 9.482 1.00 0.20 C ATOM 273 OH TYR A 17 1.006 -13.183 10.007 1.00 0.25 O ATOM 274 H TYR A 17 7.623 -9.571 9.176 1.00 0.09 H ATOM 275 HA TYR A 17 6.660 -11.509 9.846 1.00 0.19 H ATOM 276 HB2 TYR A 17 6.013 -11.247 7.127 1.00 0.09 H ATOM 277 HB3 TYR A 17 6.480 -12.931 7.341 1.00 0.05 H ATOM 278 HD1 TYR A 17 4.613 -10.512 9.498 1.00 0.22 H ATOM 279 HD2 TYR A 17 4.599 -14.252 7.481 1.00 0.08 H ATOM 280 HE1 TYR A 17 2.395 -11.001 10.437 1.00 0.30 H ATOM 281 HE2 TYR A 17 2.379 -14.755 8.413 1.00 0.12 H ATOM 282 HH TYR A 17 0.451 -12.388 9.957 1.00 0.52 H ATOM 283 N GLY A 18 9.442 -12.277 9.401 1.00 0.18 N ATOM 284 CA GLY A 18 10.532 -13.217 9.587 1.00 0.13 C ATOM 285 C GLY A 18 11.231 -13.591 8.293 1.00 0.05 C ATOM 286 O GLY A 18 12.112 -14.450 8.290 1.00 0.11 O ATOM 287 H GLY A 18 9.594 -11.318 9.545 1.00 0.45 H ATOM 288 HA2 GLY A 18 11.258 -12.779 10.258 1.00 0.17 H ATOM 289 HA3 GLY A 18 10.141 -14.115 10.038 1.00 0.15 H ATOM 290 N GLN A 19 10.840 -12.964 7.193 1.00 0.05 N ATOM 291 CA GLN A 19 11.453 -13.246 5.904 1.00 0.10 C ATOM 292 C GLN A 19 12.055 -11.976 5.319 1.00 0.05 C ATOM 293 O GLN A 19 11.554 -10.879 5.551 1.00 0.08 O ATOM 294 CB GLN A 19 10.429 -13.841 4.934 1.00 0.19 C ATOM 295 CG GLN A 19 10.535 -15.351 4.790 1.00 0.14 C ATOM 296 CD GLN A 19 9.675 -15.905 3.668 1.00 0.49 C ATOM 297 OE1 GLN A 19 10.024 -16.902 3.040 1.00 0.68 O ATOM 298 NE2 GLN A 19 8.550 -15.261 3.397 1.00 0.67 N ATOM 299 H GLN A 19 10.125 -12.292 7.249 1.00 0.11 H ATOM 300 HA GLN A 19 12.245 -13.961 6.065 1.00 0.15 H ATOM 301 HB2 GLN A 19 9.436 -13.602 5.287 1.00 0.29 H ATOM 302 HB3 GLN A 19 10.570 -13.397 3.959 1.00 0.36 H ATOM 303 HG2 GLN A 19 11.564 -15.610 4.590 1.00 0.20 H ATOM 304 HG3 GLN A 19 10.226 -15.807 5.720 1.00 0.19 H ATOM 305 HE21 GLN A 19 8.332 -14.464 3.927 1.00 0.63 H ATOM 306 HE22 GLN A 19 7.977 -15.609 2.683 1.00 0.89 H ATOM 307 N ASP A 20 13.139 -12.132 4.576 1.00 0.12 N ATOM 308 CA ASP A 20 13.812 -10.998 3.954 1.00 0.10 C ATOM 309 C ASP A 20 13.172 -10.669 2.611 1.00 0.09 C ATOM 310 O ASP A 20 12.685 -11.559 1.913 1.00 0.10 O ATOM 311 CB ASP A 20 15.305 -11.295 3.762 1.00 0.17 C ATOM 312 CG ASP A 20 15.570 -12.249 2.612 1.00 0.39 C ATOM 313 OD1 ASP A 20 15.546 -13.475 2.838 1.00 0.49 O1- ATOM 314 OD2 ASP A 20 15.805 -11.776 1.478 1.00 0.55 O ATOM 315 H ASP A 20 13.496 -13.035 4.438 1.00 0.19 H ATOM 316 HA ASP A 20 13.703 -10.147 4.609 1.00 0.07 H ATOM 317 HB2 ASP A 20 15.826 -10.371 3.563 1.00 0.29 H ATOM 318 HB3 ASP A 20 15.695 -11.736 4.667 1.00 0.06 H ATOM 319 N TYR A 21 13.147 -9.389 2.270 1.00 0.07 N ATOM 320 CA TYR A 21 12.575 -8.936 1.005 1.00 0.07 C ATOM 321 C TYR A 21 13.434 -7.832 0.395 1.00 0.07 C ATOM 322 O TYR A 21 13.714 -6.823 1.046 1.00 0.16 O ATOM 323 CB TYR A 21 11.141 -8.433 1.206 1.00 0.05 C ATOM 324 CG TYR A 21 10.222 -9.491 1.767 1.00 0.07 C ATOM 325 CD1 TYR A 21 9.670 -10.470 0.951 1.00 0.05 C ATOM 326 CD2 TYR A 21 9.921 -9.520 3.119 1.00 0.15 C ATOM 327 CE1 TYR A 21 8.846 -11.445 1.474 1.00 0.08 C ATOM 328 CE2 TYR A 21 9.098 -10.494 3.645 1.00 0.17 C ATOM 329 CZ TYR A 21 8.565 -11.453 2.823 1.00 0.12 C ATOM 330 OH TYR A 21 7.745 -12.427 3.351 1.00 0.15 O ATOM 331 H TYR A 21 13.513 -8.722 2.896 1.00 0.07 H ATOM 332 HA TYR A 21 12.558 -9.778 0.332 1.00 0.09 H ATOM 333 HB2 TYR A 21 11.150 -7.600 1.893 1.00 0.03 H ATOM 334 HB3 TYR A 21 10.740 -8.110 0.257 1.00 0.07 H ATOM 335 HD1 TYR A 21 9.894 -10.466 -0.106 1.00 0.09 H ATOM 336 HD2 TYR A 21 10.341 -8.759 3.763 1.00 0.21 H ATOM 337 HE1 TYR A 21 8.429 -12.197 0.827 1.00 0.12 H ATOM 338 HE2 TYR A 21 8.883 -10.505 4.702 1.00 0.24 H ATOM 339 HH TYR A 21 7.153 -12.026 3.996 1.00 0.21 H ATOM 340 N THR A 22 13.867 -8.038 -0.841 1.00 0.19 N ATOM 341 CA THR A 22 14.685 -7.064 -1.539 1.00 0.20 C ATOM 342 C THR A 22 13.813 -6.132 -2.374 1.00 0.21 C ATOM 343 O THR A 22 13.152 -6.563 -3.317 1.00 0.38 O ATOM 344 CB THR A 22 15.704 -7.768 -2.452 1.00 0.25 C ATOM 345 OG1 THR A 22 15.975 -9.085 -1.949 1.00 0.19 O ATOM 346 CG2 THR A 22 16.999 -6.977 -2.526 1.00 0.32 C ATOM 347 H THR A 22 13.643 -8.876 -1.295 1.00 0.32 H ATOM 348 HA THR A 22 15.225 -6.484 -0.804 1.00 0.17 H ATOM 349 HB THR A 22 15.286 -7.846 -3.446 1.00 0.29 H ATOM 350 HG1 THR A 22 16.398 -9.018 -1.087 1.00 0.40 H ATOM 351 HG21 THR A 22 16.802 -6.002 -2.946 1.00 0.60 H ATOM 352 HG22 THR A 22 17.707 -7.502 -3.151 1.00 1.03 H ATOM 353 HG23 THR A 22 17.411 -6.865 -1.533 1.00 1.05 H ATOM 354 N ILE A 23 13.802 -4.856 -2.011 1.00 0.16 N ATOM 355 CA ILE A 23 13.007 -3.865 -2.725 1.00 0.16 C ATOM 356 C ILE A 23 13.857 -2.648 -3.073 1.00 0.15 C ATOM 357 O ILE A 23 15.031 -2.584 -2.714 1.00 0.13 O ATOM 358 CB ILE A 23 11.777 -3.419 -1.904 1.00 0.17 C ATOM 359 CG1 ILE A 23 12.198 -3.035 -0.481 1.00 0.05 C ATOM 360 CG2 ILE A 23 10.724 -4.524 -1.883 1.00 0.31 C ATOM 361 CD1 ILE A 23 11.065 -2.520 0.373 1.00 0.06 C ATOM 362 H ILE A 23 14.357 -4.568 -1.252 1.00 0.26 H ATOM 363 HA ILE A 23 12.658 -4.316 -3.643 1.00 0.18 H ATOM 364 HB ILE A 23 11.344 -2.555 -2.387 1.00 0.24 H ATOM 365 HG12 ILE A 23 12.609 -3.903 0.011 1.00 0.15 H ATOM 366 HG13 ILE A 23 12.954 -2.264 -0.531 1.00 0.10 H ATOM 367 HG21 ILE A 23 9.814 -4.151 -1.437 1.00 0.40 H ATOM 368 HG22 ILE A 23 11.090 -5.359 -1.304 1.00 0.33 H ATOM 369 HG23 ILE A 23 10.522 -4.849 -2.893 1.00 0.33 H ATOM 370 HD11 ILE A 23 10.521 -3.358 0.783 1.00 0.07 H ATOM 371 HD12 ILE A 23 10.401 -1.918 -0.232 1.00 0.10 H ATOM 372 HD13 ILE A 23 11.465 -1.922 1.178 1.00 0.14 H ATOM 373 N VAL A 24 13.263 -1.687 -3.762 1.00 0.16 N ATOM 374 CA VAL A 24 13.975 -0.482 -4.164 1.00 0.15 C ATOM 375 C VAL A 24 13.727 0.656 -3.177 1.00 0.15 C ATOM 376 O VAL A 24 12.580 0.967 -2.854 1.00 0.15 O ATOM 377 CB VAL A 24 13.555 -0.029 -5.583 1.00 0.17 C ATOM 378 CG1 VAL A 24 14.247 1.271 -5.974 1.00 0.17 C ATOM 379 CG2 VAL A 24 13.856 -1.118 -6.602 1.00 0.18 C ATOM 380 H VAL A 24 12.317 -1.782 -3.995 1.00 0.18 H ATOM 381 HA VAL A 24 15.030 -0.709 -4.181 1.00 0.14 H ATOM 382 HB VAL A 24 12.489 0.143 -5.579 1.00 0.19 H ATOM 383 HG11 VAL A 24 13.950 1.550 -6.975 1.00 0.18 H ATOM 384 HG12 VAL A 24 15.318 1.133 -5.939 1.00 0.15 H ATOM 385 HG13 VAL A 24 13.962 2.050 -5.284 1.00 0.17 H ATOM 386 HG21 VAL A 24 13.610 -0.763 -7.592 1.00 1.06 H ATOM 387 HG22 VAL A 24 13.268 -1.996 -6.378 1.00 0.83 H ATOM 388 HG23 VAL A 24 14.907 -1.369 -6.560 1.00 0.80 H ATOM 389 N GLY A 25 14.806 1.270 -2.703 1.00 0.14 N ATOM 390 CA GLY A 25 14.691 2.368 -1.765 1.00 0.13 C ATOM 391 C GLY A 25 15.420 3.600 -2.259 1.00 0.11 C ATOM 392 O GLY A 25 16.576 3.829 -1.907 1.00 0.08 O ATOM 393 H GLY A 25 15.697 0.980 -3.005 1.00 0.14 H ATOM 394 HA2 GLY A 25 13.647 2.607 -1.626 1.00 0.16 H ATOM 395 HA3 GLY A 25 15.113 2.068 -0.817 1.00 0.11 H ATOM 396 N ALA A 26 14.739 4.398 -3.072 1.00 0.15 N ATOM 397 CA ALA A 26 15.335 5.603 -3.640 1.00 0.17 C ATOM 398 C ALA A 26 14.840 6.872 -2.952 1.00 0.12 C ATOM 399 O ALA A 26 15.094 7.982 -3.428 1.00 0.19 O ATOM 400 CB ALA A 26 15.045 5.670 -5.131 1.00 0.27 C ATOM 401 H ALA A 26 13.815 4.169 -3.299 1.00 0.18 H ATOM 402 HA ALA A 26 16.404 5.534 -3.515 1.00 0.19 H ATOM 403 HB1 ALA A 26 15.347 4.745 -5.598 1.00 0.54 H ATOM 404 HB2 ALA A 26 15.595 6.490 -5.569 1.00 0.34 H ATOM 405 HB3 ALA A 26 13.987 5.823 -5.285 1.00 0.79 H ATOM 406 N GLU A 27 14.136 6.719 -1.839 1.00 0.11 N ATOM 407 CA GLU A 27 13.627 7.874 -1.117 1.00 0.05 C ATOM 408 C GLU A 27 14.514 8.181 0.101 1.00 0.10 C ATOM 409 O GLU A 27 15.439 8.985 -0.002 1.00 0.20 O ATOM 410 CB GLU A 27 12.148 7.668 -0.742 1.00 0.11 C ATOM 411 CG GLU A 27 11.516 8.860 -0.038 1.00 0.78 C ATOM 412 CD GLU A 27 11.140 8.551 1.392 1.00 1.22 C ATOM 413 OE1 GLU A 27 10.599 7.456 1.643 1.00 1.58 O1- ATOM 414 OE2 GLU A 27 11.393 9.396 2.277 1.00 1.46 O ATOM 415 H GLU A 27 13.964 5.820 -1.498 1.00 0.19 H ATOM 416 HA GLU A 27 13.693 8.718 -1.789 1.00 0.05 H ATOM 417 HB2 GLU A 27 11.589 7.489 -1.650 1.00 0.41 H ATOM 418 HB3 GLU A 27 12.051 6.805 -0.105 1.00 0.47 H ATOM 419 HG2 GLU A 27 12.220 9.678 -0.041 1.00 0.86 H ATOM 420 HG3 GLU A 27 10.626 9.148 -0.577 1.00 1.08 H ATOM 421 N SER A 28 14.268 7.531 1.237 1.00 0.11 N ATOM 422 CA SER A 28 15.068 7.763 2.434 1.00 0.17 C ATOM 423 C SER A 28 15.328 6.444 3.163 1.00 0.18 C ATOM 424 O SER A 28 14.386 5.717 3.491 1.00 0.15 O ATOM 425 CB SER A 28 14.363 8.755 3.365 1.00 0.18 C ATOM 426 OG SER A 28 13.932 9.912 2.664 1.00 0.26 O ATOM 427 H SER A 28 13.535 6.889 1.278 1.00 0.15 H ATOM 428 HA SER A 28 16.010 8.181 2.123 1.00 0.23 H ATOM 429 HB2 SER A 28 13.502 8.278 3.810 1.00 0.18 H ATOM 430 HB3 SER A 28 15.046 9.058 4.146 1.00 0.19 H ATOM 431 HG SER A 28 12.977 9.830 2.473 1.00 0.55 H ATOM 432 N PRO A 29 16.610 6.116 3.413 1.00 0.23 N ATOM 433 CA PRO A 29 17.016 4.875 4.096 1.00 0.26 C ATOM 434 C PRO A 29 16.254 4.598 5.395 1.00 0.28 C ATOM 435 O PRO A 29 15.813 3.474 5.632 1.00 0.34 O ATOM 436 CB PRO A 29 18.498 5.107 4.392 1.00 0.31 C ATOM 437 CG PRO A 29 18.951 6.037 3.324 1.00 0.31 C ATOM 438 CD PRO A 29 17.780 6.935 3.031 1.00 0.25 C ATOM 439 HA PRO A 29 16.914 4.021 3.441 1.00 0.25 H ATOM 440 HB2 PRO A 29 18.607 5.544 5.373 1.00 0.35 H ATOM 441 HB3 PRO A 29 19.028 4.167 4.347 1.00 0.32 H ATOM 442 HG2 PRO A 29 19.788 6.621 3.676 1.00 0.34 H ATOM 443 HG3 PRO A 29 19.225 5.479 2.441 1.00 0.34 H ATOM 444 HD2 PRO A 29 17.836 7.834 3.627 1.00 0.26 H ATOM 445 HD3 PRO A 29 17.751 7.180 1.981 1.00 0.22 H ATOM 446 N ALA A 30 16.095 5.616 6.231 1.00 0.27 N ATOM 447 CA ALA A 30 15.389 5.453 7.498 1.00 0.30 C ATOM 448 C ALA A 30 13.890 5.282 7.278 1.00 0.18 C ATOM 449 O ALA A 30 13.231 4.507 7.973 1.00 0.15 O ATOM 450 CB ALA A 30 15.654 6.644 8.409 1.00 0.41 C ATOM 451 H ALA A 30 16.466 6.495 5.994 1.00 0.28 H ATOM 452 HA ALA A 30 15.774 4.567 7.981 1.00 0.37 H ATOM 453 HB1 ALA A 30 15.188 6.475 9.368 1.00 0.43 H ATOM 454 HB2 ALA A 30 15.243 7.539 7.963 1.00 0.40 H ATOM 455 HB3 ALA A 30 16.719 6.766 8.543 1.00 0.50 H ATOM 456 N HIS A 31 13.364 5.985 6.283 1.00 0.13 N ATOM 457 CA HIS A 31 11.939 5.936 5.973 1.00 0.10 C ATOM 458 C HIS A 31 11.548 4.579 5.390 1.00 0.09 C ATOM 459 O HIS A 31 10.539 4.000 5.783 1.00 0.19 O ATOM 460 CB HIS A 31 11.577 7.061 5.002 1.00 0.21 C ATOM 461 CG HIS A 31 10.138 7.480 5.049 1.00 0.05 C ATOM 462 ND1 HIS A 31 9.373 7.664 3.921 1.00 0.28 N ATOM 463 CD2 HIS A 31 9.338 7.791 6.095 1.00 0.12 C ATOM 464 CE1 HIS A 31 8.168 8.072 4.267 1.00 0.41 C ATOM 465 NE2 HIS A 31 8.115 8.159 5.584 1.00 0.32 N ATOM 466 H HIS A 31 13.951 6.547 5.737 1.00 0.18 H ATOM 467 HA HIS A 31 11.397 6.083 6.895 1.00 0.12 H ATOM 468 HB2 HIS A 31 12.176 7.928 5.233 1.00 0.39 H ATOM 469 HB3 HIS A 31 11.796 6.740 3.994 1.00 0.40 H ATOM 470 HD1 HIS A 31 9.687 7.535 2.983 1.00 0.37 H ATOM 471 HD2 HIS A 31 9.608 7.753 7.141 1.00 0.21 H ATOM 472 HE1 HIS A 31 7.358 8.296 3.588 1.00 0.60 H ATOM 473 HE2 HIS A 31 7.452 8.694 6.074 1.00 0.54 H ATOM 474 N ILE A 32 12.362 4.065 4.469 1.00 0.08 N ATOM 475 CA ILE A 32 12.089 2.769 3.840 1.00 0.20 C ATOM 476 C ILE A 32 12.231 1.633 4.850 1.00 0.27 C ATOM 477 O ILE A 32 11.672 0.550 4.676 1.00 0.36 O ATOM 478 CB ILE A 32 13.006 2.507 2.617 1.00 0.23 C ATOM 479 CG1 ILE A 32 14.477 2.386 3.052 1.00 0.25 C ATOM 480 CG2 ILE A 32 12.823 3.614 1.582 1.00 0.18 C ATOM 481 CD1 ILE A 32 15.448 2.141 1.917 1.00 0.30 C ATOM 482 H ILE A 32 13.159 4.572 4.197 1.00 0.03 H ATOM 483 HA ILE A 32 11.065 2.787 3.493 1.00 0.25 H ATOM 484 HB ILE A 32 12.695 1.577 2.161 1.00 0.32 H ATOM 485 HG12 ILE A 32 14.776 3.296 3.542 1.00 0.20 H ATOM 486 HG13 ILE A 32 14.568 1.564 3.746 1.00 0.32 H ATOM 487 HG21 ILE A 32 13.269 4.527 1.950 1.00 0.66 H ATOM 488 HG22 ILE A 32 11.768 3.775 1.412 1.00 0.55 H ATOM 489 HG23 ILE A 32 13.296 3.328 0.655 1.00 0.78 H ATOM 490 HD11 ILE A 32 16.403 1.843 2.322 1.00 0.09 H ATOM 491 HD12 ILE A 32 15.571 3.047 1.344 1.00 0.48 H ATOM 492 HD13 ILE A 32 15.069 1.358 1.278 1.00 0.47 H ATOM 493 N ARG A 33 12.967 1.897 5.923 1.00 0.25 N ATOM 494 CA ARG A 33 13.168 0.910 6.973 1.00 0.32 C ATOM 495 C ARG A 33 11.918 0.827 7.842 1.00 0.34 C ATOM 496 O ARG A 33 11.661 -0.183 8.499 1.00 0.57 O ATOM 497 CB ARG A 33 14.382 1.279 7.831 1.00 0.34 C ATOM 498 CG ARG A 33 15.169 0.074 8.317 1.00 0.38 C ATOM 499 CD ARG A 33 16.088 -0.464 7.229 1.00 0.37 C ATOM 500 NE ARG A 33 16.587 -1.800 7.542 1.00 0.36 N ATOM 501 CZ ARG A 33 17.374 -2.515 6.735 1.00 0.68 C ATOM 502 NH1 ARG A 33 17.828 -1.990 5.603 1.00 1.01 N1+ ATOM 503 NH2 ARG A 33 17.730 -3.746 7.077 1.00 0.84 N ATOM 504 H ARG A 33 13.389 2.777 6.006 1.00 0.20 H ATOM 505 HA ARG A 33 13.338 -0.049 6.507 1.00 0.36 H ATOM 506 HB2 ARG A 33 15.044 1.905 7.251 1.00 0.30 H ATOM 507 HB3 ARG A 33 14.042 1.832 8.695 1.00 0.38 H ATOM 508 HG2 ARG A 33 15.765 0.364 9.170 1.00 0.40 H ATOM 509 HG3 ARG A 33 14.477 -0.703 8.607 1.00 0.42 H ATOM 510 HD2 ARG A 33 15.538 -0.505 6.300 1.00 0.46 H ATOM 511 HD3 ARG A 33 16.927 0.207 7.120 1.00 0.38 H ATOM 512 HE ARG A 33 16.304 -2.197 8.398 1.00 0.47 H ATOM 513 HH11 ARG A 33 17.584 -1.051 5.346 1.00 0.89 H ATOM 514 HH12 ARG A 33 18.421 -2.531 4.998 1.00 1.42 H ATOM 515 HH21 ARG A 33 17.411 -4.142 7.942 1.00 0.63 H ATOM 516 HH22 ARG A 33 18.317 -4.291 6.468 1.00 1.22 H ATOM 517 N LEU A 34 11.138 1.900 7.821 1.00 0.14 N ATOM 518 CA LEU A 34 9.906 1.985 8.596 1.00 0.15 C ATOM 519 C LEU A 34 8.762 1.283 7.866 1.00 0.16 C ATOM 520 O LEU A 34 7.827 0.780 8.490 1.00 0.17 O ATOM 521 CB LEU A 34 9.546 3.453 8.842 1.00 0.13 C ATOM 522 CG LEU A 34 8.427 3.693 9.855 1.00 0.07 C ATOM 523 CD1 LEU A 34 8.981 3.693 11.271 1.00 0.12 C ATOM 524 CD2 LEU A 34 7.713 5.002 9.556 1.00 0.04 C ATOM 525 H LEU A 34 11.398 2.661 7.261 1.00 0.18 H ATOM 526 HA LEU A 34 10.073 1.496 9.544 1.00 0.17 H ATOM 527 HB2 LEU A 34 10.432 3.965 9.187 1.00 0.16 H ATOM 528 HB3 LEU A 34 9.246 3.889 7.901 1.00 0.13 H ATOM 529 HG LEU A 34 7.705 2.893 9.780 1.00 0.05 H ATOM 530 HD11 LEU A 34 9.448 2.742 11.475 1.00 0.16 H ATOM 531 HD12 LEU A 34 8.175 3.858 11.972 1.00 0.14 H ATOM 532 HD13 LEU A 34 9.712 4.481 11.370 1.00 0.11 H ATOM 533 HD21 LEU A 34 8.439 5.798 9.479 1.00 0.02 H ATOM 534 HD22 LEU A 34 7.020 5.222 10.354 1.00 0.06 H ATOM 535 HD23 LEU A 34 7.175 4.914 8.625 1.00 0.05 H ATOM 536 N VAL A 35 8.855 1.248 6.541 1.00 0.16 N ATOM 537 CA VAL A 35 7.838 0.613 5.707 1.00 0.16 C ATOM 538 C VAL A 35 7.665 -0.855 6.086 1.00 0.13 C ATOM 539 O VAL A 35 6.545 -1.356 6.193 1.00 0.12 O ATOM 540 CB VAL A 35 8.205 0.698 4.209 1.00 0.20 C ATOM 541 CG1 VAL A 35 7.078 0.144 3.354 1.00 0.18 C ATOM 542 CG2 VAL A 35 8.531 2.129 3.805 1.00 0.25 C ATOM 543 H VAL A 35 9.634 1.662 6.110 1.00 0.15 H ATOM 544 HA VAL A 35 6.904 1.130 5.863 1.00 0.17 H ATOM 545 HB VAL A 35 9.083 0.091 4.041 1.00 0.20 H ATOM 546 HG11 VAL A 35 7.315 0.286 2.310 1.00 0.20 H ATOM 547 HG12 VAL A 35 6.159 0.660 3.589 1.00 0.13 H ATOM 548 HG13 VAL A 35 6.961 -0.910 3.556 1.00 0.23 H ATOM 549 HG21 VAL A 35 9.165 2.581 4.553 1.00 0.26 H ATOM 550 HG22 VAL A 35 7.619 2.695 3.715 1.00 0.25 H ATOM 551 HG23 VAL A 35 9.044 2.126 2.854 1.00 0.27 H ATOM 552 N ALA A 36 8.786 -1.527 6.303 1.00 0.14 N ATOM 553 CA ALA A 36 8.779 -2.936 6.672 1.00 0.15 C ATOM 554 C ALA A 36 7.980 -3.174 7.949 1.00 0.12 C ATOM 555 O ALA A 36 7.193 -4.113 8.030 1.00 0.11 O ATOM 556 CB ALA A 36 10.203 -3.432 6.840 1.00 0.18 C ATOM 557 H ALA A 36 9.645 -1.063 6.208 1.00 0.15 H ATOM 558 HA ALA A 36 8.322 -3.490 5.865 1.00 0.16 H ATOM 559 HB1 ALA A 36 10.194 -4.498 7.018 1.00 0.19 H ATOM 560 HB2 ALA A 36 10.661 -2.929 7.677 1.00 0.18 H ATOM 561 HB3 ALA A 36 10.762 -3.220 5.941 1.00 0.21 H ATOM 562 N ALA A 37 8.171 -2.303 8.931 1.00 0.13 N ATOM 563 CA ALA A 37 7.479 -2.421 10.206 1.00 0.11 C ATOM 564 C ALA A 37 5.978 -2.192 10.047 1.00 0.14 C ATOM 565 O ALA A 37 5.170 -2.837 10.713 1.00 0.20 O ATOM 566 CB ALA A 37 8.062 -1.442 11.212 1.00 0.13 C ATOM 567 H ALA A 37 8.791 -1.558 8.792 1.00 0.16 H ATOM 568 HA ALA A 37 7.640 -3.421 10.580 1.00 0.10 H ATOM 569 HB1 ALA A 37 7.917 -0.433 10.857 1.00 0.15 H ATOM 570 HB2 ALA A 37 9.118 -1.634 11.328 1.00 0.11 H ATOM 571 HB3 ALA A 37 7.567 -1.565 12.163 1.00 0.14 H ATOM 572 N PHE A 38 5.614 -1.280 9.151 1.00 0.15 N ATOM 573 CA PHE A 38 4.212 -0.967 8.905 1.00 0.21 C ATOM 574 C PHE A 38 3.485 -2.175 8.318 1.00 0.21 C ATOM 575 O PHE A 38 2.383 -2.523 8.746 1.00 0.28 O ATOM 576 CB PHE A 38 4.093 0.228 7.955 1.00 0.26 C ATOM 577 CG PHE A 38 2.737 0.877 7.965 1.00 0.34 C ATOM 578 CD1 PHE A 38 2.441 1.867 8.887 1.00 0.41 C ATOM 579 CD2 PHE A 38 1.766 0.502 7.051 1.00 0.35 C ATOM 580 CE1 PHE A 38 1.199 2.470 8.900 1.00 0.50 C ATOM 581 CE2 PHE A 38 0.521 1.102 7.059 1.00 0.43 C ATOM 582 CZ PHE A 38 0.238 2.088 7.984 1.00 0.50 C ATOM 583 H PHE A 38 6.308 -0.806 8.643 1.00 0.15 H ATOM 584 HA PHE A 38 3.757 -0.712 9.851 1.00 0.23 H ATOM 585 HB2 PHE A 38 4.821 0.975 8.235 1.00 0.28 H ATOM 586 HB3 PHE A 38 4.295 -0.103 6.948 1.00 0.23 H ATOM 587 HD1 PHE A 38 3.192 2.167 9.602 1.00 0.41 H ATOM 588 HD2 PHE A 38 1.986 -0.271 6.328 1.00 0.30 H ATOM 589 HE1 PHE A 38 0.980 3.242 9.623 1.00 0.56 H ATOM 590 HE2 PHE A 38 -0.229 0.802 6.341 1.00 0.43 H ATOM 591 HZ PHE A 38 -0.735 2.558 7.993 1.00 0.56 H ATOM 592 N VAL A 39 4.118 -2.816 7.343 1.00 0.16 N ATOM 593 CA VAL A 39 3.534 -3.985 6.696 1.00 0.17 C ATOM 594 C VAL A 39 3.522 -5.177 7.647 1.00 0.16 C ATOM 595 O VAL A 39 2.521 -5.888 7.751 1.00 0.18 O ATOM 596 CB VAL A 39 4.298 -4.355 5.407 1.00 0.15 C ATOM 597 CG1 VAL A 39 3.653 -5.550 4.716 1.00 0.17 C ATOM 598 CG2 VAL A 39 4.354 -3.160 4.470 1.00 0.15 C ATOM 599 H VAL A 39 4.999 -2.493 7.050 1.00 0.15 H ATOM 600 HA VAL A 39 2.517 -3.743 6.429 1.00 0.21 H ATOM 601 HB VAL A 39 5.309 -4.625 5.675 1.00 0.13 H ATOM 602 HG11 VAL A 39 3.641 -6.391 5.390 1.00 0.20 H ATOM 603 HG12 VAL A 39 4.222 -5.805 3.834 1.00 0.16 H ATOM 604 HG13 VAL A 39 2.642 -5.302 4.432 1.00 0.18 H ATOM 605 HG21 VAL A 39 3.669 -3.314 3.649 1.00 0.74 H ATOM 606 HG22 VAL A 39 5.356 -3.047 4.090 1.00 0.90 H ATOM 607 HG23 VAL A 39 4.072 -2.267 5.009 1.00 0.96 H ATOM 608 N ASP A 40 4.633 -5.376 8.352 1.00 0.12 N ATOM 609 CA ASP A 40 4.758 -6.475 9.308 1.00 0.11 C ATOM 610 C ASP A 40 3.659 -6.397 10.361 1.00 0.12 C ATOM 611 O ASP A 40 3.113 -7.417 10.788 1.00 0.13 O ATOM 612 CB ASP A 40 6.135 -6.438 9.979 1.00 0.09 C ATOM 613 CG ASP A 40 6.343 -7.564 10.972 1.00 0.09 C ATOM 614 OD1 ASP A 40 5.915 -7.419 12.137 1.00 1.03 O ATOM 615 OD2 ASP A 40 6.950 -8.592 10.601 1.00 1.14 O1- ATOM 616 H ASP A 40 5.398 -4.771 8.220 1.00 0.10 H ATOM 617 HA ASP A 40 4.655 -7.403 8.764 1.00 0.12 H ATOM 618 HB2 ASP A 40 6.900 -6.509 9.221 1.00 0.13 H ATOM 619 HB3 ASP A 40 6.244 -5.499 10.501 1.00 0.15 H ATOM 620 N ASP A 41 3.334 -5.174 10.763 1.00 0.12 N ATOM 621 CA ASP A 41 2.300 -4.933 11.760 1.00 0.13 C ATOM 622 C ASP A 41 0.928 -5.321 11.222 1.00 0.09 C ATOM 623 O ASP A 41 0.175 -6.051 11.869 1.00 0.07 O ATOM 624 CB ASP A 41 2.297 -3.458 12.160 1.00 0.16 C ATOM 625 CG ASP A 41 1.439 -3.187 13.375 1.00 0.13 C ATOM 626 OD1 ASP A 41 1.968 -3.269 14.507 1.00 0.22 O ATOM 627 OD2 ASP A 41 0.241 -2.868 13.207 1.00 0.12 O1- ATOM 628 H ASP A 41 3.814 -4.405 10.381 1.00 0.11 H ATOM 629 HA ASP A 41 2.523 -5.535 12.629 1.00 0.16 H ATOM 630 HB2 ASP A 41 3.308 -3.150 12.383 1.00 0.25 H ATOM 631 HB3 ASP A 41 1.920 -2.870 11.337 1.00 0.25 H ATOM 632 N LYS A 42 0.618 -4.837 10.025 1.00 0.10 N ATOM 633 CA LYS A 42 -0.660 -5.120 9.385 1.00 0.11 C ATOM 634 C LYS A 42 -0.855 -6.620 9.178 1.00 0.03 C ATOM 635 O LYS A 42 -1.938 -7.155 9.423 1.00 0.07 O ATOM 636 CB LYS A 42 -0.756 -4.394 8.041 1.00 0.19 C ATOM 637 CG LYS A 42 -1.092 -2.914 8.163 1.00 0.26 C ATOM 638 CD LYS A 42 -2.441 -2.592 7.535 1.00 0.28 C ATOM 639 CE LYS A 42 -3.591 -3.227 8.305 1.00 0.31 C ATOM 640 NZ LYS A 42 -3.929 -2.474 9.543 1.00 0.38 N1+ ATOM 641 H LYS A 42 1.271 -4.271 9.558 1.00 0.11 H ATOM 642 HA LYS A 42 -1.440 -4.755 10.034 1.00 0.15 H ATOM 643 HB2 LYS A 42 0.193 -4.482 7.531 1.00 0.24 H ATOM 644 HB3 LYS A 42 -1.520 -4.867 7.444 1.00 0.19 H ATOM 645 HG2 LYS A 42 -1.122 -2.645 9.208 1.00 0.32 H ATOM 646 HG3 LYS A 42 -0.327 -2.339 7.662 1.00 0.26 H ATOM 647 HD2 LYS A 42 -2.577 -1.521 7.527 1.00 0.31 H ATOM 648 HD3 LYS A 42 -2.452 -2.964 6.521 1.00 0.25 H ATOM 649 HE2 LYS A 42 -4.461 -3.257 7.666 1.00 0.32 H ATOM 650 HE3 LYS A 42 -3.310 -4.234 8.575 1.00 0.29 H ATOM 651 HZ1 LYS A 42 -4.484 -3.078 10.192 1.00 0.37 H ATOM 652 HZ2 LYS A 42 -4.490 -1.630 9.307 1.00 0.41 H ATOM 653 HZ3 LYS A 42 -3.061 -2.170 10.025 1.00 0.41 H ATOM 654 N MET A 43 0.202 -7.293 8.748 1.00 0.07 N ATOM 655 CA MET A 43 0.149 -8.732 8.500 1.00 0.12 C ATOM 656 C MET A 43 0.068 -9.529 9.799 1.00 0.16 C ATOM 657 O MET A 43 -0.172 -10.731 9.774 1.00 0.35 O ATOM 658 CB MET A 43 1.376 -9.181 7.706 1.00 0.18 C ATOM 659 CG MET A 43 1.335 -8.789 6.240 1.00 0.16 C ATOM 660 SD MET A 43 2.679 -9.524 5.294 1.00 0.26 S ATOM 661 CE MET A 43 2.254 -11.263 5.385 1.00 0.29 C ATOM 662 H MET A 43 1.045 -6.810 8.582 1.00 0.11 H ATOM 663 HA MET A 43 -0.734 -8.935 7.917 1.00 0.11 H ATOM 664 HB2 MET A 43 2.258 -8.738 8.147 1.00 0.21 H ATOM 665 HB3 MET A 43 1.456 -10.255 7.767 1.00 0.23 H ATOM 666 HG2 MET A 43 0.397 -9.117 5.817 1.00 0.11 H ATOM 667 HG3 MET A 43 1.407 -7.714 6.167 1.00 0.16 H ATOM 668 HE1 MET A 43 1.247 -11.406 5.020 1.00 0.39 H ATOM 669 HE2 MET A 43 2.318 -11.597 6.409 1.00 0.33 H ATOM 670 HE3 MET A 43 2.941 -11.835 4.779 1.00 0.23 H ATOM 671 N HIS A 44 0.263 -8.864 10.928 1.00 0.02 N ATOM 672 CA HIS A 44 0.220 -9.535 12.220 1.00 0.04 C ATOM 673 C HIS A 44 -1.149 -9.399 12.886 1.00 0.05 C ATOM 674 O HIS A 44 -1.488 -10.177 13.778 1.00 0.20 O ATOM 675 CB HIS A 44 1.311 -8.981 13.143 1.00 0.08 C ATOM 676 CG HIS A 44 2.532 -9.845 13.211 1.00 0.11 C ATOM 677 ND1 HIS A 44 3.748 -9.491 12.660 1.00 0.27 N ATOM 678 CD2 HIS A 44 2.721 -11.062 13.771 1.00 0.29 C ATOM 679 CE1 HIS A 44 4.627 -10.453 12.878 1.00 0.38 C ATOM 680 NE2 HIS A 44 4.028 -11.418 13.547 1.00 0.40 N ATOM 681 H HIS A 44 0.443 -7.898 10.893 1.00 0.13 H ATOM 682 HA HIS A 44 0.415 -10.582 12.049 1.00 0.06 H ATOM 683 HB2 HIS A 44 1.614 -8.007 12.787 1.00 0.20 H ATOM 684 HB3 HIS A 44 0.912 -8.884 14.142 1.00 0.22 H ATOM 685 HD1 HIS A 44 3.944 -8.647 12.185 1.00 0.35 H ATOM 686 HD2 HIS A 44 1.978 -11.648 14.292 1.00 0.39 H ATOM 687 HE1 HIS A 44 5.659 -10.452 12.560 1.00 0.51 H ATOM 688 HE2 HIS A 44 4.429 -12.287 13.773 1.00 0.51 H ATOM 689 N GLU A 45 -1.938 -8.423 12.453 1.00 0.16 N ATOM 690 CA GLU A 45 -3.262 -8.214 13.037 1.00 0.15 C ATOM 691 C GLU A 45 -4.364 -8.863 12.197 1.00 0.15 C ATOM 692 O GLU A 45 -5.338 -9.388 12.739 1.00 0.17 O ATOM 693 CB GLU A 45 -3.555 -6.717 13.221 1.00 0.12 C ATOM 694 CG GLU A 45 -3.299 -5.871 11.978 1.00 0.09 C ATOM 695 CD GLU A 45 -4.034 -4.547 11.998 1.00 0.12 C ATOM 696 OE1 GLU A 45 -3.633 -3.644 12.761 1.00 0.16 O ATOM 697 OE2 GLU A 45 -5.007 -4.391 11.225 1.00 0.21 O1- ATOM 698 H GLU A 45 -1.625 -7.830 11.737 1.00 0.30 H ATOM 699 HA GLU A 45 -3.258 -8.684 14.009 1.00 0.17 H ATOM 700 HB2 GLU A 45 -4.593 -6.600 13.499 1.00 0.11 H ATOM 701 HB3 GLU A 45 -2.938 -6.339 14.023 1.00 0.14 H ATOM 702 HG2 GLU A 45 -2.239 -5.673 11.903 1.00 0.06 H ATOM 703 HG3 GLU A 45 -3.618 -6.426 11.109 1.00 0.14 H ATOM 704 N PHE A 46 -4.195 -8.863 10.880 1.00 0.15 N ATOM 705 CA PHE A 46 -5.210 -9.426 9.991 1.00 0.14 C ATOM 706 C PHE A 46 -5.106 -10.943 9.893 1.00 0.16 C ATOM 707 O PHE A 46 -6.038 -11.610 9.439 1.00 0.17 O ATOM 708 CB PHE A 46 -5.120 -8.799 8.601 1.00 0.14 C ATOM 709 CG PHE A 46 -6.087 -7.666 8.400 1.00 0.15 C ATOM 710 CD1 PHE A 46 -7.440 -7.918 8.232 1.00 0.18 C ATOM 711 CD2 PHE A 46 -5.645 -6.354 8.380 1.00 0.13 C ATOM 712 CE1 PHE A 46 -8.335 -6.879 8.051 1.00 0.19 C ATOM 713 CE2 PHE A 46 -6.537 -5.312 8.199 1.00 0.14 C ATOM 714 CZ PHE A 46 -7.882 -5.575 8.032 1.00 0.17 C ATOM 715 H PHE A 46 -3.373 -8.489 10.499 1.00 0.18 H ATOM 716 HA PHE A 46 -6.172 -9.181 10.413 1.00 0.14 H ATOM 717 HB2 PHE A 46 -4.122 -8.418 8.446 1.00 0.14 H ATOM 718 HB3 PHE A 46 -5.332 -9.555 7.860 1.00 0.15 H ATOM 719 HD1 PHE A 46 -7.794 -8.938 8.247 1.00 0.20 H ATOM 720 HD2 PHE A 46 -4.593 -6.145 8.508 1.00 0.10 H ATOM 721 HE1 PHE A 46 -9.387 -7.089 7.921 1.00 0.21 H ATOM 722 HE2 PHE A 46 -6.180 -4.293 8.186 1.00 0.12 H ATOM 723 HZ PHE A 46 -8.578 -4.760 7.890 1.00 0.18 H ATOM 724 N SER A 47 -3.982 -11.490 10.328 1.00 0.21 N ATOM 725 CA SER A 47 -3.773 -12.930 10.289 1.00 0.23 C ATOM 726 C SER A 47 -4.699 -13.630 11.276 1.00 0.21 C ATOM 727 O SER A 47 -5.078 -14.787 11.082 1.00 0.32 O ATOM 728 CB SER A 47 -2.315 -13.243 10.617 1.00 0.25 C ATOM 729 OG SER A 47 -1.780 -12.269 11.498 1.00 0.76 O ATOM 730 H SER A 47 -3.271 -10.916 10.682 1.00 0.25 H ATOM 731 HA SER A 47 -3.995 -13.277 9.292 1.00 0.24 H ATOM 732 HB2 SER A 47 -2.252 -14.214 11.085 1.00 0.48 H ATOM 733 HB3 SER A 47 -1.736 -13.245 9.705 1.00 0.78 H ATOM 734 HG SER A 47 -1.472 -12.701 12.304 1.00 0.84 H ATOM 735 N GLU A 48 -5.102 -12.895 12.303 1.00 0.09 N ATOM 736 CA GLU A 48 -5.971 -13.431 13.339 1.00 0.08 C ATOM 737 C GLU A 48 -7.419 -13.466 12.857 1.00 0.10 C ATOM 738 O GLU A 48 -8.279 -14.070 13.493 1.00 0.07 O ATOM 739 CB GLU A 48 -5.867 -12.593 14.617 1.00 0.11 C ATOM 740 CG GLU A 48 -4.439 -12.281 15.055 1.00 0.06 C ATOM 741 CD GLU A 48 -3.675 -13.499 15.526 1.00 0.28 C ATOM 742 OE1 GLU A 48 -3.186 -14.273 14.677 1.00 0.61 O ATOM 743 OE2 GLU A 48 -3.528 -13.667 16.752 1.00 0.49 O1- ATOM 744 H GLU A 48 -4.818 -11.961 12.353 1.00 0.09 H ATOM 745 HA GLU A 48 -5.651 -14.439 13.552 1.00 0.09 H ATOM 746 HB2 GLU A 48 -6.379 -11.657 14.458 1.00 0.19 H ATOM 747 HB3 GLU A 48 -6.356 -13.125 15.419 1.00 0.20 H ATOM 748 HG2 GLU A 48 -3.903 -11.844 14.229 1.00 0.23 H ATOM 749 HG3 GLU A 48 -4.479 -11.569 15.866 1.00 0.30 H ATOM 750 N LYS A 49 -7.680 -12.808 11.729 1.00 0.14 N ATOM 751 CA LYS A 49 -9.021 -12.768 11.155 1.00 0.18 C ATOM 752 C LYS A 49 -9.335 -14.080 10.447 1.00 0.27 C ATOM 753 O LYS A 49 -10.480 -14.531 10.441 1.00 0.38 O ATOM 754 CB LYS A 49 -9.154 -11.602 10.171 1.00 0.12 C ATOM 755 CG LYS A 49 -9.158 -10.230 10.833 1.00 0.20 C ATOM 756 CD LYS A 49 -10.437 -9.995 11.623 1.00 0.43 C ATOM 757 CE LYS A 49 -10.657 -8.518 11.921 1.00 0.64 C ATOM 758 NZ LYS A 49 -9.661 -7.992 12.888 1.00 0.88 N1+ ATOM 759 H LYS A 49 -6.950 -12.340 11.270 1.00 0.15 H ATOM 760 HA LYS A 49 -9.724 -12.630 11.963 1.00 0.23 H ATOM 761 HB2 LYS A 49 -8.325 -11.639 9.478 1.00 0.23 H ATOM 762 HB3 LYS A 49 -10.076 -11.715 9.619 1.00 0.26 H ATOM 763 HG2 LYS A 49 -8.315 -10.165 11.504 1.00 0.33 H ATOM 764 HG3 LYS A 49 -9.071 -9.474 10.068 1.00 0.21 H ATOM 765 HD2 LYS A 49 -11.275 -10.361 11.052 1.00 0.45 H ATOM 766 HD3 LYS A 49 -10.375 -10.533 12.557 1.00 0.53 H ATOM 767 HE2 LYS A 49 -10.577 -7.961 10.998 1.00 0.70 H ATOM 768 HE3 LYS A 49 -11.647 -8.392 12.331 1.00 0.61 H ATOM 769 HZ1 LYS A 49 -9.701 -8.537 13.773 1.00 1.61 H ATOM 770 HZ2 LYS A 49 -9.858 -6.995 13.102 1.00 1.39 H ATOM 771 HZ3 LYS A 49 -8.701 -8.067 12.494 1.00 0.46 H ATOM 772 N GLN A 50 -8.299 -14.681 9.864 1.00 0.30 N ATOM 773 CA GLN A 50 -8.418 -15.951 9.143 1.00 0.41 C ATOM 774 C GLN A 50 -9.584 -15.939 8.146 1.00 0.29 C ATOM 775 O GLN A 50 -10.591 -16.610 8.359 1.00 0.47 O ATOM 776 CB GLN A 50 -8.599 -17.103 10.134 1.00 0.63 C ATOM 777 CG GLN A 50 -7.447 -17.252 11.113 1.00 0.78 C ATOM 778 CD GLN A 50 -7.886 -17.838 12.440 1.00 0.93 C ATOM 779 OE1 GLN A 50 -9.035 -17.676 12.858 1.00 0.94 O ATOM 780 NE2 GLN A 50 -6.971 -18.515 13.112 1.00 1.07 N ATOM 781 H GLN A 50 -7.416 -14.263 9.933 1.00 0.30 H ATOM 782 HA GLN A 50 -7.500 -16.107 8.597 1.00 0.48 H ATOM 783 HB2 GLN A 50 -9.501 -16.932 10.702 1.00 0.63 H ATOM 784 HB3 GLN A 50 -8.699 -18.024 9.582 1.00 0.70 H ATOM 785 HG2 GLN A 50 -6.706 -17.906 10.677 1.00 0.79 H ATOM 786 HG3 GLN A 50 -7.012 -16.280 11.289 1.00 0.80 H ATOM 787 HE21 GLN A 50 -6.075 -18.604 12.718 1.00 1.07 H ATOM 788 HE22 GLN A 50 -7.221 -18.893 13.982 1.00 1.19 H ATOM 789 N PRO A 51 -9.470 -15.179 7.043 1.00 0.11 N ATOM 790 CA PRO A 51 -10.530 -15.101 6.036 1.00 0.09 C ATOM 791 C PRO A 51 -10.622 -16.381 5.212 1.00 0.05 C ATOM 792 O PRO A 51 -11.585 -17.140 5.324 1.00 0.20 O ATOM 793 CB PRO A 51 -10.117 -13.919 5.145 1.00 0.32 C ATOM 794 CG PRO A 51 -8.946 -13.281 5.823 1.00 0.44 C ATOM 795 CD PRO A 51 -8.323 -14.336 6.689 1.00 0.34 C ATOM 796 HA PRO A 51 -11.490 -14.899 6.488 1.00 0.18 H ATOM 797 HB2 PRO A 51 -9.849 -14.285 4.164 1.00 0.34 H ATOM 798 HB3 PRO A 51 -10.944 -13.228 5.058 1.00 0.42 H ATOM 799 HG2 PRO A 51 -8.237 -12.940 5.084 1.00 0.61 H ATOM 800 HG3 PRO A 51 -9.281 -12.454 6.428 1.00 0.50 H ATOM 801 HD2 PRO A 51 -7.585 -14.899 6.132 1.00 0.49 H ATOM 802 HD3 PRO A 51 -7.880 -13.894 7.570 1.00 0.38 H ATOM 803 N MET A 52 -9.596 -16.628 4.406 1.00 0.10 N ATOM 804 CA MET A 52 -9.556 -17.818 3.562 1.00 0.14 C ATOM 805 C MET A 52 -8.688 -18.889 4.207 1.00 0.14 C ATOM 806 O MET A 52 -8.498 -19.968 3.648 1.00 0.16 O ATOM 807 CB MET A 52 -9.003 -17.479 2.173 1.00 0.25 C ATOM 808 CG MET A 52 -9.615 -16.231 1.549 1.00 0.17 C ATOM 809 SD MET A 52 -11.411 -16.314 1.420 1.00 0.22 S ATOM 810 CE MET A 52 -11.614 -17.657 0.254 1.00 1.11 C ATOM 811 H MET A 52 -8.851 -15.996 4.377 1.00 0.20 H ATOM 812 HA MET A 52 -10.563 -18.193 3.460 1.00 0.12 H ATOM 813 HB2 MET A 52 -7.937 -17.326 2.254 1.00 0.33 H ATOM 814 HB3 MET A 52 -9.189 -18.313 1.513 1.00 0.38 H ATOM 815 HG2 MET A 52 -9.354 -15.377 2.158 1.00 0.11 H ATOM 816 HG3 MET A 52 -9.203 -16.103 0.558 1.00 0.18 H ATOM 817 HE1 MET A 52 -12.664 -17.783 0.028 1.00 1.59 H ATOM 818 HE2 MET A 52 -11.230 -18.567 0.687 1.00 1.15 H ATOM 819 HE3 MET A 52 -11.073 -17.433 -0.654 1.00 1.59 H ATOM 820 N LEU A 53 -8.165 -18.570 5.394 1.00 0.15 N ATOM 821 CA LEU A 53 -7.301 -19.484 6.146 1.00 0.17 C ATOM 822 C LEU A 53 -6.109 -19.924 5.301 1.00 0.20 C ATOM 823 O LEU A 53 -5.710 -21.089 5.316 1.00 0.41 O ATOM 824 CB LEU A 53 -8.098 -20.697 6.633 1.00 0.19 C ATOM 825 CG LEU A 53 -8.998 -20.429 7.840 1.00 0.36 C ATOM 826 CD1 LEU A 53 -10.274 -21.251 7.756 1.00 0.31 C ATOM 827 CD2 LEU A 53 -8.252 -20.730 9.130 1.00 0.51 C ATOM 828 H LEU A 53 -8.378 -17.698 5.779 1.00 0.14 H ATOM 829 HA LEU A 53 -6.929 -18.944 7.005 1.00 0.18 H ATOM 830 HB2 LEU A 53 -8.715 -21.049 5.819 1.00 0.31 H ATOM 831 HB3 LEU A 53 -7.402 -21.476 6.899 1.00 0.03 H ATOM 832 HG LEU A 53 -9.275 -19.385 7.848 1.00 0.63 H ATOM 833 HD11 LEU A 53 -10.023 -22.297 7.689 1.00 0.17 H ATOM 834 HD12 LEU A 53 -10.836 -20.958 6.882 1.00 0.58 H ATOM 835 HD13 LEU A 53 -10.872 -21.080 8.642 1.00 0.42 H ATOM 836 HD21 LEU A 53 -8.893 -20.518 9.975 1.00 0.78 H ATOM 837 HD22 LEU A 53 -7.366 -20.112 9.185 1.00 0.50 H ATOM 838 HD23 LEU A 53 -7.966 -21.771 9.148 1.00 0.56 H ATOM 839 N ASP A 54 -5.541 -18.972 4.574 1.00 0.04 N ATOM 840 CA ASP A 54 -4.403 -19.233 3.708 1.00 0.08 C ATOM 841 C ASP A 54 -3.368 -18.127 3.881 1.00 0.06 C ATOM 842 O ASP A 54 -3.728 -16.968 4.089 1.00 0.07 O ATOM 843 CB ASP A 54 -4.863 -19.327 2.252 1.00 0.12 C ATOM 844 CG ASP A 54 -3.752 -19.726 1.304 1.00 0.14 C ATOM 845 OD1 ASP A 54 -2.836 -20.461 1.724 1.00 0.47 O1- ATOM 846 OD2 ASP A 54 -3.788 -19.303 0.132 1.00 0.21 O ATOM 847 H ASP A 54 -5.889 -18.060 4.632 1.00 0.17 H ATOM 848 HA ASP A 54 -3.966 -20.173 4.005 1.00 0.11 H ATOM 849 HB2 ASP A 54 -5.652 -20.059 2.178 1.00 0.27 H ATOM 850 HB3 ASP A 54 -5.245 -18.364 1.944 1.00 0.19 H ATOM 851 N VAL A 55 -2.095 -18.487 3.795 1.00 0.06 N ATOM 852 CA VAL A 55 -0.995 -17.537 3.981 1.00 0.07 C ATOM 853 C VAL A 55 -0.936 -16.451 2.891 1.00 0.06 C ATOM 854 O VAL A 55 -1.023 -15.264 3.209 1.00 0.06 O ATOM 855 CB VAL A 55 0.370 -18.259 4.080 1.00 0.09 C ATOM 856 CG1 VAL A 55 1.474 -17.284 4.463 1.00 0.08 C ATOM 857 CG2 VAL A 55 0.306 -19.405 5.079 1.00 0.13 C ATOM 858 H VAL A 55 -1.883 -19.424 3.595 1.00 0.08 H ATOM 859 HA VAL A 55 -1.167 -17.045 4.928 1.00 0.07 H ATOM 860 HB VAL A 55 0.607 -18.671 3.113 1.00 0.10 H ATOM 861 HG11 VAL A 55 1.250 -16.847 5.423 1.00 0.09 H ATOM 862 HG12 VAL A 55 1.542 -16.503 3.718 1.00 0.06 H ATOM 863 HG13 VAL A 55 2.415 -17.813 4.519 1.00 0.12 H ATOM 864 HG21 VAL A 55 1.303 -19.779 5.263 1.00 0.13 H ATOM 865 HG22 VAL A 55 -0.309 -20.200 4.679 1.00 0.15 H ATOM 866 HG23 VAL A 55 -0.121 -19.051 6.006 1.00 0.13 H ATOM 867 N PRO A 56 -0.790 -16.808 1.594 1.00 0.05 N ATOM 868 CA PRO A 56 -0.712 -15.805 0.521 1.00 0.04 C ATOM 869 C PRO A 56 -1.963 -14.930 0.427 1.00 0.04 C ATOM 870 O PRO A 56 -1.886 -13.769 0.024 1.00 0.04 O ATOM 871 CB PRO A 56 -0.538 -16.634 -0.755 1.00 0.05 C ATOM 872 CG PRO A 56 -0.984 -18.008 -0.399 1.00 0.06 C ATOM 873 CD PRO A 56 -0.685 -18.180 1.063 1.00 0.06 C ATOM 874 HA PRO A 56 0.149 -15.164 0.651 1.00 0.04 H ATOM 875 HB2 PRO A 56 -1.148 -16.215 -1.543 1.00 0.05 H ATOM 876 HB3 PRO A 56 0.499 -16.623 -1.055 1.00 0.06 H ATOM 877 HG2 PRO A 56 -2.045 -18.107 -0.578 1.00 0.06 H ATOM 878 HG3 PRO A 56 -0.436 -18.733 -0.982 1.00 0.06 H ATOM 879 HD2 PRO A 56 -1.414 -18.829 1.524 1.00 0.07 H ATOM 880 HD3 PRO A 56 0.312 -18.571 1.200 1.00 0.05 H ATOM 881 N LYS A 57 -3.107 -15.483 0.818 1.00 0.05 N ATOM 882 CA LYS A 57 -4.365 -14.742 0.770 1.00 0.05 C ATOM 883 C LYS A 57 -4.405 -13.687 1.868 1.00 0.06 C ATOM 884 O LYS A 57 -5.177 -12.733 1.802 1.00 0.08 O ATOM 885 CB LYS A 57 -5.567 -15.680 0.906 1.00 0.06 C ATOM 886 CG LYS A 57 -5.574 -16.837 -0.084 1.00 0.09 C ATOM 887 CD LYS A 57 -5.332 -16.376 -1.513 1.00 0.11 C ATOM 888 CE LYS A 57 -5.557 -17.508 -2.502 1.00 0.12 C ATOM 889 NZ LYS A 57 -4.611 -18.642 -2.294 1.00 0.10 N1+ ATOM 890 H LYS A 57 -3.104 -16.406 1.149 1.00 0.06 H ATOM 891 HA LYS A 57 -4.415 -14.245 -0.184 1.00 0.04 H ATOM 892 HB2 LYS A 57 -5.573 -16.093 1.904 1.00 0.04 H ATOM 893 HB3 LYS A 57 -6.470 -15.106 0.761 1.00 0.07 H ATOM 894 HG2 LYS A 57 -4.798 -17.535 0.192 1.00 0.08 H ATOM 895 HG3 LYS A 57 -6.535 -17.330 -0.033 1.00 0.10 H ATOM 896 HD2 LYS A 57 -6.009 -15.568 -1.742 1.00 0.11 H ATOM 897 HD3 LYS A 57 -4.312 -16.033 -1.603 1.00 0.13 H ATOM 898 HE2 LYS A 57 -6.567 -17.869 -2.389 1.00 0.13 H ATOM 899 HE3 LYS A 57 -5.426 -17.121 -3.502 1.00 0.14 H ATOM 900 HZ1 LYS A 57 -3.708 -18.449 -2.770 1.00 0.90 H ATOM 901 HZ2 LYS A 57 -5.012 -19.519 -2.682 1.00 0.84 H ATOM 902 HZ3 LYS A 57 -4.429 -18.783 -1.272 1.00 0.83 H ATOM 903 N LEU A 58 -3.567 -13.870 2.877 1.00 0.05 N ATOM 904 CA LEU A 58 -3.495 -12.937 3.991 1.00 0.06 C ATOM 905 C LEU A 58 -2.671 -11.714 3.595 1.00 0.06 C ATOM 906 O LEU A 58 -3.059 -10.577 3.864 1.00 0.08 O ATOM 907 CB LEU A 58 -2.887 -13.644 5.221 1.00 0.06 C ATOM 908 CG LEU A 58 -2.813 -12.843 6.536 1.00 0.11 C ATOM 909 CD1 LEU A 58 -1.553 -11.992 6.595 1.00 0.07 C ATOM 910 CD2 LEU A 58 -4.046 -11.974 6.734 1.00 0.17 C ATOM 911 H LEU A 58 -2.979 -14.655 2.873 1.00 0.05 H ATOM 912 HA LEU A 58 -4.501 -12.625 4.219 1.00 0.07 H ATOM 913 HB2 LEU A 58 -3.470 -14.533 5.410 1.00 0.06 H ATOM 914 HB3 LEU A 58 -1.884 -13.953 4.964 1.00 0.04 H ATOM 915 HG LEU A 58 -2.768 -13.543 7.359 1.00 0.16 H ATOM 916 HD11 LEU A 58 -0.685 -12.627 6.487 1.00 0.05 H ATOM 917 HD12 LEU A 58 -1.510 -11.480 7.546 1.00 0.07 H ATOM 918 HD13 LEU A 58 -1.572 -11.268 5.795 1.00 0.06 H ATOM 919 HD21 LEU A 58 -4.936 -12.570 6.595 1.00 0.17 H ATOM 920 HD22 LEU A 58 -4.037 -11.160 6.023 1.00 0.24 H ATOM 921 HD23 LEU A 58 -4.039 -11.573 7.736 1.00 0.18 H ATOM 922 N ALA A 59 -1.546 -11.961 2.932 1.00 0.05 N ATOM 923 CA ALA A 59 -0.655 -10.891 2.497 1.00 0.06 C ATOM 924 C ALA A 59 -1.361 -9.934 1.538 1.00 0.08 C ATOM 925 O ALA A 59 -1.264 -8.713 1.681 1.00 0.11 O ATOM 926 CB ALA A 59 0.591 -11.475 1.848 1.00 0.06 C ATOM 927 H ALA A 59 -1.308 -12.891 2.734 1.00 0.04 H ATOM 928 HA ALA A 59 -0.346 -10.338 3.373 1.00 0.07 H ATOM 929 HB1 ALA A 59 0.307 -12.073 0.996 1.00 0.06 H ATOM 930 HB2 ALA A 59 1.113 -12.094 2.563 1.00 0.06 H ATOM 931 HB3 ALA A 59 1.237 -10.674 1.525 1.00 0.06 H ATOM 932 N VAL A 60 -2.081 -10.491 0.572 1.00 0.05 N ATOM 933 CA VAL A 60 -2.804 -9.674 -0.400 1.00 0.07 C ATOM 934 C VAL A 60 -3.952 -8.916 0.269 1.00 0.07 C ATOM 935 O VAL A 60 -4.319 -7.821 -0.160 1.00 0.08 O ATOM 936 CB VAL A 60 -3.344 -10.514 -1.585 1.00 0.07 C ATOM 937 CG1 VAL A 60 -4.430 -11.479 -1.135 1.00 0.07 C ATOM 938 CG2 VAL A 60 -3.865 -9.608 -2.693 1.00 0.08 C ATOM 939 H VAL A 60 -2.120 -11.469 0.508 1.00 0.04 H ATOM 940 HA VAL A 60 -2.104 -8.952 -0.797 1.00 0.07 H ATOM 941 HB VAL A 60 -2.526 -11.096 -1.984 1.00 0.07 H ATOM 942 HG11 VAL A 60 -4.539 -12.265 -1.868 1.00 0.07 H ATOM 943 HG12 VAL A 60 -5.365 -10.946 -1.042 1.00 0.08 H ATOM 944 HG13 VAL A 60 -4.163 -11.906 -0.183 1.00 0.09 H ATOM 945 HG21 VAL A 60 -3.064 -8.977 -3.049 1.00 0.08 H ATOM 946 HG22 VAL A 60 -4.665 -8.993 -2.310 1.00 0.08 H ATOM 947 HG23 VAL A 60 -4.235 -10.214 -3.508 1.00 0.08 H ATOM 948 N LEU A 61 -4.499 -9.493 1.337 1.00 0.07 N ATOM 949 CA LEU A 61 -5.591 -8.865 2.067 1.00 0.08 C ATOM 950 C LEU A 61 -5.113 -7.570 2.713 1.00 0.08 C ATOM 951 O LEU A 61 -5.795 -6.548 2.670 1.00 0.08 O ATOM 952 CB LEU A 61 -6.135 -9.811 3.138 1.00 0.10 C ATOM 953 CG LEU A 61 -7.380 -9.311 3.867 1.00 0.10 C ATOM 954 CD1 LEU A 61 -8.621 -9.527 3.016 1.00 0.11 C ATOM 955 CD2 LEU A 61 -7.519 -10.004 5.212 1.00 0.07 C ATOM 956 H LEU A 61 -4.159 -10.362 1.641 1.00 0.07 H ATOM 957 HA LEU A 61 -6.378 -8.638 1.361 1.00 0.07 H ATOM 958 HB2 LEU A 61 -6.371 -10.756 2.670 1.00 0.10 H ATOM 959 HB3 LEU A 61 -5.358 -9.975 3.870 1.00 0.10 H ATOM 960 HG LEU A 61 -7.280 -8.250 4.046 1.00 0.11 H ATOM 961 HD11 LEU A 61 -8.526 -8.970 2.095 1.00 0.14 H ATOM 962 HD12 LEU A 61 -9.493 -9.187 3.555 1.00 0.09 H ATOM 963 HD13 LEU A 61 -8.724 -10.578 2.791 1.00 0.13 H ATOM 964 HD21 LEU A 61 -6.739 -9.664 5.874 1.00 0.07 H ATOM 965 HD22 LEU A 61 -7.435 -11.072 5.076 1.00 0.09 H ATOM 966 HD23 LEU A 61 -8.484 -9.771 5.640 1.00 0.06 H ATOM 967 N THR A 62 -3.935 -7.617 3.312 1.00 0.10 N ATOM 968 CA THR A 62 -3.373 -6.442 3.947 1.00 0.11 C ATOM 969 C THR A 62 -2.898 -5.444 2.899 1.00 0.10 C ATOM 970 O THR A 62 -2.948 -4.234 3.112 1.00 0.13 O ATOM 971 CB THR A 62 -2.210 -6.810 4.884 1.00 0.13 C ATOM 972 OG1 THR A 62 -1.451 -7.893 4.331 1.00 0.12 O ATOM 973 CG2 THR A 62 -2.728 -7.209 6.254 1.00 0.15 C ATOM 974 H THR A 62 -3.438 -8.466 3.341 1.00 0.10 H ATOM 975 HA THR A 62 -4.153 -5.981 4.536 1.00 0.12 H ATOM 976 HB THR A 62 -1.568 -5.948 4.995 1.00 0.14 H ATOM 977 HG1 THR A 62 -1.209 -7.691 3.420 1.00 0.14 H ATOM 978 HG21 THR A 62 -1.899 -7.312 6.936 1.00 1.01 H ATOM 979 HG22 THR A 62 -3.250 -8.152 6.180 1.00 0.84 H ATOM 980 HG23 THR A 62 -3.405 -6.451 6.623 1.00 0.83 H ATOM 981 N ALA A 63 -2.463 -5.965 1.756 1.00 0.08 N ATOM 982 CA ALA A 63 -1.980 -5.134 0.663 1.00 0.08 C ATOM 983 C ALA A 63 -3.087 -4.238 0.123 1.00 0.07 C ATOM 984 O ALA A 63 -2.893 -3.037 -0.063 1.00 0.08 O ATOM 985 CB ALA A 63 -1.425 -6.005 -0.456 1.00 0.08 C ATOM 986 H ALA A 63 -2.470 -6.939 1.646 1.00 0.08 H ATOM 987 HA ALA A 63 -1.177 -4.518 1.040 1.00 0.10 H ATOM 988 HB1 ALA A 63 -0.693 -6.687 -0.051 1.00 0.11 H ATOM 989 HB2 ALA A 63 -0.959 -5.379 -1.201 1.00 0.10 H ATOM 990 HB3 ALA A 63 -2.229 -6.565 -0.909 1.00 0.05 H ATOM 991 N VAL A 64 -4.256 -4.824 -0.106 1.00 0.07 N ATOM 992 CA VAL A 64 -5.385 -4.076 -0.635 1.00 0.08 C ATOM 993 C VAL A 64 -5.915 -3.070 0.389 1.00 0.09 C ATOM 994 O VAL A 64 -6.423 -2.010 0.017 1.00 0.12 O ATOM 995 CB VAL A 64 -6.517 -5.016 -1.117 1.00 0.08 C ATOM 996 CG1 VAL A 64 -7.236 -5.680 0.050 1.00 0.05 C ATOM 997 CG2 VAL A 64 -7.499 -4.265 -2.003 1.00 0.12 C ATOM 998 H VAL A 64 -4.358 -5.784 0.083 1.00 0.08 H ATOM 999 HA VAL A 64 -5.028 -3.524 -1.490 1.00 0.11 H ATOM 1000 HB VAL A 64 -6.068 -5.797 -1.711 1.00 0.08 H ATOM 1001 HG11 VAL A 64 -7.583 -4.923 0.737 1.00 0.04 H ATOM 1002 HG12 VAL A 64 -6.556 -6.346 0.560 1.00 0.04 H ATOM 1003 HG13 VAL A 64 -8.078 -6.243 -0.321 1.00 0.07 H ATOM 1004 HG21 VAL A 64 -7.010 -3.984 -2.923 1.00 0.18 H ATOM 1005 HG22 VAL A 64 -7.837 -3.376 -1.491 1.00 0.11 H ATOM 1006 HG23 VAL A 64 -8.344 -4.900 -2.223 1.00 0.12 H ATOM 1007 N GLN A 65 -5.763 -3.386 1.674 1.00 0.08 N ATOM 1008 CA GLN A 65 -6.223 -2.495 2.736 1.00 0.09 C ATOM 1009 C GLN A 65 -5.298 -1.287 2.846 1.00 0.07 C ATOM 1010 O GLN A 65 -5.751 -0.154 3.009 1.00 0.12 O ATOM 1011 CB GLN A 65 -6.293 -3.239 4.075 1.00 0.10 C ATOM 1012 CG GLN A 65 -7.281 -2.624 5.067 1.00 0.10 C ATOM 1013 CD GLN A 65 -6.597 -2.028 6.284 1.00 0.24 C ATOM 1014 OE1 GLN A 65 -5.444 -1.608 6.227 1.00 0.81 O ATOM 1015 NE2 GLN A 65 -7.309 -1.987 7.397 1.00 0.31 N ATOM 1016 H GLN A 65 -5.336 -4.236 1.911 1.00 0.07 H ATOM 1017 HA GLN A 65 -7.214 -2.152 2.469 1.00 0.10 H ATOM 1018 HB2 GLN A 65 -6.583 -4.264 3.889 1.00 0.17 H ATOM 1019 HB3 GLN A 65 -5.310 -3.231 4.527 1.00 0.15 H ATOM 1020 HG2 GLN A 65 -7.833 -1.838 4.569 1.00 0.07 H ATOM 1021 HG3 GLN A 65 -7.969 -3.387 5.403 1.00 0.13 H ATOM 1022 HE21 GLN A 65 -8.223 -2.337 7.375 1.00 0.76 H ATOM 1023 HE22 GLN A 65 -6.898 -1.593 8.196 1.00 0.24 H ATOM 1024 N ILE A 66 -3.998 -1.537 2.739 1.00 0.02 N ATOM 1025 CA ILE A 66 -3.007 -0.471 2.801 1.00 0.03 C ATOM 1026 C ILE A 66 -3.182 0.468 1.610 1.00 0.05 C ATOM 1027 O ILE A 66 -3.140 1.692 1.747 1.00 0.18 O ATOM 1028 CB ILE A 66 -1.562 -1.032 2.804 1.00 0.10 C ATOM 1029 CG1 ILE A 66 -1.279 -1.771 4.116 1.00 0.74 C ATOM 1030 CG2 ILE A 66 -0.552 0.092 2.593 1.00 0.71 C ATOM 1031 CD1 ILE A 66 -0.028 -2.625 4.083 1.00 1.29 C ATOM 1032 H ILE A 66 -3.698 -2.466 2.623 1.00 0.03 H ATOM 1033 HA ILE A 66 -3.163 0.084 3.716 1.00 0.05 H ATOM 1034 HB ILE A 66 -1.469 -1.725 1.980 1.00 0.67 H ATOM 1035 HG12 ILE A 66 -1.166 -1.049 4.911 1.00 0.89 H ATOM 1036 HG13 ILE A 66 -2.114 -2.418 4.343 1.00 1.67 H ATOM 1037 HG21 ILE A 66 0.413 -0.326 2.350 1.00 1.06 H ATOM 1038 HG22 ILE A 66 -0.474 0.680 3.496 1.00 1.14 H ATOM 1039 HG23 ILE A 66 -0.885 0.723 1.783 1.00 0.67 H ATOM 1040 HD11 ILE A 66 -0.143 -3.399 3.340 1.00 1.10 H ATOM 1041 HD12 ILE A 66 0.126 -3.077 5.053 1.00 2.16 H ATOM 1042 HD13 ILE A 66 0.825 -2.011 3.835 1.00 1.79 H ATOM 1043 N ALA A 67 -3.408 -0.124 0.445 1.00 0.07 N ATOM 1044 CA ALA A 67 -3.585 0.635 -0.782 1.00 0.05 C ATOM 1045 C ALA A 67 -4.807 1.551 -0.718 1.00 0.04 C ATOM 1046 O ALA A 67 -4.743 2.702 -1.137 1.00 0.03 O ATOM 1047 CB ALA A 67 -3.697 -0.310 -1.967 1.00 0.06 C ATOM 1048 H ALA A 67 -3.456 -1.104 0.410 1.00 0.16 H ATOM 1049 HA ALA A 67 -2.701 1.244 -0.925 1.00 0.05 H ATOM 1050 HB1 ALA A 67 -3.717 0.263 -2.884 1.00 0.05 H ATOM 1051 HB2 ALA A 67 -4.606 -0.883 -1.881 1.00 0.07 H ATOM 1052 HB3 ALA A 67 -2.850 -0.977 -1.977 1.00 0.08 H ATOM 1053 N SER A 68 -5.911 1.048 -0.176 1.00 0.05 N ATOM 1054 CA SER A 68 -7.138 1.832 -0.092 1.00 0.07 C ATOM 1055 C SER A 68 -7.025 2.960 0.934 1.00 0.08 C ATOM 1056 O SER A 68 -7.319 4.118 0.624 1.00 0.12 O ATOM 1057 CB SER A 68 -8.331 0.927 0.234 1.00 0.07 C ATOM 1058 OG SER A 68 -7.955 -0.120 1.109 1.00 0.04 O ATOM 1059 H SER A 68 -5.901 0.134 0.182 1.00 0.06 H ATOM 1060 HA SER A 68 -7.302 2.275 -1.062 1.00 0.09 H ATOM 1061 HB2 SER A 68 -9.106 1.511 0.706 1.00 0.12 H ATOM 1062 HB3 SER A 68 -8.711 0.497 -0.681 1.00 0.14 H ATOM 1063 HG SER A 68 -7.599 -0.856 0.597 1.00 0.13 H ATOM 1064 N GLU A 69 -6.566 2.631 2.139 1.00 0.08 N ATOM 1065 CA GLU A 69 -6.435 3.620 3.208 1.00 0.14 C ATOM 1066 C GLU A 69 -5.423 4.712 2.858 1.00 0.10 C ATOM 1067 O GLU A 69 -5.458 5.803 3.429 1.00 0.10 O ATOM 1068 CB GLU A 69 -6.051 2.939 4.523 1.00 0.19 C ATOM 1069 CG GLU A 69 -7.226 2.280 5.232 1.00 0.29 C ATOM 1070 CD GLU A 69 -8.226 3.286 5.770 1.00 0.63 C ATOM 1071 OE1 GLU A 69 -8.039 3.764 6.912 1.00 0.79 O1- ATOM 1072 OE2 GLU A 69 -9.205 3.605 5.066 1.00 0.82 O ATOM 1073 H GLU A 69 -6.319 1.693 2.319 1.00 0.07 H ATOM 1074 HA GLU A 69 -7.402 4.082 3.334 1.00 0.19 H ATOM 1075 HB2 GLU A 69 -5.309 2.181 4.319 1.00 0.16 H ATOM 1076 HB3 GLU A 69 -5.626 3.679 5.186 1.00 0.33 H ATOM 1077 HG2 GLU A 69 -7.734 1.631 4.534 1.00 0.30 H ATOM 1078 HG3 GLU A 69 -6.850 1.695 6.057 1.00 0.27 H ATOM 1079 N TYR A 70 -4.518 4.422 1.933 1.00 0.07 N ATOM 1080 CA TYR A 70 -3.524 5.402 1.516 1.00 0.04 C ATOM 1081 C TYR A 70 -3.994 6.156 0.274 1.00 0.03 C ATOM 1082 O TYR A 70 -3.629 7.315 0.061 1.00 0.04 O ATOM 1083 CB TYR A 70 -2.174 4.732 1.257 1.00 0.05 C ATOM 1084 CG TYR A 70 -1.238 4.792 2.441 1.00 0.18 C ATOM 1085 CD1 TYR A 70 -0.390 5.876 2.621 1.00 0.36 C ATOM 1086 CD2 TYR A 70 -1.201 3.768 3.380 1.00 0.37 C ATOM 1087 CE1 TYR A 70 0.467 5.939 3.702 1.00 0.47 C ATOM 1088 CE2 TYR A 70 -0.347 3.823 4.463 1.00 0.46 C ATOM 1089 CZ TYR A 70 0.485 4.912 4.621 1.00 0.44 C ATOM 1090 OH TYR A 70 1.333 4.974 5.702 1.00 0.58 O ATOM 1091 H TYR A 70 -4.506 3.524 1.536 1.00 0.07 H ATOM 1092 HA TYR A 70 -3.409 6.113 2.322 1.00 0.05 H ATOM 1093 HB2 TYR A 70 -2.336 3.694 1.013 1.00 0.09 H ATOM 1094 HB3 TYR A 70 -1.691 5.223 0.424 1.00 0.13 H ATOM 1095 HD1 TYR A 70 -0.406 6.682 1.902 1.00 0.50 H ATOM 1096 HD2 TYR A 70 -1.855 2.917 3.253 1.00 0.53 H ATOM 1097 HE1 TYR A 70 1.119 6.791 3.825 1.00 0.66 H ATOM 1098 HE2 TYR A 70 -0.333 3.017 5.183 1.00 0.63 H ATOM 1099 HH TYR A 70 1.635 4.087 5.923 1.00 0.70 H ATOM 1100 N LEU A 71 -4.822 5.504 -0.537 1.00 0.07 N ATOM 1101 CA LEU A 71 -5.348 6.122 -1.755 1.00 0.11 C ATOM 1102 C LEU A 71 -6.296 7.263 -1.414 1.00 0.12 C ATOM 1103 O LEU A 71 -6.404 8.233 -2.163 1.00 0.16 O ATOM 1104 CB LEU A 71 -6.064 5.093 -2.637 1.00 0.13 C ATOM 1105 CG LEU A 71 -5.235 4.572 -3.826 1.00 0.14 C ATOM 1106 CD1 LEU A 71 -5.812 3.274 -4.386 1.00 0.12 C ATOM 1107 CD2 LEU A 71 -5.143 5.623 -4.929 1.00 0.23 C ATOM 1108 H LEU A 71 -5.079 4.584 -0.316 1.00 0.08 H ATOM 1109 HA LEU A 71 -4.508 6.525 -2.302 1.00 0.11 H ATOM 1110 HB2 LEU A 71 -6.344 4.254 -2.016 1.00 0.10 H ATOM 1111 HB3 LEU A 71 -6.965 5.549 -3.020 1.00 0.19 H ATOM 1112 HG LEU A 71 -4.231 4.365 -3.485 1.00 0.12 H ATOM 1113 HD11 LEU A 71 -5.279 3.011 -5.288 1.00 0.17 H ATOM 1114 HD12 LEU A 71 -6.859 3.408 -4.616 1.00 0.16 H ATOM 1115 HD13 LEU A 71 -5.697 2.482 -3.660 1.00 0.05 H ATOM 1116 HD21 LEU A 71 -4.454 5.281 -5.689 1.00 0.63 H ATOM 1117 HD22 LEU A 71 -4.786 6.555 -4.516 1.00 1.06 H ATOM 1118 HD23 LEU A 71 -6.115 5.772 -5.371 1.00 1.03 H ATOM 1119 N LYS A 72 -6.991 7.131 -0.290 1.00 0.13 N ATOM 1120 CA LYS A 72 -7.918 8.159 0.164 1.00 0.16 C ATOM 1121 C LYS A 72 -7.154 9.350 0.738 1.00 0.16 C ATOM 1122 O LYS A 72 -7.660 10.472 0.780 1.00 0.30 O ATOM 1123 CB LYS A 72 -8.865 7.583 1.220 1.00 0.18 C ATOM 1124 CG LYS A 72 -8.187 7.257 2.542 1.00 0.18 C ATOM 1125 CD LYS A 72 -8.916 6.157 3.300 1.00 0.22 C ATOM 1126 CE LYS A 72 -10.244 6.633 3.860 1.00 0.25 C ATOM 1127 NZ LYS A 72 -10.965 5.542 4.567 1.00 0.24 N1+ ATOM 1128 H LYS A 72 -6.896 6.305 0.235 1.00 0.12 H ATOM 1129 HA LYS A 72 -8.493 8.488 -0.687 1.00 0.19 H ATOM 1130 HB2 LYS A 72 -9.651 8.298 1.411 1.00 0.23 H ATOM 1131 HB3 LYS A 72 -9.302 6.676 0.833 1.00 0.17 H ATOM 1132 HG2 LYS A 72 -7.177 6.931 2.344 1.00 0.15 H ATOM 1133 HG3 LYS A 72 -8.164 8.149 3.151 1.00 0.20 H ATOM 1134 HD2 LYS A 72 -9.097 5.330 2.629 1.00 0.26 H ATOM 1135 HD3 LYS A 72 -8.291 5.826 4.116 1.00 0.20 H ATOM 1136 HE2 LYS A 72 -10.061 7.440 4.553 1.00 0.27 H ATOM 1137 HE3 LYS A 72 -10.857 6.991 3.046 1.00 0.33 H ATOM 1138 HZ1 LYS A 72 -10.316 4.738 4.749 1.00 0.51 H ATOM 1139 HZ2 LYS A 72 -11.764 5.209 3.987 1.00 0.89 H ATOM 1140 HZ3 LYS A 72 -11.332 5.888 5.475 1.00 0.88 H ATOM 1141 N LEU A 73 -5.924 9.098 1.169 1.00 0.03 N ATOM 1142 CA LEU A 73 -5.083 10.134 1.742 1.00 0.05 C ATOM 1143 C LEU A 73 -4.488 10.997 0.639 1.00 0.05 C ATOM 1144 O LEU A 73 -4.394 12.216 0.774 1.00 0.10 O ATOM 1145 CB LEU A 73 -3.975 9.504 2.596 1.00 0.14 C ATOM 1146 CG LEU A 73 -3.081 10.490 3.352 1.00 0.17 C ATOM 1147 CD1 LEU A 73 -3.895 11.302 4.350 1.00 0.18 C ATOM 1148 CD2 LEU A 73 -1.954 9.750 4.059 1.00 0.24 C ATOM 1149 H LEU A 73 -5.573 8.186 1.099 1.00 0.09 H ATOM 1150 HA LEU A 73 -5.705 10.752 2.371 1.00 0.10 H ATOM 1151 HB2 LEU A 73 -4.440 8.849 3.319 1.00 0.19 H ATOM 1152 HB3 LEU A 73 -3.349 8.909 1.949 1.00 0.17 H ATOM 1153 HG LEU A 73 -2.639 11.178 2.645 1.00 0.14 H ATOM 1154 HD11 LEU A 73 -4.550 10.643 4.901 1.00 0.20 H ATOM 1155 HD12 LEU A 73 -4.484 12.037 3.822 1.00 0.17 H ATOM 1156 HD13 LEU A 73 -3.228 11.802 5.036 1.00 0.22 H ATOM 1157 HD21 LEU A 73 -2.372 9.045 4.763 1.00 0.28 H ATOM 1158 HD22 LEU A 73 -1.336 10.459 4.589 1.00 0.23 H ATOM 1159 HD23 LEU A 73 -1.355 9.222 3.333 1.00 0.25 H ATOM 1160 N LYS A 74 -4.105 10.362 -0.464 1.00 0.10 N ATOM 1161 CA LYS A 74 -3.529 11.086 -1.591 1.00 0.18 C ATOM 1162 C LYS A 74 -4.607 11.916 -2.283 1.00 0.21 C ATOM 1163 O LYS A 74 -4.309 12.912 -2.943 1.00 0.29 O ATOM 1164 CB LYS A 74 -2.844 10.119 -2.570 1.00 0.23 C ATOM 1165 CG LYS A 74 -3.646 9.807 -3.828 1.00 0.11 C ATOM 1166 CD LYS A 74 -2.854 8.930 -4.790 1.00 0.18 C ATOM 1167 CE LYS A 74 -3.501 8.877 -6.163 1.00 0.26 C ATOM 1168 NZ LYS A 74 -3.479 10.200 -6.841 1.00 0.15 N1+ ATOM 1169 H LYS A 74 -4.206 9.387 -0.516 1.00 0.09 H ATOM 1170 HA LYS A 74 -2.786 11.763 -1.196 1.00 0.23 H ATOM 1171 HB2 LYS A 74 -1.902 10.549 -2.873 1.00 0.43 H ATOM 1172 HB3 LYS A 74 -2.651 9.189 -2.055 1.00 0.39 H ATOM 1173 HG2 LYS A 74 -4.552 9.290 -3.546 1.00 0.26 H ATOM 1174 HG3 LYS A 74 -3.896 10.735 -4.323 1.00 0.30 H ATOM 1175 HD2 LYS A 74 -1.855 9.329 -4.889 1.00 0.33 H ATOM 1176 HD3 LYS A 74 -2.803 7.928 -4.389 1.00 0.45 H ATOM 1177 HE2 LYS A 74 -2.965 8.163 -6.770 1.00 0.62 H ATOM 1178 HE3 LYS A 74 -4.527 8.555 -6.049 1.00 0.53 H ATOM 1179 HZ1 LYS A 74 -2.504 10.554 -6.906 1.00 0.56 H ATOM 1180 HZ2 LYS A 74 -4.051 10.887 -6.309 1.00 0.36 H ATOM 1181 HZ3 LYS A 74 -3.871 10.117 -7.801 1.00 0.67 H ATOM 1182 N GLU A 75 -5.860 11.505 -2.109 1.00 0.18 N ATOM 1183 CA GLU A 75 -6.987 12.220 -2.691 1.00 0.27 C ATOM 1184 C GLU A 75 -7.191 13.534 -1.943 1.00 0.23 C ATOM 1185 O GLU A 75 -7.621 14.535 -2.514 1.00 0.32 O ATOM 1186 CB GLU A 75 -8.250 11.357 -2.620 1.00 0.36 C ATOM 1187 CG GLU A 75 -9.444 11.945 -3.356 1.00 0.51 C ATOM 1188 CD GLU A 75 -9.333 11.825 -4.863 1.00 0.97 C ATOM 1189 OE1 GLU A 75 -8.206 11.679 -5.382 1.00 1.57 O1- ATOM 1190 OE2 GLU A 75 -10.379 11.878 -5.544 1.00 1.47 O ATOM 1191 H GLU A 75 -6.030 10.699 -1.577 1.00 0.12 H ATOM 1192 HA GLU A 75 -6.755 12.431 -3.724 1.00 0.34 H ATOM 1193 HB2 GLU A 75 -8.035 10.390 -3.047 1.00 0.62 H ATOM 1194 HB3 GLU A 75 -8.522 11.229 -1.583 1.00 0.25 H ATOM 1195 HG2 GLU A 75 -10.337 11.427 -3.037 1.00 0.53 H ATOM 1196 HG3 GLU A 75 -9.527 12.991 -3.099 1.00 0.52 H ATOM 1197 N GLU A 76 -6.854 13.522 -0.658 1.00 0.13 N ATOM 1198 CA GLU A 76 -6.973 14.704 0.183 1.00 0.10 C ATOM 1199 C GLU A 76 -5.967 15.764 -0.261 1.00 0.05 C ATOM 1200 O GLU A 76 -6.210 16.966 -0.139 1.00 0.03 O ATOM 1201 CB GLU A 76 -6.733 14.329 1.647 1.00 0.10 C ATOM 1202 CG GLU A 76 -7.040 15.449 2.626 1.00 0.19 C ATOM 1203 CD GLU A 76 -8.517 15.779 2.693 1.00 0.51 C ATOM 1204 OE1 GLU A 76 -9.237 15.136 3.488 1.00 1.56 O ATOM 1205 OE2 GLU A 76 -8.966 16.683 1.959 1.00 0.59 O1- ATOM 1206 H GLU A 76 -6.519 12.691 -0.262 1.00 0.10 H ATOM 1207 HA GLU A 76 -7.972 15.098 0.074 1.00 0.12 H ATOM 1208 HB2 GLU A 76 -7.356 13.483 1.897 1.00 0.24 H ATOM 1209 HB3 GLU A 76 -5.695 14.047 1.768 1.00 0.12 H ATOM 1210 HG2 GLU A 76 -6.709 15.152 3.609 1.00 0.10 H ATOM 1211 HG3 GLU A 76 -6.504 16.334 2.318 1.00 0.42 H ATOM 1212 N TYR A 77 -4.846 15.304 -0.801 1.00 0.06 N ATOM 1213 CA TYR A 77 -3.795 16.196 -1.268 1.00 0.05 C ATOM 1214 C TYR A 77 -4.311 17.115 -2.369 1.00 0.07 C ATOM 1215 O TYR A 77 -4.220 18.339 -2.263 1.00 0.11 O ATOM 1216 CB TYR A 77 -2.598 15.383 -1.771 1.00 0.09 C ATOM 1217 CG TYR A 77 -1.487 16.225 -2.363 1.00 0.12 C ATOM 1218 CD1 TYR A 77 -1.088 17.406 -1.751 1.00 0.12 C ATOM 1219 CD2 TYR A 77 -0.838 15.838 -3.530 1.00 0.14 C ATOM 1220 CE1 TYR A 77 -0.077 18.177 -2.276 1.00 0.16 C ATOM 1221 CE2 TYR A 77 0.178 16.605 -4.065 1.00 0.17 C ATOM 1222 CZ TYR A 77 0.553 17.775 -3.437 1.00 0.18 C ATOM 1223 OH TYR A 77 1.565 18.538 -3.969 1.00 0.21 O ATOM 1224 H TYR A 77 -4.723 14.334 -0.890 1.00 0.09 H ATOM 1225 HA TYR A 77 -3.484 16.799 -0.431 1.00 0.02 H ATOM 1226 HB2 TYR A 77 -2.183 14.824 -0.948 1.00 0.10 H ATOM 1227 HB3 TYR A 77 -2.937 14.696 -2.532 1.00 0.10 H ATOM 1228 HD1 TYR A 77 -1.580 17.719 -0.845 1.00 0.10 H ATOM 1229 HD2 TYR A 77 -1.134 14.920 -4.020 1.00 0.14 H ATOM 1230 HE1 TYR A 77 0.213 19.092 -1.775 1.00 0.17 H ATOM 1231 HE2 TYR A 77 0.670 16.290 -4.974 1.00 0.19 H ATOM 1232 HH TYR A 77 2.414 18.221 -3.628 1.00 0.12 H ATOM 1233 N GLN A 78 -4.865 16.521 -3.417 1.00 0.10 N ATOM 1234 CA GLN A 78 -5.390 17.289 -4.539 1.00 0.13 C ATOM 1235 C GLN A 78 -6.658 18.036 -4.134 1.00 0.06 C ATOM 1236 O GLN A 78 -7.038 19.023 -4.762 1.00 0.08 O ATOM 1237 CB GLN A 78 -5.671 16.373 -5.735 1.00 0.19 C ATOM 1238 CG GLN A 78 -6.683 15.272 -5.451 1.00 0.23 C ATOM 1239 CD GLN A 78 -8.013 15.498 -6.146 1.00 0.31 C ATOM 1240 OE1 GLN A 78 -8.415 16.632 -6.397 1.00 0.51 O ATOM 1241 NE2 GLN A 78 -8.708 14.418 -6.452 1.00 0.26 N ATOM 1242 H GLN A 78 -4.921 15.542 -3.438 1.00 0.13 H ATOM 1243 HA GLN A 78 -4.639 18.012 -4.821 1.00 0.17 H ATOM 1244 HB2 GLN A 78 -6.049 16.974 -6.550 1.00 0.24 H ATOM 1245 HB3 GLN A 78 -4.746 15.911 -6.042 1.00 0.20 H ATOM 1246 HG2 GLN A 78 -6.276 14.330 -5.786 1.00 0.21 H ATOM 1247 HG3 GLN A 78 -6.858 15.227 -4.385 1.00 0.33 H ATOM 1248 HE21 GLN A 78 -8.333 13.539 -6.211 1.00 0.23 H ATOM 1249 HE22 GLN A 78 -9.570 14.534 -6.901 1.00 0.36 H ATOM 1250 N ARG A 79 -7.284 17.583 -3.052 1.00 0.04 N ATOM 1251 CA ARG A 79 -8.508 18.195 -2.571 1.00 0.11 C ATOM 1252 C ARG A 79 -8.197 19.532 -1.924 1.00 0.17 C ATOM 1253 O ARG A 79 -8.787 20.551 -2.267 1.00 0.29 O ATOM 1254 CB ARG A 79 -9.205 17.279 -1.564 1.00 0.18 C ATOM 1255 CG ARG A 79 -10.701 17.511 -1.462 1.00 0.46 C ATOM 1256 CD ARG A 79 -11.410 17.063 -2.728 1.00 0.78 C ATOM 1257 NE ARG A 79 -12.143 18.155 -3.365 1.00 1.20 N ATOM 1258 CZ ARG A 79 -13.140 17.974 -4.228 1.00 0.98 C ATOM 1259 NH1 ARG A 79 -13.504 16.743 -4.577 1.00 0.63 N1+ ATOM 1260 NH2 ARG A 79 -13.754 19.025 -4.754 1.00 1.78 N ATOM 1261 H ARG A 79 -6.897 16.833 -2.555 1.00 0.06 H ATOM 1262 HA ARG A 79 -9.160 18.358 -3.418 1.00 0.11 H ATOM 1263 HB2 ARG A 79 -9.041 16.253 -1.856 1.00 0.29 H ATOM 1264 HB3 ARG A 79 -8.770 17.440 -0.589 1.00 0.09 H ATOM 1265 HG2 ARG A 79 -11.090 16.949 -0.624 1.00 0.37 H ATOM 1266 HG3 ARG A 79 -10.884 18.566 -1.310 1.00 0.61 H ATOM 1267 HD2 ARG A 79 -10.674 16.687 -3.422 1.00 1.38 H ATOM 1268 HD3 ARG A 79 -12.104 16.274 -2.476 1.00 0.57 H ATOM 1269 HE ARG A 79 -11.877 19.075 -3.136 1.00 1.96 H ATOM 1270 HH11 ARG A 79 -13.030 15.946 -4.190 1.00 0.74 H ATOM 1271 HH12 ARG A 79 -14.253 16.603 -5.231 1.00 1.10 H ATOM 1272 HH21 ARG A 79 -13.461 19.961 -4.501 1.00 2.44 H ATOM 1273 HH22 ARG A 79 -14.507 18.901 -5.403 1.00 1.83 H ATOM 1274 N LEU A 80 -7.245 19.512 -1.003 1.00 0.11 N ATOM 1275 CA LEU A 80 -6.829 20.712 -0.295 1.00 0.17 C ATOM 1276 C LEU A 80 -6.393 21.810 -1.265 1.00 0.18 C ATOM 1277 O LEU A 80 -6.696 22.988 -1.069 1.00 0.22 O ATOM 1278 CB LEU A 80 -5.673 20.373 0.644 1.00 0.19 C ATOM 1279 CG LEU A 80 -5.018 21.577 1.320 1.00 0.22 C ATOM 1280 CD1 LEU A 80 -5.851 22.040 2.500 1.00 0.25 C ATOM 1281 CD2 LEU A 80 -3.602 21.242 1.757 1.00 0.23 C ATOM 1282 H LEU A 80 -6.812 18.656 -0.785 1.00 0.10 H ATOM 1283 HA LEU A 80 -7.666 21.066 0.290 1.00 0.22 H ATOM 1284 HB2 LEU A 80 -6.045 19.708 1.412 1.00 0.19 H ATOM 1285 HB3 LEU A 80 -4.919 19.852 0.074 1.00 0.17 H ATOM 1286 HG LEU A 80 -4.967 22.390 0.613 1.00 0.22 H ATOM 1287 HD11 LEU A 80 -5.885 21.258 3.243 1.00 0.23 H ATOM 1288 HD12 LEU A 80 -6.852 22.263 2.165 1.00 0.27 H ATOM 1289 HD13 LEU A 80 -5.407 22.927 2.927 1.00 0.27 H ATOM 1290 HD21 LEU A 80 -3.616 20.354 2.372 1.00 0.22 H ATOM 1291 HD22 LEU A 80 -3.196 22.067 2.322 1.00 0.23 H ATOM 1292 HD23 LEU A 80 -2.990 21.068 0.884 1.00 0.25 H ATOM 1293 N ARG A 81 -5.699 21.409 -2.323 1.00 0.17 N ATOM 1294 CA ARG A 81 -5.201 22.354 -3.310 1.00 0.21 C ATOM 1295 C ARG A 81 -6.336 22.945 -4.143 1.00 0.22 C ATOM 1296 O ARG A 81 -6.333 24.139 -4.445 1.00 0.31 O ATOM 1297 CB ARG A 81 -4.170 21.681 -4.219 1.00 0.21 C ATOM 1298 CG ARG A 81 -3.023 21.032 -3.458 1.00 0.25 C ATOM 1299 CD ARG A 81 -1.833 20.762 -4.362 1.00 0.43 C ATOM 1300 NE ARG A 81 -1.273 21.998 -4.908 1.00 0.50 N ATOM 1301 CZ ARG A 81 -0.080 22.088 -5.495 1.00 0.50 C ATOM 1302 NH1 ARG A 81 0.713 21.025 -5.583 1.00 0.71 N1+ ATOM 1303 NH2 ARG A 81 0.327 23.256 -5.975 1.00 0.54 N ATOM 1304 H ARG A 81 -5.519 20.451 -2.442 1.00 0.14 H ATOM 1305 HA ARG A 81 -4.716 23.159 -2.776 1.00 0.24 H ATOM 1306 HB2 ARG A 81 -4.667 20.920 -4.801 1.00 0.18 H ATOM 1307 HB3 ARG A 81 -3.756 22.421 -4.888 1.00 0.24 H ATOM 1308 HG2 ARG A 81 -2.714 21.689 -2.659 1.00 0.20 H ATOM 1309 HG3 ARG A 81 -3.365 20.097 -3.043 1.00 0.26 H ATOM 1310 HD2 ARG A 81 -1.069 20.255 -3.790 1.00 0.53 H ATOM 1311 HD3 ARG A 81 -2.152 20.131 -5.178 1.00 0.43 H ATOM 1312 HE ARG A 81 -1.827 22.810 -4.839 1.00 0.70 H ATOM 1313 HH11 ARG A 81 0.423 20.141 -5.207 1.00 0.80 H ATOM 1314 HH12 ARG A 81 1.608 21.100 -6.033 1.00 0.87 H ATOM 1315 HH21 ARG A 81 -0.264 24.066 -5.897 1.00 0.71 H ATOM 1316 HH22 ARG A 81 1.224 23.336 -6.418 1.00 0.55 H ATOM 1317 N GLU A 82 -7.320 22.125 -4.494 1.00 0.13 N ATOM 1318 CA GLU A 82 -8.434 22.601 -5.303 1.00 0.14 C ATOM 1319 C GLU A 82 -9.403 23.449 -4.470 1.00 0.14 C ATOM 1320 O GLU A 82 -10.034 24.369 -4.988 1.00 0.14 O ATOM 1321 CB GLU A 82 -9.157 21.428 -5.982 1.00 0.14 C ATOM 1322 CG GLU A 82 -10.170 20.704 -5.106 1.00 0.06 C ATOM 1323 CD GLU A 82 -11.571 21.268 -5.243 1.00 0.18 C ATOM 1324 OE1 GLU A 82 -11.921 21.756 -6.342 1.00 0.84 O ATOM 1325 OE2 GLU A 82 -12.333 21.217 -4.254 1.00 1.21 O1- ATOM 1326 H GLU A 82 -7.294 21.184 -4.209 1.00 0.09 H ATOM 1327 HA GLU A 82 -8.015 23.228 -6.071 1.00 0.14 H ATOM 1328 HB2 GLU A 82 -9.674 21.800 -6.852 1.00 0.21 H ATOM 1329 HB3 GLU A 82 -8.416 20.709 -6.301 1.00 0.17 H ATOM 1330 HG2 GLU A 82 -10.189 19.663 -5.386 1.00 0.11 H ATOM 1331 HG3 GLU A 82 -9.861 20.795 -4.075 1.00 0.21 H ATOM 1332 N GLN A 83 -9.495 23.149 -3.176 1.00 0.14 N ATOM 1333 CA GLN A 83 -10.392 23.875 -2.274 1.00 0.14 C ATOM 1334 C GLN A 83 -9.891 25.289 -2.002 1.00 0.13 C ATOM 1335 O GLN A 83 -10.646 26.146 -1.543 1.00 0.13 O ATOM 1336 CB GLN A 83 -10.543 23.125 -0.943 1.00 0.14 C ATOM 1337 CG GLN A 83 -11.259 21.789 -1.059 1.00 0.11 C ATOM 1338 CD GLN A 83 -11.105 20.932 0.183 1.00 0.55 C ATOM 1339 OE1 GLN A 83 -10.126 21.051 0.924 1.00 0.86 O ATOM 1340 NE2 GLN A 83 -12.064 20.053 0.417 1.00 0.65 N ATOM 1341 H GLN A 83 -8.955 22.409 -2.819 1.00 0.14 H ATOM 1342 HA GLN A 83 -11.358 23.936 -2.750 1.00 0.14 H ATOM 1343 HB2 GLN A 83 -9.561 22.943 -0.534 1.00 0.14 H ATOM 1344 HB3 GLN A 83 -11.099 23.745 -0.256 1.00 0.16 H ATOM 1345 HG2 GLN A 83 -12.311 21.968 -1.223 1.00 0.31 H ATOM 1346 HG3 GLN A 83 -10.851 21.251 -1.902 1.00 0.31 H ATOM 1347 HE21 GLN A 83 -12.814 20.002 -0.217 1.00 0.50 H ATOM 1348 HE22 GLN A 83 -11.988 19.481 1.210 1.00 0.94 H ATOM 1349 N LEU A 84 -8.621 25.536 -2.296 1.00 0.13 N ATOM 1350 CA LEU A 84 -8.027 26.848 -2.054 1.00 0.10 C ATOM 1351 C LEU A 84 -8.144 27.762 -3.267 1.00 0.05 C ATOM 1352 O LEU A 84 -8.035 28.984 -3.143 1.00 0.17 O ATOM 1353 CB LEU A 84 -6.552 26.710 -1.656 1.00 0.13 C ATOM 1354 CG LEU A 84 -6.229 27.002 -0.180 1.00 0.14 C ATOM 1355 CD1 LEU A 84 -6.526 28.458 0.169 1.00 0.15 C ATOM 1356 CD2 LEU A 84 -6.999 26.066 0.746 1.00 0.15 C ATOM 1357 H LEU A 84 -8.072 24.823 -2.685 1.00 0.14 H ATOM 1358 HA LEU A 84 -8.567 27.299 -1.238 1.00 0.14 H ATOM 1359 HB2 LEU A 84 -6.233 25.703 -1.882 1.00 0.19 H ATOM 1360 HB3 LEU A 84 -5.976 27.389 -2.266 1.00 0.11 H ATOM 1361 HG LEU A 84 -5.173 26.835 -0.018 1.00 0.15 H ATOM 1362 HD11 LEU A 84 -6.088 29.107 -0.574 1.00 0.87 H ATOM 1363 HD12 LEU A 84 -6.104 28.688 1.135 1.00 0.82 H ATOM 1364 HD13 LEU A 84 -7.593 28.617 0.201 1.00 0.98 H ATOM 1365 HD21 LEU A 84 -8.059 26.200 0.598 1.00 0.66 H ATOM 1366 HD22 LEU A 84 -6.748 26.292 1.771 1.00 0.85 H ATOM 1367 HD23 LEU A 84 -6.732 25.041 0.530 1.00 0.90 H ATOM 1368 N LYS A 85 -8.376 27.180 -4.432 1.00 0.12 N ATOM 1369 CA LYS A 85 -8.484 27.966 -5.652 1.00 0.08 C ATOM 1370 C LYS A 85 -9.926 28.046 -6.130 1.00 0.11 C ATOM 1371 O LYS A 85 -10.787 27.292 -5.674 1.00 0.11 O ATOM 1372 CB LYS A 85 -7.597 27.379 -6.755 1.00 0.02 C ATOM 1373 CG LYS A 85 -8.058 26.022 -7.260 1.00 0.15 C ATOM 1374 CD LYS A 85 -7.154 25.490 -8.359 1.00 0.18 C ATOM 1375 CE LYS A 85 -7.410 26.192 -9.682 1.00 0.27 C ATOM 1376 NZ LYS A 85 -6.648 25.572 -10.792 1.00 0.48 N1+ ATOM 1377 H LYS A 85 -8.492 26.208 -4.470 1.00 0.23 H ATOM 1378 HA LYS A 85 -8.143 28.965 -5.426 1.00 0.10 H ATOM 1379 HB2 LYS A 85 -7.583 28.066 -7.588 1.00 0.09 H ATOM 1380 HB3 LYS A 85 -6.593 27.273 -6.372 1.00 0.09 H ATOM 1381 HG2 LYS A 85 -8.051 25.327 -6.440 1.00 0.21 H ATOM 1382 HG3 LYS A 85 -9.061 26.115 -7.648 1.00 0.21 H ATOM 1383 HD2 LYS A 85 -6.126 25.650 -8.074 1.00 0.09 H ATOM 1384 HD3 LYS A 85 -7.335 24.433 -8.482 1.00 0.30 H ATOM 1385 HE2 LYS A 85 -8.464 26.134 -9.905 1.00 0.29 H ATOM 1386 HE3 LYS A 85 -7.118 27.224 -9.591 1.00 0.24 H ATOM 1387 HZ1 LYS A 85 -6.681 26.182 -11.634 1.00 0.51 H ATOM 1388 HZ2 LYS A 85 -7.056 24.646 -11.034 1.00 0.50 H ATOM 1389 HZ3 LYS A 85 -5.655 25.439 -10.516 1.00 0.66 H ATOM 1390 N LYS A 86 -10.178 28.977 -7.034 1.00 0.23 N ATOM 1391 CA LYS A 86 -11.506 29.171 -7.591 1.00 0.30 C ATOM 1392 C LYS A 86 -11.532 28.722 -9.044 1.00 0.31 C ATOM 1393 O LYS A 86 -10.931 29.414 -9.894 1.00 0.34 O ATOM 1394 CB LYS A 86 -11.917 30.642 -7.480 1.00 0.35 C ATOM 1395 CG LYS A 86 -13.327 30.925 -7.972 1.00 0.42 C ATOM 1396 CD LYS A 86 -13.736 32.365 -7.706 1.00 0.38 C ATOM 1397 CE LYS A 86 -13.984 32.612 -6.226 1.00 0.40 C ATOM 1398 NZ LYS A 86 -14.737 33.871 -5.989 1.00 0.64 N1+ ATOM 1399 OXT LYS A 86 -12.145 27.671 -9.333 1.00 0.35 O1- ATOM 1400 H LYS A 86 -9.449 29.553 -7.340 1.00 0.28 H ATOM 1401 HA LYS A 86 -12.199 28.567 -7.024 1.00 0.32 H ATOM 1402 HB2 LYS A 86 -11.855 30.943 -6.444 1.00 0.47 H ATOM 1403 HB3 LYS A 86 -11.233 31.242 -8.060 1.00 0.25 H ATOM 1404 HG2 LYS A 86 -13.372 30.739 -9.035 1.00 0.61 H ATOM 1405 HG3 LYS A 86 -14.014 30.267 -7.461 1.00 0.44 H ATOM 1406 HD2 LYS A 86 -12.946 33.020 -8.041 1.00 0.46 H ATOM 1407 HD3 LYS A 86 -14.642 32.578 -8.252 1.00 0.61 H ATOM 1408 HE2 LYS A 86 -14.553 31.784 -5.828 1.00 0.43 H ATOM 1409 HE3 LYS A 86 -13.033 32.669 -5.718 1.00 0.75 H ATOM 1410 HZ1 LYS A 86 -14.271 34.668 -6.470 1.00 0.69 H ATOM 1411 HZ2 LYS A 86 -14.776 34.075 -4.969 1.00 0.74 H ATOM 1412 HZ3 LYS A 86 -15.708 33.781 -6.347 1.00 1.03 H TER 1413 LYS A 86 ATOM 1414 N GLY B 1 -29.623 -6.375 16.708 1.00 1.09 N ATOM 1415 CA GLY B 1 -29.033 -5.421 15.741 1.00 0.31 C ATOM 1416 C GLY B 1 -29.870 -4.172 15.613 1.00 0.29 C ATOM 1417 O GLY B 1 -31.101 -4.232 15.684 1.00 0.69 O ATOM 1418 H1 GLY B 1 -29.648 -5.951 17.655 1.00 1.85 H ATOM 1419 H2 GLY B 1 -29.058 -7.245 16.743 1.00 1.53 H ATOM 1420 H3 GLY B 1 -30.593 -6.614 16.424 1.00 0.98 H ATOM 1421 HA2 GLY B 1 -28.047 -5.146 16.080 1.00 0.68 H ATOM 1422 HA3 GLY B 1 -28.957 -5.898 14.776 1.00 1.20 H ATOM 1423 N SER B 2 -29.210 -3.039 15.429 1.00 0.38 N ATOM 1424 CA SER B 2 -29.897 -1.767 15.297 1.00 0.63 C ATOM 1425 C SER B 2 -30.340 -1.536 13.855 1.00 0.42 C ATOM 1426 O SER B 2 -30.000 -2.310 12.955 1.00 0.44 O ATOM 1427 CB SER B 2 -28.971 -0.638 15.751 1.00 1.08 C ATOM 1428 OG SER B 2 -27.758 -1.157 16.277 1.00 1.47 O ATOM 1429 H SER B 2 -28.231 -3.054 15.380 1.00 0.60 H ATOM 1430 HA SER B 2 -30.767 -1.790 15.935 1.00 0.79 H ATOM 1431 HB2 SER B 2 -28.740 -0.004 14.906 1.00 0.94 H ATOM 1432 HB3 SER B 2 -29.465 -0.056 16.516 1.00 1.36 H ATOM 1433 HG SER B 2 -27.910 -1.493 17.170 1.00 1.74 H ATOM 1434 N HIS B 3 -31.107 -0.478 13.642 1.00 0.34 N ATOM 1435 CA HIS B 3 -31.588 -0.137 12.312 1.00 0.24 C ATOM 1436 C HIS B 3 -30.616 0.827 11.636 1.00 0.25 C ATOM 1437 O HIS B 3 -30.222 1.839 12.214 1.00 0.45 O ATOM 1438 CB HIS B 3 -32.992 0.483 12.400 1.00 0.41 C ATOM 1439 CG HIS B 3 -33.440 1.188 11.150 1.00 0.33 C ATOM 1440 ND1 HIS B 3 -33.509 2.564 11.044 1.00 0.95 N ATOM 1441 CD2 HIS B 3 -33.838 0.701 9.952 1.00 1.09 C ATOM 1442 CE1 HIS B 3 -33.929 2.888 9.834 1.00 1.27 C ATOM 1443 NE2 HIS B 3 -34.133 1.777 9.154 1.00 1.42 N ATOM 1444 H HIS B 3 -31.358 0.092 14.400 1.00 0.47 H ATOM 1445 HA HIS B 3 -31.637 -1.047 11.735 1.00 0.23 H ATOM 1446 HB2 HIS B 3 -33.706 -0.298 12.610 1.00 0.98 H ATOM 1447 HB3 HIS B 3 -33.007 1.200 13.207 1.00 0.86 H ATOM 1448 HD1 HIS B 3 -33.290 3.210 11.757 1.00 1.44 H ATOM 1449 HD2 HIS B 3 -33.910 -0.342 9.676 1.00 1.63 H ATOM 1450 HE1 HIS B 3 -34.082 3.893 9.465 1.00 1.73 H ATOM 1451 HE2 HIS B 3 -34.458 1.730 8.228 1.00 1.97 H ATOM 1452 N MET B 4 -30.228 0.503 10.415 1.00 0.16 N ATOM 1453 CA MET B 4 -29.314 1.347 9.666 1.00 0.18 C ATOM 1454 C MET B 4 -30.064 2.499 9.015 1.00 0.37 C ATOM 1455 O MET B 4 -30.978 2.290 8.219 1.00 0.82 O ATOM 1456 CB MET B 4 -28.572 0.533 8.604 1.00 0.24 C ATOM 1457 CG MET B 4 -27.349 -0.192 9.141 1.00 0.26 C ATOM 1458 SD MET B 4 -26.175 0.924 9.930 1.00 0.45 S ATOM 1459 CE MET B 4 -24.948 -0.242 10.522 1.00 0.61 C ATOM 1460 H MET B 4 -30.562 -0.326 10.006 1.00 0.26 H ATOM 1461 HA MET B 4 -28.595 1.750 10.361 1.00 0.18 H ATOM 1462 HB2 MET B 4 -29.246 -0.203 8.192 1.00 0.30 H ATOM 1463 HB3 MET B 4 -28.253 1.198 7.814 1.00 0.34 H ATOM 1464 HG2 MET B 4 -27.671 -0.924 9.865 1.00 0.39 H ATOM 1465 HG3 MET B 4 -26.856 -0.691 8.318 1.00 0.19 H ATOM 1466 HE1 MET B 4 -24.174 0.288 11.058 1.00 0.60 H ATOM 1467 HE2 MET B 4 -24.511 -0.762 9.684 1.00 0.76 H ATOM 1468 HE3 MET B 4 -25.418 -0.954 11.182 1.00 0.62 H ATOM 1469 N THR B 5 -29.689 3.711 9.383 1.00 0.18 N ATOM 1470 CA THR B 5 -30.310 4.906 8.839 1.00 0.33 C ATOM 1471 C THR B 5 -29.228 5.866 8.346 1.00 0.22 C ATOM 1472 O THR B 5 -29.430 7.079 8.258 1.00 0.16 O ATOM 1473 CB THR B 5 -31.207 5.598 9.897 1.00 0.59 C ATOM 1474 OG1 THR B 5 -31.854 6.745 9.332 1.00 0.29 O ATOM 1475 CG2 THR B 5 -30.397 6.014 11.118 1.00 0.99 C ATOM 1476 H THR B 5 -28.968 3.809 10.040 1.00 0.38 H ATOM 1477 HA THR B 5 -30.927 4.613 8.001 1.00 0.41 H ATOM 1478 HB THR B 5 -31.964 4.894 10.212 1.00 0.89 H ATOM 1479 HG1 THR B 5 -31.230 7.207 8.751 1.00 0.56 H ATOM 1480 HG21 THR B 5 -29.598 6.673 10.813 1.00 1.32 H ATOM 1481 HG22 THR B 5 -29.979 5.138 11.589 1.00 1.84 H ATOM 1482 HG23 THR B 5 -31.039 6.529 11.818 1.00 0.81 H ATOM 1483 N GLU B 6 -28.076 5.299 8.020 1.00 0.23 N ATOM 1484 CA GLU B 6 -26.943 6.075 7.543 1.00 0.17 C ATOM 1485 C GLU B 6 -26.051 5.210 6.668 1.00 0.23 C ATOM 1486 O GLU B 6 -26.277 4.006 6.547 1.00 0.52 O ATOM 1487 CB GLU B 6 -26.136 6.614 8.731 1.00 0.15 C ATOM 1488 CG GLU B 6 -25.648 5.528 9.681 1.00 0.15 C ATOM 1489 CD GLU B 6 -24.653 6.046 10.700 1.00 1.15 C ATOM 1490 OE1 GLU B 6 -24.199 7.200 10.559 1.00 1.76 O ATOM 1491 OE2 GLU B 6 -24.319 5.302 11.644 1.00 1.72 O1- ATOM 1492 H GLU B 6 -27.986 4.327 8.086 1.00 0.29 H ATOM 1493 HA GLU B 6 -27.319 6.902 6.963 1.00 0.15 H ATOM 1494 HB2 GLU B 6 -25.277 7.147 8.355 1.00 0.11 H ATOM 1495 HB3 GLU B 6 -26.756 7.300 9.292 1.00 0.20 H ATOM 1496 HG2 GLU B 6 -26.497 5.119 10.208 1.00 0.87 H ATOM 1497 HG3 GLU B 6 -25.176 4.748 9.102 1.00 1.00 H ATOM 1498 N GLN B 7 -25.054 5.827 6.054 1.00 0.15 N ATOM 1499 CA GLN B 7 -24.114 5.104 5.214 1.00 0.22 C ATOM 1500 C GLN B 7 -22.734 5.096 5.863 1.00 0.22 C ATOM 1501 O GLN B 7 -21.928 6.004 5.645 1.00 0.45 O ATOM 1502 CB GLN B 7 -24.037 5.723 3.819 1.00 0.57 C ATOM 1503 CG GLN B 7 -25.101 5.204 2.865 1.00 0.48 C ATOM 1504 CD GLN B 7 -24.655 5.252 1.418 1.00 0.33 C ATOM 1505 OE1 GLN B 7 -23.927 6.156 1.004 1.00 0.26 O ATOM 1506 NE2 GLN B 7 -25.081 4.275 0.638 1.00 0.86 N ATOM 1507 H GLN B 7 -24.952 6.795 6.165 1.00 0.32 H ATOM 1508 HA GLN B 7 -24.464 4.088 5.129 1.00 0.30 H ATOM 1509 HB2 GLN B 7 -24.152 6.794 3.905 1.00 1.25 H ATOM 1510 HB3 GLN B 7 -23.068 5.508 3.394 1.00 1.40 H ATOM 1511 HG2 GLN B 7 -25.328 4.180 3.121 1.00 1.28 H ATOM 1512 HG3 GLN B 7 -25.990 5.808 2.975 1.00 1.10 H ATOM 1513 HE21 GLN B 7 -25.655 3.584 1.035 1.00 1.15 H ATOM 1514 HE22 GLN B 7 -24.802 4.270 -0.302 1.00 1.01 H ATOM 1515 N PRO B 8 -22.454 4.087 6.696 1.00 0.27 N ATOM 1516 CA PRO B 8 -21.181 3.952 7.379 1.00 0.51 C ATOM 1517 C PRO B 8 -20.170 3.186 6.530 1.00 0.35 C ATOM 1518 O PRO B 8 -20.397 2.965 5.339 1.00 0.14 O ATOM 1519 CB PRO B 8 -21.543 3.155 8.648 1.00 0.80 C ATOM 1520 CG PRO B 8 -22.955 2.675 8.463 1.00 0.79 C ATOM 1521 CD PRO B 8 -23.350 2.986 7.045 1.00 0.38 C ATOM 1522 HA PRO B 8 -20.774 4.913 7.652 1.00 0.68 H ATOM 1523 HB2 PRO B 8 -20.862 2.326 8.757 1.00 0.89 H ATOM 1524 HB3 PRO B 8 -21.463 3.801 9.510 1.00 0.98 H ATOM 1525 HG2 PRO B 8 -23.003 1.610 8.634 1.00 0.94 H ATOM 1526 HG3 PRO B 8 -23.605 3.192 9.154 1.00 1.05 H ATOM 1527 HD2 PRO B 8 -23.181 2.132 6.406 1.00 0.51 H ATOM 1528 HD3 PRO B 8 -24.382 3.299 7.000 1.00 0.23 H ATOM 1529 N LYS B 9 -19.051 2.813 7.139 1.00 0.47 N ATOM 1530 CA LYS B 9 -18.018 2.045 6.449 1.00 0.33 C ATOM 1531 C LYS B 9 -18.573 0.691 5.999 1.00 0.35 C ATOM 1532 O LYS B 9 -18.553 -0.291 6.744 1.00 0.52 O ATOM 1533 CB LYS B 9 -16.784 1.853 7.347 1.00 0.23 C ATOM 1534 CG LYS B 9 -17.102 1.358 8.755 1.00 0.28 C ATOM 1535 CD LYS B 9 -15.911 0.677 9.409 1.00 0.35 C ATOM 1536 CE LYS B 9 -16.157 0.462 10.894 1.00 0.69 C ATOM 1537 NZ LYS B 9 -16.353 1.746 11.617 1.00 0.89 N1+ ATOM 1538 H LYS B 9 -18.908 3.082 8.069 1.00 0.68 H ATOM 1539 HA LYS B 9 -17.729 2.604 5.573 1.00 0.32 H ATOM 1540 HB2 LYS B 9 -16.126 1.138 6.880 1.00 0.21 H ATOM 1541 HB3 LYS B 9 -16.268 2.797 7.431 1.00 0.20 H ATOM 1542 HG2 LYS B 9 -17.386 2.198 9.366 1.00 0.31 H ATOM 1543 HG3 LYS B 9 -17.920 0.655 8.705 1.00 0.51 H ATOM 1544 HD2 LYS B 9 -15.749 -0.282 8.938 1.00 0.42 H ATOM 1545 HD3 LYS B 9 -15.035 1.294 9.285 1.00 0.33 H ATOM 1546 HE2 LYS B 9 -17.041 -0.143 11.015 1.00 0.69 H ATOM 1547 HE3 LYS B 9 -15.309 -0.052 11.315 1.00 0.86 H ATOM 1548 HZ1 LYS B 9 -16.464 1.570 12.637 1.00 0.83 H ATOM 1549 HZ2 LYS B 9 -17.204 2.231 11.269 1.00 1.17 H ATOM 1550 HZ3 LYS B 9 -15.533 2.368 11.473 1.00 0.89 H ATOM 1551 N THR B 10 -19.088 0.655 4.783 1.00 0.33 N ATOM 1552 CA THR B 10 -19.671 -0.552 4.231 1.00 0.31 C ATOM 1553 C THR B 10 -18.590 -1.536 3.782 1.00 0.23 C ATOM 1554 O THR B 10 -17.415 -1.185 3.684 1.00 0.23 O ATOM 1555 CB THR B 10 -20.613 -0.213 3.052 1.00 0.36 C ATOM 1556 OG1 THR B 10 -21.552 -1.278 2.847 1.00 0.42 O ATOM 1557 CG2 THR B 10 -19.835 0.041 1.766 1.00 0.28 C ATOM 1558 H THR B 10 -19.087 1.474 4.243 1.00 0.44 H ATOM 1559 HA THR B 10 -20.258 -1.016 5.009 1.00 0.35 H ATOM 1560 HB THR B 10 -21.158 0.686 3.303 1.00 0.43 H ATOM 1561 HG1 THR B 10 -22.447 -0.937 2.957 1.00 0.68 H ATOM 1562 HG21 THR B 10 -19.132 0.846 1.920 1.00 0.27 H ATOM 1563 HG22 THR B 10 -20.522 0.310 0.977 1.00 0.37 H ATOM 1564 HG23 THR B 10 -19.300 -0.854 1.486 1.00 0.21 H ATOM 1565 N ARG B 11 -18.996 -2.769 3.530 1.00 0.25 N ATOM 1566 CA ARG B 11 -18.071 -3.797 3.089 1.00 0.21 C ATOM 1567 C ARG B 11 -18.195 -3.984 1.582 1.00 0.27 C ATOM 1568 O ARG B 11 -19.303 -4.055 1.046 1.00 0.53 O ATOM 1569 CB ARG B 11 -18.342 -5.114 3.824 1.00 0.24 C ATOM 1570 CG ARG B 11 -18.574 -4.931 5.317 1.00 0.31 C ATOM 1571 CD ARG B 11 -18.412 -6.238 6.079 1.00 0.68 C ATOM 1572 NE ARG B 11 -19.560 -6.527 6.941 1.00 1.23 N ATOM 1573 CZ ARG B 11 -19.781 -5.952 8.125 1.00 1.21 C ATOM 1574 NH1 ARG B 11 -18.956 -5.018 8.587 1.00 1.36 N1+ ATOM 1575 NH2 ARG B 11 -20.838 -6.309 8.840 1.00 1.72 N ATOM 1576 H ARG B 11 -19.945 -2.988 3.631 1.00 0.34 H ATOM 1577 HA ARG B 11 -17.071 -3.462 3.319 1.00 0.16 H ATOM 1578 HB2 ARG B 11 -19.217 -5.583 3.398 1.00 0.29 H ATOM 1579 HB3 ARG B 11 -17.493 -5.766 3.694 1.00 0.24 H ATOM 1580 HG2 ARG B 11 -17.856 -4.216 5.694 1.00 0.57 H ATOM 1581 HG3 ARG B 11 -19.574 -4.555 5.472 1.00 0.93 H ATOM 1582 HD2 ARG B 11 -18.304 -7.042 5.367 1.00 0.87 H ATOM 1583 HD3 ARG B 11 -17.524 -6.175 6.689 1.00 0.93 H ATOM 1584 HE ARG B 11 -20.199 -7.204 6.623 1.00 1.86 H ATOM 1585 HH11 ARG B 11 -18.160 -4.740 8.052 1.00 1.44 H ATOM 1586 HH12 ARG B 11 -19.135 -4.578 9.473 1.00 1.80 H ATOM 1587 HH21 ARG B 11 -21.471 -7.003 8.489 1.00 2.21 H ATOM 1588 HH22 ARG B 11 -21.002 -5.902 9.741 1.00 1.80 H ATOM 1589 N VAL B 12 -17.066 -4.045 0.901 1.00 0.16 N ATOM 1590 CA VAL B 12 -17.063 -4.195 -0.542 1.00 0.15 C ATOM 1591 C VAL B 12 -16.272 -5.430 -0.968 1.00 0.12 C ATOM 1592 O VAL B 12 -15.293 -5.811 -0.322 1.00 0.17 O ATOM 1593 CB VAL B 12 -16.480 -2.935 -1.227 1.00 0.19 C ATOM 1594 CG1 VAL B 12 -14.994 -2.788 -0.931 1.00 0.13 C ATOM 1595 CG2 VAL B 12 -16.733 -2.958 -2.727 1.00 0.25 C ATOM 1596 H VAL B 12 -16.207 -4.008 1.383 1.00 0.29 H ATOM 1597 HA VAL B 12 -18.085 -4.310 -0.864 1.00 0.15 H ATOM 1598 HB VAL B 12 -16.985 -2.070 -0.820 1.00 0.23 H ATOM 1599 HG11 VAL B 12 -14.497 -3.727 -1.117 1.00 0.10 H ATOM 1600 HG12 VAL B 12 -14.858 -2.507 0.104 1.00 0.16 H ATOM 1601 HG13 VAL B 12 -14.574 -2.026 -1.570 1.00 0.17 H ATOM 1602 HG21 VAL B 12 -16.266 -3.832 -3.156 1.00 0.23 H ATOM 1603 HG22 VAL B 12 -16.315 -2.070 -3.178 1.00 0.29 H ATOM 1604 HG23 VAL B 12 -17.796 -2.990 -2.913 1.00 0.29 H ATOM 1605 N SER B 13 -16.725 -6.065 -2.037 1.00 0.09 N ATOM 1606 CA SER B 13 -16.068 -7.244 -2.571 1.00 0.12 C ATOM 1607 C SER B 13 -15.071 -6.838 -3.657 1.00 0.18 C ATOM 1608 O SER B 13 -15.431 -6.136 -4.609 1.00 0.48 O ATOM 1609 CB SER B 13 -17.123 -8.195 -3.138 1.00 0.12 C ATOM 1610 OG SER B 13 -18.433 -7.739 -2.812 1.00 0.38 O ATOM 1611 H SER B 13 -17.531 -5.735 -2.481 1.00 0.12 H ATOM 1612 HA SER B 13 -15.543 -7.733 -1.764 1.00 0.13 H ATOM 1613 HB2 SER B 13 -17.028 -8.242 -4.214 1.00 0.36 H ATOM 1614 HB3 SER B 13 -16.982 -9.182 -2.718 1.00 0.42 H ATOM 1615 HG SER B 13 -18.513 -7.659 -1.850 1.00 1.14 H ATOM 1616 N VAL B 14 -13.819 -7.247 -3.499 1.00 0.14 N ATOM 1617 CA VAL B 14 -12.777 -6.923 -4.461 1.00 0.13 C ATOM 1618 C VAL B 14 -12.080 -8.194 -4.940 1.00 0.09 C ATOM 1619 O VAL B 14 -11.506 -8.939 -4.147 1.00 0.19 O ATOM 1620 CB VAL B 14 -11.728 -5.937 -3.883 1.00 0.15 C ATOM 1621 CG1 VAL B 14 -12.283 -4.521 -3.843 1.00 0.27 C ATOM 1622 CG2 VAL B 14 -11.266 -6.363 -2.494 1.00 0.17 C ATOM 1623 H VAL B 14 -13.595 -7.805 -2.719 1.00 0.35 H ATOM 1624 HA VAL B 14 -13.252 -6.449 -5.312 1.00 0.19 H ATOM 1625 HB VAL B 14 -10.869 -5.940 -4.536 1.00 0.11 H ATOM 1626 HG11 VAL B 14 -11.524 -3.847 -3.473 1.00 0.58 H ATOM 1627 HG12 VAL B 14 -13.142 -4.490 -3.188 1.00 1.03 H ATOM 1628 HG13 VAL B 14 -12.577 -4.220 -4.838 1.00 1.10 H ATOM 1629 HG21 VAL B 14 -10.909 -7.381 -2.529 1.00 0.27 H ATOM 1630 HG22 VAL B 14 -12.090 -6.293 -1.802 1.00 0.33 H ATOM 1631 HG23 VAL B 14 -10.467 -5.714 -2.167 1.00 0.15 H ATOM 1632 N ARG B 15 -12.147 -8.445 -6.238 1.00 0.17 N ATOM 1633 CA ARG B 15 -11.534 -9.630 -6.813 1.00 0.12 C ATOM 1634 C ARG B 15 -10.126 -9.332 -7.319 1.00 0.08 C ATOM 1635 O ARG B 15 -9.941 -8.556 -8.258 1.00 0.12 O ATOM 1636 CB ARG B 15 -12.400 -10.184 -7.946 1.00 0.19 C ATOM 1637 CG ARG B 15 -12.273 -11.689 -8.115 1.00 0.32 C ATOM 1638 CD ARG B 15 -13.365 -12.254 -9.011 1.00 0.37 C ATOM 1639 NE ARG B 15 -13.105 -11.998 -10.425 1.00 0.23 N ATOM 1640 CZ ARG B 15 -13.928 -12.352 -11.412 1.00 0.17 C ATOM 1641 NH1 ARG B 15 -15.060 -12.992 -11.141 1.00 0.20 N1+ ATOM 1642 NH2 ARG B 15 -13.610 -12.080 -12.672 1.00 0.33 N ATOM 1643 H ARG B 15 -12.626 -7.824 -6.822 1.00 0.29 H ATOM 1644 HA ARG B 15 -11.470 -10.371 -6.036 1.00 0.09 H ATOM 1645 HB2 ARG B 15 -13.434 -9.949 -7.742 1.00 0.11 H ATOM 1646 HB3 ARG B 15 -12.109 -9.713 -8.874 1.00 0.33 H ATOM 1647 HG2 ARG B 15 -11.313 -11.910 -8.555 1.00 0.45 H ATOM 1648 HG3 ARG B 15 -12.340 -12.157 -7.143 1.00 0.32 H ATOM 1649 HD2 ARG B 15 -13.425 -13.320 -8.855 1.00 0.42 H ATOM 1650 HD3 ARG B 15 -14.308 -11.799 -8.739 1.00 0.56 H ATOM 1651 HE ARG B 15 -12.265 -11.537 -10.650 1.00 0.30 H ATOM 1652 HH11 ARG B 15 -15.304 -13.215 -10.192 1.00 0.38 H ATOM 1653 HH12 ARG B 15 -15.682 -13.251 -11.885 1.00 0.14 H ATOM 1654 HH21 ARG B 15 -12.750 -11.613 -12.887 1.00 0.48 H ATOM 1655 HH22 ARG B 15 -14.235 -12.340 -13.418 1.00 0.36 H ATOM 1656 N ILE B 16 -9.137 -9.942 -6.682 1.00 0.03 N ATOM 1657 CA ILE B 16 -7.747 -9.765 -7.061 1.00 0.08 C ATOM 1658 C ILE B 16 -7.147 -11.117 -7.424 1.00 0.13 C ATOM 1659 O ILE B 16 -7.219 -12.062 -6.633 1.00 0.15 O ATOM 1660 CB ILE B 16 -6.924 -9.122 -5.923 1.00 0.10 C ATOM 1661 CG1 ILE B 16 -7.630 -7.869 -5.391 1.00 0.11 C ATOM 1662 CG2 ILE B 16 -5.524 -8.780 -6.413 1.00 0.15 C ATOM 1663 CD1 ILE B 16 -7.056 -7.349 -4.088 1.00 0.15 C ATOM 1664 H ILE B 16 -9.349 -10.539 -5.926 1.00 0.04 H ATOM 1665 HA ILE B 16 -7.710 -9.117 -7.924 1.00 0.10 H ATOM 1666 HB ILE B 16 -6.834 -9.841 -5.125 1.00 0.09 H ATOM 1667 HG12 ILE B 16 -7.547 -7.080 -6.123 1.00 0.12 H ATOM 1668 HG13 ILE B 16 -8.673 -8.094 -5.229 1.00 0.10 H ATOM 1669 HG21 ILE B 16 -5.096 -9.640 -6.910 1.00 0.24 H ATOM 1670 HG22 ILE B 16 -4.904 -8.507 -5.572 1.00 0.13 H ATOM 1671 HG23 ILE B 16 -5.575 -7.952 -7.105 1.00 0.16 H ATOM 1672 HD11 ILE B 16 -6.061 -6.969 -4.258 1.00 0.18 H ATOM 1673 HD12 ILE B 16 -7.015 -8.152 -3.364 1.00 0.19 H ATOM 1674 HD13 ILE B 16 -7.683 -6.554 -3.709 1.00 0.13 H ATOM 1675 N TYR B 17 -6.593 -11.210 -8.630 1.00 0.18 N ATOM 1676 CA TYR B 17 -5.987 -12.444 -9.128 1.00 0.25 C ATOM 1677 C TYR B 17 -7.012 -13.578 -9.191 1.00 0.24 C ATOM 1678 O TYR B 17 -6.658 -14.757 -9.150 1.00 0.27 O ATOM 1679 CB TYR B 17 -4.789 -12.847 -8.265 1.00 0.29 C ATOM 1680 CG TYR B 17 -3.475 -12.851 -9.018 1.00 0.23 C ATOM 1681 CD1 TYR B 17 -3.102 -11.770 -9.808 1.00 0.22 C ATOM 1682 CD2 TYR B 17 -2.606 -13.931 -8.932 1.00 0.27 C ATOM 1683 CE1 TYR B 17 -1.900 -11.766 -10.488 1.00 0.20 C ATOM 1684 CE2 TYR B 17 -1.402 -13.933 -9.611 1.00 0.31 C ATOM 1685 CZ TYR B 17 -1.055 -12.848 -10.385 1.00 0.26 C ATOM 1686 OH TYR B 17 0.146 -12.845 -11.061 1.00 0.34 O ATOM 1687 H TYR B 17 -6.575 -10.412 -9.210 1.00 0.19 H ATOM 1688 HA TYR B 17 -5.638 -12.248 -10.132 1.00 0.28 H ATOM 1689 HB2 TYR B 17 -4.697 -12.154 -7.442 1.00 0.38 H ATOM 1690 HB3 TYR B 17 -4.952 -13.842 -7.874 1.00 0.32 H ATOM 1691 HD1 TYR B 17 -3.765 -10.921 -9.887 1.00 0.28 H ATOM 1692 HD2 TYR B 17 -2.881 -14.780 -8.326 1.00 0.32 H ATOM 1693 HE1 TYR B 17 -1.624 -10.916 -11.097 1.00 0.21 H ATOM 1694 HE2 TYR B 17 -0.739 -14.783 -9.531 1.00 0.42 H ATOM 1695 HH TYR B 17 0.713 -12.137 -10.709 1.00 1.20 H ATOM 1696 N GLY B 18 -8.285 -13.210 -9.291 1.00 0.21 N ATOM 1697 CA GLY B 18 -9.339 -14.202 -9.376 1.00 0.22 C ATOM 1698 C GLY B 18 -10.037 -14.451 -8.052 1.00 0.22 C ATOM 1699 O GLY B 18 -11.163 -14.943 -8.026 1.00 0.24 O ATOM 1700 H GLY B 18 -8.507 -12.257 -9.308 1.00 0.20 H ATOM 1701 HA2 GLY B 18 -10.073 -13.868 -10.095 1.00 0.21 H ATOM 1702 HA3 GLY B 18 -8.913 -15.132 -9.725 1.00 0.26 H ATOM 1703 N GLN B 19 -9.390 -14.101 -6.950 1.00 0.20 N ATOM 1704 CA GLN B 19 -9.979 -14.320 -5.633 1.00 0.21 C ATOM 1705 C GLN B 19 -10.691 -13.064 -5.133 1.00 0.18 C ATOM 1706 O GLN B 19 -10.102 -11.983 -5.094 1.00 0.13 O ATOM 1707 CB GLN B 19 -8.902 -14.744 -4.633 1.00 0.22 C ATOM 1708 CG GLN B 19 -9.033 -16.185 -4.164 1.00 0.56 C ATOM 1709 CD GLN B 19 -10.332 -16.455 -3.422 1.00 0.86 C ATOM 1710 OE1 GLN B 19 -10.879 -17.555 -3.490 1.00 0.81 O ATOM 1711 NE2 GLN B 19 -10.831 -15.463 -2.699 1.00 1.36 N ATOM 1712 H GLN B 19 -8.506 -13.678 -7.021 1.00 0.18 H ATOM 1713 HA GLN B 19 -10.701 -15.117 -5.726 1.00 0.26 H ATOM 1714 HB2 GLN B 19 -7.933 -14.626 -5.093 1.00 0.11 H ATOM 1715 HB3 GLN B 19 -8.959 -14.100 -3.766 1.00 0.37 H ATOM 1716 HG2 GLN B 19 -8.993 -16.833 -5.027 1.00 0.67 H ATOM 1717 HG3 GLN B 19 -8.206 -16.414 -3.509 1.00 0.58 H ATOM 1718 HE21 GLN B 19 -10.343 -14.614 -2.672 1.00 1.54 H ATOM 1719 HE22 GLN B 19 -11.679 -15.617 -2.228 1.00 1.60 H ATOM 1720 N ASP B 20 -11.955 -13.211 -4.754 1.00 0.24 N ATOM 1721 CA ASP B 20 -12.744 -12.088 -4.259 1.00 0.24 C ATOM 1722 C ASP B 20 -12.663 -11.993 -2.740 1.00 0.23 C ATOM 1723 O ASP B 20 -12.878 -12.983 -2.035 1.00 0.23 O ATOM 1724 CB ASP B 20 -14.202 -12.221 -4.702 1.00 0.31 C ATOM 1725 CG ASP B 20 -15.072 -11.091 -4.188 1.00 0.41 C ATOM 1726 OD1 ASP B 20 -14.826 -9.931 -4.565 1.00 1.64 O ATOM 1727 OD2 ASP B 20 -16.013 -11.367 -3.411 1.00 0.39 O1- ATOM 1728 H ASP B 20 -12.371 -14.099 -4.804 1.00 0.28 H ATOM 1729 HA ASP B 20 -12.333 -11.189 -4.679 1.00 0.23 H ATOM 1730 HB2 ASP B 20 -14.244 -12.219 -5.782 1.00 0.70 H ATOM 1731 HB3 ASP B 20 -14.599 -13.155 -4.333 1.00 0.79 H ATOM 1732 N TYR B 21 -12.341 -10.807 -2.240 1.00 0.23 N ATOM 1733 CA TYR B 21 -12.228 -10.582 -0.805 1.00 0.22 C ATOM 1734 C TYR B 21 -13.191 -9.493 -0.357 1.00 0.24 C ATOM 1735 O TYR B 21 -13.464 -8.555 -1.103 1.00 0.36 O ATOM 1736 CB TYR B 21 -10.803 -10.169 -0.426 1.00 0.19 C ATOM 1737 CG TYR B 21 -9.724 -11.065 -0.987 1.00 0.17 C ATOM 1738 CD1 TYR B 21 -9.570 -12.371 -0.536 1.00 0.16 C ATOM 1739 CD2 TYR B 21 -8.857 -10.601 -1.967 1.00 0.17 C ATOM 1740 CE1 TYR B 21 -8.582 -13.188 -1.047 1.00 0.15 C ATOM 1741 CE2 TYR B 21 -7.868 -11.415 -2.483 1.00 0.16 C ATOM 1742 CZ TYR B 21 -7.736 -12.706 -2.018 1.00 0.15 C ATOM 1743 OH TYR B 21 -6.752 -13.519 -2.529 1.00 0.14 O ATOM 1744 H TYR B 21 -12.176 -10.056 -2.853 1.00 0.23 H ATOM 1745 HA TYR B 21 -12.476 -11.503 -0.300 1.00 0.22 H ATOM 1746 HB2 TYR B 21 -10.619 -9.168 -0.788 1.00 0.19 H ATOM 1747 HB3 TYR B 21 -10.713 -10.176 0.651 1.00 0.18 H ATOM 1748 HD1 TYR B 21 -10.237 -12.746 0.224 1.00 0.17 H ATOM 1749 HD2 TYR B 21 -8.964 -9.586 -2.328 1.00 0.18 H ATOM 1750 HE1 TYR B 21 -8.476 -14.200 -0.685 1.00 0.15 H ATOM 1751 HE2 TYR B 21 -7.203 -11.038 -3.245 1.00 0.17 H ATOM 1752 HH TYR B 21 -6.043 -12.977 -2.883 1.00 0.22 H ATOM 1753 N THR B 22 -13.702 -9.623 0.853 1.00 0.18 N ATOM 1754 CA THR B 22 -14.614 -8.635 1.406 1.00 0.18 C ATOM 1755 C THR B 22 -13.864 -7.689 2.342 1.00 0.16 C ATOM 1756 O THR B 22 -13.505 -8.062 3.458 1.00 0.21 O ATOM 1757 CB THR B 22 -15.761 -9.311 2.178 1.00 0.20 C ATOM 1758 OG1 THR B 22 -15.979 -10.632 1.665 1.00 0.54 O ATOM 1759 CG2 THR B 22 -17.041 -8.500 2.056 1.00 0.26 C ATOM 1760 H THR B 22 -13.470 -10.409 1.389 1.00 0.21 H ATOM 1761 HA THR B 22 -15.037 -8.069 0.589 1.00 0.19 H ATOM 1762 HB THR B 22 -15.488 -9.378 3.223 1.00 0.45 H ATOM 1763 HG1 THR B 22 -16.212 -10.581 0.728 1.00 1.31 H ATOM 1764 HG21 THR B 22 -17.352 -8.474 1.021 1.00 0.50 H ATOM 1765 HG22 THR B 22 -16.865 -7.495 2.406 1.00 0.51 H ATOM 1766 HG23 THR B 22 -17.814 -8.958 2.655 1.00 0.23 H ATOM 1767 N ILE B 23 -13.618 -6.472 1.880 1.00 0.11 N ATOM 1768 CA ILE B 23 -12.901 -5.490 2.680 1.00 0.11 C ATOM 1769 C ILE B 23 -13.800 -4.314 3.027 1.00 0.14 C ATOM 1770 O ILE B 23 -14.972 -4.285 2.651 1.00 0.32 O ATOM 1771 CB ILE B 23 -11.641 -4.966 1.955 1.00 0.07 C ATOM 1772 CG1 ILE B 23 -12.020 -4.335 0.609 1.00 0.07 C ATOM 1773 CG2 ILE B 23 -10.636 -6.096 1.759 1.00 0.03 C ATOM 1774 CD1 ILE B 23 -10.907 -3.526 -0.019 1.00 0.08 C ATOM 1775 H ILE B 23 -13.942 -6.221 0.985 1.00 0.10 H ATOM 1776 HA ILE B 23 -12.591 -5.968 3.597 1.00 0.12 H ATOM 1777 HB ILE B 23 -11.183 -4.215 2.581 1.00 0.08 H ATOM 1778 HG12 ILE B 23 -12.286 -5.116 -0.083 1.00 0.08 H ATOM 1779 HG13 ILE B 23 -12.868 -3.679 0.750 1.00 0.05 H ATOM 1780 HG21 ILE B 23 -9.681 -5.685 1.471 1.00 0.08 H ATOM 1781 HG22 ILE B 23 -10.989 -6.760 0.984 1.00 0.08 H ATOM 1782 HG23 ILE B 23 -10.529 -6.647 2.682 1.00 0.05 H ATOM 1783 HD11 ILE B 23 -10.083 -4.178 -0.259 1.00 0.10 H ATOM 1784 HD12 ILE B 23 -10.577 -2.766 0.674 1.00 0.09 H ATOM 1785 HD13 ILE B 23 -11.268 -3.057 -0.922 1.00 0.08 H ATOM 1786 N VAL B 24 -13.249 -3.349 3.742 1.00 0.16 N ATOM 1787 CA VAL B 24 -14.000 -2.171 4.139 1.00 0.17 C ATOM 1788 C VAL B 24 -13.896 -1.090 3.068 1.00 0.22 C ATOM 1789 O VAL B 24 -12.801 -0.628 2.747 1.00 0.28 O ATOM 1790 CB VAL B 24 -13.496 -1.602 5.484 1.00 0.19 C ATOM 1791 CG1 VAL B 24 -14.337 -0.411 5.916 1.00 0.20 C ATOM 1792 CG2 VAL B 24 -13.497 -2.677 6.560 1.00 0.18 C ATOM 1793 H VAL B 24 -12.307 -3.423 3.996 1.00 0.31 H ATOM 1794 HA VAL B 24 -15.036 -2.460 4.253 1.00 0.15 H ATOM 1795 HB VAL B 24 -12.478 -1.262 5.347 1.00 0.24 H ATOM 1796 HG11 VAL B 24 -13.980 -0.046 6.868 1.00 0.22 H ATOM 1797 HG12 VAL B 24 -15.369 -0.716 6.011 1.00 0.15 H ATOM 1798 HG13 VAL B 24 -14.260 0.373 5.179 1.00 0.30 H ATOM 1799 HG21 VAL B 24 -13.184 -2.245 7.499 1.00 0.19 H ATOM 1800 HG22 VAL B 24 -12.813 -3.465 6.283 1.00 0.19 H ATOM 1801 HG23 VAL B 24 -14.490 -3.084 6.662 1.00 0.21 H ATOM 1802 N GLY B 25 -15.034 -0.688 2.521 1.00 0.21 N ATOM 1803 CA GLY B 25 -15.044 0.334 1.498 1.00 0.27 C ATOM 1804 C GLY B 25 -15.379 1.692 2.066 1.00 0.07 C ATOM 1805 O GLY B 25 -16.382 2.302 1.700 1.00 0.28 O ATOM 1806 H GLY B 25 -15.885 -1.077 2.830 1.00 0.17 H ATOM 1807 HA2 GLY B 25 -14.068 0.377 1.039 1.00 0.41 H ATOM 1808 HA3 GLY B 25 -15.776 0.075 0.747 1.00 0.45 H ATOM 1809 N ALA B 26 -14.536 2.167 2.972 1.00 0.15 N ATOM 1810 CA ALA B 26 -14.746 3.460 3.602 1.00 0.36 C ATOM 1811 C ALA B 26 -14.222 4.589 2.716 1.00 0.34 C ATOM 1812 O ALA B 26 -13.277 5.290 3.083 1.00 0.57 O ATOM 1813 CB ALA B 26 -14.077 3.494 4.971 1.00 0.61 C ATOM 1814 H ALA B 26 -13.751 1.632 3.218 1.00 0.28 H ATOM 1815 HA ALA B 26 -15.808 3.592 3.744 1.00 0.44 H ATOM 1816 HB1 ALA B 26 -14.226 4.466 5.421 1.00 0.65 H ATOM 1817 HB2 ALA B 26 -13.021 3.305 4.861 1.00 0.75 H ATOM 1818 HB3 ALA B 26 -14.515 2.735 5.603 1.00 0.66 H ATOM 1819 N GLU B 27 -14.844 4.747 1.551 1.00 0.08 N ATOM 1820 CA GLU B 27 -14.470 5.778 0.589 1.00 0.06 C ATOM 1821 C GLU B 27 -15.438 5.745 -0.588 1.00 0.07 C ATOM 1822 O GLU B 27 -16.485 5.101 -0.511 1.00 0.08 O ATOM 1823 CB GLU B 27 -13.028 5.563 0.104 1.00 0.06 C ATOM 1824 CG GLU B 27 -12.136 6.790 0.234 1.00 0.97 C ATOM 1825 CD GLU B 27 -11.975 7.534 -1.073 1.00 1.82 C ATOM 1826 OE1 GLU B 27 -12.991 8.034 -1.605 1.00 2.18 O ATOM 1827 OE2 GLU B 27 -10.839 7.606 -1.577 1.00 2.44 O1- ATOM 1828 H GLU B 27 -15.590 4.147 1.329 1.00 0.17 H ATOM 1829 HA GLU B 27 -14.549 6.736 1.079 1.00 0.06 H ATOM 1830 HB2 GLU B 27 -12.583 4.763 0.678 1.00 0.65 H ATOM 1831 HB3 GLU B 27 -13.052 5.274 -0.935 1.00 0.68 H ATOM 1832 HG2 GLU B 27 -12.562 7.463 0.963 1.00 1.48 H ATOM 1833 HG3 GLU B 27 -11.163 6.470 0.570 1.00 0.82 H ATOM 1834 N SER B 28 -15.102 6.449 -1.659 1.00 0.08 N ATOM 1835 CA SER B 28 -15.944 6.485 -2.845 1.00 0.11 C ATOM 1836 C SER B 28 -15.948 5.122 -3.535 1.00 0.14 C ATOM 1837 O SER B 28 -14.891 4.509 -3.707 1.00 0.14 O ATOM 1838 CB SER B 28 -15.451 7.566 -3.814 1.00 0.16 C ATOM 1839 OG SER B 28 -14.998 8.718 -3.118 1.00 0.98 O ATOM 1840 H SER B 28 -14.262 6.967 -1.650 1.00 0.08 H ATOM 1841 HA SER B 28 -16.950 6.723 -2.532 1.00 0.08 H ATOM 1842 HB2 SER B 28 -14.638 7.171 -4.402 1.00 0.65 H ATOM 1843 HB3 SER B 28 -16.260 7.851 -4.469 1.00 0.91 H ATOM 1844 HG SER B 28 -14.126 8.533 -2.715 1.00 1.70 H ATOM 1845 N PRO B 29 -17.140 4.631 -3.928 1.00 0.17 N ATOM 1846 CA PRO B 29 -17.297 3.335 -4.607 1.00 0.21 C ATOM 1847 C PRO B 29 -16.338 3.154 -5.781 1.00 0.18 C ATOM 1848 O PRO B 29 -15.745 2.090 -5.951 1.00 0.20 O ATOM 1849 CB PRO B 29 -18.743 3.376 -5.103 1.00 0.30 C ATOM 1850 CG PRO B 29 -19.443 4.245 -4.121 1.00 0.28 C ATOM 1851 CD PRO B 29 -18.443 5.292 -3.713 1.00 0.18 C ATOM 1852 HA PRO B 29 -17.178 2.512 -3.919 1.00 0.21 H ATOM 1853 HB2 PRO B 29 -18.774 3.796 -6.099 1.00 0.35 H ATOM 1854 HB3 PRO B 29 -19.153 2.378 -5.112 1.00 0.33 H ATOM 1855 HG2 PRO B 29 -20.301 4.706 -4.585 1.00 0.31 H ATOM 1856 HG3 PRO B 29 -19.744 3.660 -3.265 1.00 0.30 H ATOM 1857 HD2 PRO B 29 -18.537 6.168 -4.337 1.00 0.17 H ATOM 1858 HD3 PRO B 29 -18.574 5.552 -2.673 1.00 0.16 H ATOM 1859 N ALA B 30 -16.178 4.198 -6.582 1.00 0.18 N ATOM 1860 CA ALA B 30 -15.291 4.142 -7.735 1.00 0.16 C ATOM 1861 C ALA B 30 -13.825 4.116 -7.309 1.00 0.10 C ATOM 1862 O ALA B 30 -12.988 3.488 -7.960 1.00 0.05 O ATOM 1863 CB ALA B 30 -15.547 5.325 -8.652 1.00 0.20 C ATOM 1864 H ALA B 30 -16.681 5.024 -6.399 1.00 0.22 H ATOM 1865 HA ALA B 30 -15.513 3.238 -8.283 1.00 0.17 H ATOM 1866 HB1 ALA B 30 -15.271 6.237 -8.143 1.00 0.24 H ATOM 1867 HB2 ALA B 30 -16.595 5.359 -8.911 1.00 0.24 H ATOM 1868 HB3 ALA B 30 -14.956 5.218 -9.549 1.00 0.17 H ATOM 1869 N HIS B 31 -13.532 4.784 -6.200 1.00 0.15 N ATOM 1870 CA HIS B 31 -12.172 4.859 -5.677 1.00 0.13 C ATOM 1871 C HIS B 31 -11.732 3.499 -5.142 1.00 0.07 C ATOM 1872 O HIS B 31 -10.618 3.052 -5.402 1.00 0.05 O ATOM 1873 CB HIS B 31 -12.090 5.915 -4.567 1.00 0.20 C ATOM 1874 CG HIS B 31 -10.760 6.598 -4.459 1.00 0.38 C ATOM 1875 ND1 HIS B 31 -10.549 7.890 -4.883 1.00 0.76 N ATOM 1876 CD2 HIS B 31 -9.578 6.176 -3.952 1.00 1.42 C ATOM 1877 CE1 HIS B 31 -9.299 8.232 -4.643 1.00 0.48 C ATOM 1878 NE2 HIS B 31 -8.682 7.213 -4.075 1.00 1.22 N ATOM 1879 H HIS B 31 -14.256 5.231 -5.713 1.00 0.20 H ATOM 1880 HA HIS B 31 -11.518 5.148 -6.484 1.00 0.16 H ATOM 1881 HB2 HIS B 31 -12.829 6.676 -4.752 1.00 0.46 H ATOM 1882 HB3 HIS B 31 -12.298 5.442 -3.619 1.00 0.18 H ATOM 1883 HD1 HIS B 31 -11.223 8.484 -5.281 1.00 1.63 H ATOM 1884 HD2 HIS B 31 -9.377 5.201 -3.528 1.00 2.33 H ATOM 1885 HE1 HIS B 31 -8.854 9.188 -4.873 1.00 0.80 H ATOM 1886 HE2 HIS B 31 -7.855 7.297 -3.555 1.00 1.73 H ATOM 1887 N ILE B 32 -12.625 2.838 -4.413 1.00 0.08 N ATOM 1888 CA ILE B 32 -12.335 1.522 -3.831 1.00 0.08 C ATOM 1889 C ILE B 32 -12.448 0.407 -4.870 1.00 0.07 C ATOM 1890 O ILE B 32 -12.114 -0.744 -4.601 1.00 0.14 O ATOM 1891 CB ILE B 32 -13.264 1.205 -2.631 1.00 0.11 C ATOM 1892 CG1 ILE B 32 -14.732 1.112 -3.081 1.00 0.13 C ATOM 1893 CG2 ILE B 32 -13.097 2.260 -1.549 1.00 0.12 C ATOM 1894 CD1 ILE B 32 -15.681 0.639 -2.003 1.00 0.10 C ATOM 1895 H ILE B 32 -13.498 3.252 -4.251 1.00 0.12 H ATOM 1896 HA ILE B 32 -11.316 1.540 -3.470 1.00 0.07 H ATOM 1897 HB ILE B 32 -12.961 0.253 -2.216 1.00 0.12 H ATOM 1898 HG12 ILE B 32 -15.068 2.085 -3.395 1.00 0.14 H ATOM 1899 HG13 ILE B 32 -14.805 0.426 -3.912 1.00 0.17 H ATOM 1900 HG21 ILE B 32 -13.439 3.213 -1.922 1.00 0.17 H ATOM 1901 HG22 ILE B 32 -12.053 2.333 -1.278 1.00 0.14 H ATOM 1902 HG23 ILE B 32 -13.675 1.984 -0.678 1.00 0.08 H ATOM 1903 HD11 ILE B 32 -15.215 -0.149 -1.431 1.00 0.10 H ATOM 1904 HD12 ILE B 32 -16.584 0.263 -2.461 1.00 0.12 H ATOM 1905 HD13 ILE B 32 -15.926 1.463 -1.349 1.00 0.06 H ATOM 1906 N ARG B 33 -12.914 0.754 -6.059 1.00 0.07 N ATOM 1907 CA ARG B 33 -13.055 -0.220 -7.128 1.00 0.05 C ATOM 1908 C ARG B 33 -11.743 -0.359 -7.889 1.00 0.04 C ATOM 1909 O ARG B 33 -11.347 -1.461 -8.265 1.00 0.05 O ATOM 1910 CB ARG B 33 -14.180 0.184 -8.083 1.00 0.07 C ATOM 1911 CG ARG B 33 -15.084 -0.974 -8.476 1.00 0.59 C ATOM 1912 CD ARG B 33 -16.006 -1.380 -7.333 1.00 0.36 C ATOM 1913 NE ARG B 33 -16.550 -2.725 -7.513 1.00 0.42 N ATOM 1914 CZ ARG B 33 -16.224 -3.774 -6.755 1.00 0.84 C ATOM 1915 NH1 ARG B 33 -15.326 -3.646 -5.784 1.00 1.03 N1+ ATOM 1916 NH2 ARG B 33 -16.796 -4.949 -6.969 1.00 1.46 N ATOM 1917 H ARG B 33 -13.174 1.684 -6.218 1.00 0.12 H ATOM 1918 HA ARG B 33 -13.294 -1.171 -6.680 1.00 0.04 H ATOM 1919 HB2 ARG B 33 -14.785 0.944 -7.610 1.00 0.54 H ATOM 1920 HB3 ARG B 33 -13.742 0.596 -8.983 1.00 0.51 H ATOM 1921 HG2 ARG B 33 -15.686 -0.677 -9.322 1.00 1.01 H ATOM 1922 HG3 ARG B 33 -14.469 -1.819 -8.747 1.00 1.12 H ATOM 1923 HD2 ARG B 33 -15.454 -1.347 -6.408 1.00 0.78 H ATOM 1924 HD3 ARG B 33 -16.826 -0.678 -7.285 1.00 0.78 H ATOM 1925 HE ARG B 33 -17.211 -2.851 -8.236 1.00 0.87 H ATOM 1926 HH11 ARG B 33 -14.885 -2.765 -5.615 1.00 1.06 H ATOM 1927 HH12 ARG B 33 -15.088 -4.442 -5.209 1.00 1.45 H ATOM 1928 HH21 ARG B 33 -17.476 -5.055 -7.701 1.00 1.72 H ATOM 1929 HH22 ARG B 33 -16.553 -5.741 -6.400 1.00 1.78 H ATOM 1930 N LEU B 34 -11.061 0.765 -8.093 1.00 0.06 N ATOM 1931 CA LEU B 34 -9.794 0.768 -8.816 1.00 0.09 C ATOM 1932 C LEU B 34 -8.673 0.180 -7.963 1.00 0.08 C ATOM 1933 O LEU B 34 -7.646 -0.243 -8.491 1.00 0.12 O ATOM 1934 CB LEU B 34 -9.435 2.186 -9.287 1.00 0.12 C ATOM 1935 CG LEU B 34 -9.062 3.193 -8.191 1.00 0.10 C ATOM 1936 CD1 LEU B 34 -7.552 3.266 -8.012 1.00 0.09 C ATOM 1937 CD2 LEU B 34 -9.618 4.569 -8.522 1.00 0.14 C ATOM 1938 H LEU B 34 -11.421 1.613 -7.755 1.00 0.07 H ATOM 1939 HA LEU B 34 -9.921 0.140 -9.685 1.00 0.12 H ATOM 1940 HB2 LEU B 34 -8.603 2.112 -9.971 1.00 0.14 H ATOM 1941 HB3 LEU B 34 -10.282 2.581 -9.826 1.00 0.14 H ATOM 1942 HG LEU B 34 -9.495 2.873 -7.254 1.00 0.08 H ATOM 1943 HD11 LEU B 34 -7.089 3.539 -8.949 1.00 0.09 H ATOM 1944 HD12 LEU B 34 -7.181 2.304 -7.695 1.00 0.10 H ATOM 1945 HD13 LEU B 34 -7.316 4.008 -7.265 1.00 0.09 H ATOM 1946 HD21 LEU B 34 -9.355 5.262 -7.735 1.00 0.14 H ATOM 1947 HD22 LEU B 34 -10.691 4.513 -8.609 1.00 0.15 H ATOM 1948 HD23 LEU B 34 -9.199 4.913 -9.457 1.00 0.16 H ATOM 1949 N VAL B 35 -8.877 0.152 -6.646 1.00 0.05 N ATOM 1950 CA VAL B 35 -7.884 -0.395 -5.726 1.00 0.08 C ATOM 1951 C VAL B 35 -7.578 -1.842 -6.088 1.00 0.08 C ATOM 1952 O VAL B 35 -6.418 -2.254 -6.139 1.00 0.11 O ATOM 1953 CB VAL B 35 -8.368 -0.334 -4.260 1.00 0.09 C ATOM 1954 CG1 VAL B 35 -7.309 -0.884 -3.319 1.00 0.14 C ATOM 1955 CG2 VAL B 35 -8.729 1.090 -3.869 1.00 0.09 C ATOM 1956 H VAL B 35 -9.713 0.511 -6.287 1.00 0.02 H ATOM 1957 HA VAL B 35 -6.981 0.192 -5.816 1.00 0.11 H ATOM 1958 HB VAL B 35 -9.253 -0.946 -4.170 1.00 0.07 H ATOM 1959 HG11 VAL B 35 -7.695 -0.892 -2.311 1.00 0.14 H ATOM 1960 HG12 VAL B 35 -6.431 -0.260 -3.363 1.00 0.14 H ATOM 1961 HG13 VAL B 35 -7.053 -1.890 -3.617 1.00 0.17 H ATOM 1962 HG21 VAL B 35 -7.841 1.703 -3.872 1.00 0.15 H ATOM 1963 HG22 VAL B 35 -9.165 1.091 -2.881 1.00 0.14 H ATOM 1964 HG23 VAL B 35 -9.441 1.488 -4.577 1.00 0.02 H ATOM 1965 N ALA B 36 -8.635 -2.598 -6.356 1.00 0.07 N ATOM 1966 CA ALA B 36 -8.506 -4.002 -6.727 1.00 0.07 C ATOM 1967 C ALA B 36 -7.665 -4.165 -7.988 1.00 0.09 C ATOM 1968 O ALA B 36 -6.778 -5.017 -8.053 1.00 0.09 O ATOM 1969 CB ALA B 36 -9.881 -4.616 -6.936 1.00 0.08 C ATOM 1970 H ALA B 36 -9.533 -2.199 -6.292 1.00 0.06 H ATOM 1971 HA ALA B 36 -8.022 -4.521 -5.912 1.00 0.07 H ATOM 1972 HB1 ALA B 36 -9.793 -5.691 -6.981 1.00 0.10 H ATOM 1973 HB2 ALA B 36 -10.302 -4.249 -7.861 1.00 0.06 H ATOM 1974 HB3 ALA B 36 -10.525 -4.338 -6.114 1.00 0.10 H ATOM 1975 N ALA B 37 -7.942 -3.330 -8.980 1.00 0.12 N ATOM 1976 CA ALA B 37 -7.228 -3.374 -10.250 1.00 0.15 C ATOM 1977 C ALA B 37 -5.767 -2.971 -10.080 1.00 0.17 C ATOM 1978 O ALA B 37 -4.882 -3.513 -10.745 1.00 0.19 O ATOM 1979 CB ALA B 37 -7.913 -2.469 -11.261 1.00 0.21 C ATOM 1980 H ALA B 37 -8.643 -2.659 -8.852 1.00 0.14 H ATOM 1981 HA ALA B 37 -7.271 -4.388 -10.622 1.00 0.12 H ATOM 1982 HB1 ALA B 37 -8.945 -2.770 -11.372 1.00 0.20 H ATOM 1983 HB2 ALA B 37 -7.412 -2.547 -12.213 1.00 0.26 H ATOM 1984 HB3 ALA B 37 -7.872 -1.447 -10.915 1.00 0.22 H ATOM 1985 N PHE B 38 -5.523 -2.020 -9.184 1.00 0.16 N ATOM 1986 CA PHE B 38 -4.172 -1.541 -8.921 1.00 0.18 C ATOM 1987 C PHE B 38 -3.319 -2.642 -8.293 1.00 0.15 C ATOM 1988 O PHE B 38 -2.190 -2.881 -8.718 1.00 0.16 O ATOM 1989 CB PHE B 38 -4.216 -0.315 -8.002 1.00 0.23 C ATOM 1990 CG PHE B 38 -2.859 0.190 -7.606 1.00 0.20 C ATOM 1991 CD1 PHE B 38 -1.989 0.694 -8.558 1.00 0.37 C ATOM 1992 CD2 PHE B 38 -2.453 0.164 -6.282 1.00 0.28 C ATOM 1993 CE1 PHE B 38 -0.739 1.160 -8.198 1.00 0.36 C ATOM 1994 CE2 PHE B 38 -1.205 0.628 -5.915 1.00 0.27 C ATOM 1995 CZ PHE B 38 -0.345 1.127 -6.874 1.00 0.14 C ATOM 1996 H PHE B 38 -6.276 -1.624 -8.690 1.00 0.15 H ATOM 1997 HA PHE B 38 -3.733 -1.255 -9.865 1.00 0.20 H ATOM 1998 HB2 PHE B 38 -4.732 0.488 -8.508 1.00 0.26 H ATOM 1999 HB3 PHE B 38 -4.754 -0.569 -7.101 1.00 0.28 H ATOM 2000 HD1 PHE B 38 -2.295 0.720 -9.592 1.00 0.58 H ATOM 2001 HD2 PHE B 38 -3.126 -0.223 -5.531 1.00 0.47 H ATOM 2002 HE1 PHE B 38 -0.069 1.548 -8.952 1.00 0.55 H ATOM 2003 HE2 PHE B 38 -0.901 0.600 -4.880 1.00 0.46 H ATOM 2004 HZ PHE B 38 0.631 1.489 -6.590 1.00 0.12 H ATOM 2005 N VAL B 39 -3.873 -3.316 -7.291 1.00 0.14 N ATOM 2006 CA VAL B 39 -3.156 -4.389 -6.603 1.00 0.14 C ATOM 2007 C VAL B 39 -2.916 -5.561 -7.552 1.00 0.14 C ATOM 2008 O VAL B 39 -1.821 -6.134 -7.589 1.00 0.19 O ATOM 2009 CB VAL B 39 -3.924 -4.879 -5.351 1.00 0.15 C ATOM 2010 CG1 VAL B 39 -3.193 -6.038 -4.683 1.00 0.15 C ATOM 2011 CG2 VAL B 39 -4.118 -3.742 -4.358 1.00 0.22 C ATOM 2012 H VAL B 39 -4.789 -3.092 -7.014 1.00 0.14 H ATOM 2013 HA VAL B 39 -2.200 -3.997 -6.285 1.00 0.20 H ATOM 2014 HB VAL B 39 -4.898 -5.229 -5.663 1.00 0.15 H ATOM 2015 HG11 VAL B 39 -3.141 -6.873 -5.366 1.00 0.12 H ATOM 2016 HG12 VAL B 39 -3.724 -6.333 -3.790 1.00 0.18 H ATOM 2017 HG13 VAL B 39 -2.191 -5.727 -4.421 1.00 0.19 H ATOM 2018 HG21 VAL B 39 -4.362 -2.835 -4.888 1.00 0.69 H ATOM 2019 HG22 VAL B 39 -3.208 -3.595 -3.795 1.00 1.08 H ATOM 2020 HG23 VAL B 39 -4.922 -3.991 -3.683 1.00 1.05 H ATOM 2021 N ASP B 40 -3.936 -5.889 -8.337 1.00 0.14 N ATOM 2022 CA ASP B 40 -3.854 -6.982 -9.300 1.00 0.21 C ATOM 2023 C ASP B 40 -2.716 -6.739 -10.290 1.00 0.27 C ATOM 2024 O ASP B 40 -1.974 -7.658 -10.636 1.00 0.34 O ATOM 2025 CB ASP B 40 -5.175 -7.111 -10.061 1.00 0.21 C ATOM 2026 CG ASP B 40 -5.244 -8.366 -10.910 1.00 0.33 C ATOM 2027 OD1 ASP B 40 -4.570 -8.420 -11.962 1.00 0.47 O ATOM 2028 OD2 ASP B 40 -5.986 -9.298 -10.536 1.00 0.32 O1- ATOM 2029 H ASP B 40 -4.774 -5.385 -8.262 1.00 0.12 H ATOM 2030 HA ASP B 40 -3.664 -7.898 -8.757 1.00 0.27 H ATOM 2031 HB2 ASP B 40 -5.992 -7.131 -9.353 1.00 0.24 H ATOM 2032 HB3 ASP B 40 -5.289 -6.255 -10.709 1.00 0.12 H ATOM 2033 N ASP B 41 -2.587 -5.491 -10.729 1.00 0.28 N ATOM 2034 CA ASP B 41 -1.542 -5.102 -11.676 1.00 0.37 C ATOM 2035 C ASP B 41 -0.152 -5.349 -11.098 1.00 0.32 C ATOM 2036 O ASP B 41 0.704 -5.954 -11.747 1.00 0.32 O ATOM 2037 CB ASP B 41 -1.693 -3.618 -12.050 1.00 0.46 C ATOM 2038 CG ASP B 41 -0.374 -2.972 -12.440 1.00 0.78 C ATOM 2039 OD1 ASP B 41 0.068 -3.159 -13.594 1.00 0.92 O ATOM 2040 OD2 ASP B 41 0.222 -2.274 -11.591 1.00 1.11 O1- ATOM 2041 H ASP B 41 -3.216 -4.809 -10.405 1.00 0.23 H ATOM 2042 HA ASP B 41 -1.661 -5.701 -12.566 1.00 0.45 H ATOM 2043 HB2 ASP B 41 -2.373 -3.530 -12.884 1.00 0.41 H ATOM 2044 HB3 ASP B 41 -2.097 -3.079 -11.206 1.00 0.46 H ATOM 2045 N LYS B 42 0.051 -4.909 -9.866 1.00 0.28 N ATOM 2046 CA LYS B 42 1.341 -5.046 -9.203 1.00 0.24 C ATOM 2047 C LYS B 42 1.770 -6.508 -9.073 1.00 0.20 C ATOM 2048 O LYS B 42 2.908 -6.856 -9.390 1.00 0.18 O ATOM 2049 CB LYS B 42 1.304 -4.370 -7.832 1.00 0.24 C ATOM 2050 CG LYS B 42 1.004 -2.875 -7.903 1.00 0.21 C ATOM 2051 CD LYS B 42 2.272 -2.029 -7.860 1.00 0.40 C ATOM 2052 CE LYS B 42 3.174 -2.276 -9.064 1.00 0.55 C ATOM 2053 NZ LYS B 42 2.556 -1.836 -10.349 1.00 0.48 N1+ ATOM 2054 H LYS B 42 -0.692 -4.477 -9.386 1.00 0.29 H ATOM 2055 HA LYS B 42 2.067 -4.537 -9.816 1.00 0.24 H ATOM 2056 HB2 LYS B 42 0.543 -4.842 -7.229 1.00 0.29 H ATOM 2057 HB3 LYS B 42 2.264 -4.499 -7.352 1.00 0.22 H ATOM 2058 HG2 LYS B 42 0.485 -2.672 -8.826 1.00 0.34 H ATOM 2059 HG3 LYS B 42 0.373 -2.606 -7.069 1.00 0.32 H ATOM 2060 HD2 LYS B 42 1.994 -0.986 -7.842 1.00 0.39 H ATOM 2061 HD3 LYS B 42 2.818 -2.270 -6.959 1.00 0.69 H ATOM 2062 HE2 LYS B 42 4.097 -1.735 -8.922 1.00 0.77 H ATOM 2063 HE3 LYS B 42 3.388 -3.332 -9.122 1.00 0.71 H ATOM 2064 HZ1 LYS B 42 2.614 -0.802 -10.440 1.00 0.69 H ATOM 2065 HZ2 LYS B 42 1.552 -2.120 -10.391 1.00 0.49 H ATOM 2066 HZ3 LYS B 42 3.059 -2.273 -11.155 1.00 0.49 H ATOM 2067 N MET B 43 0.862 -7.371 -8.640 1.00 0.21 N ATOM 2068 CA MET B 43 1.190 -8.788 -8.478 1.00 0.19 C ATOM 2069 C MET B 43 1.138 -9.533 -9.807 1.00 0.17 C ATOM 2070 O MET B 43 1.376 -10.738 -9.861 1.00 0.18 O ATOM 2071 CB MET B 43 0.265 -9.459 -7.459 1.00 0.24 C ATOM 2072 CG MET B 43 -1.211 -9.295 -7.756 1.00 0.25 C ATOM 2073 SD MET B 43 -2.235 -10.383 -6.746 1.00 0.31 S ATOM 2074 CE MET B 43 -1.480 -10.165 -5.134 1.00 0.24 C ATOM 2075 H MET B 43 -0.042 -7.054 -8.420 1.00 0.23 H ATOM 2076 HA MET B 43 2.202 -8.843 -8.112 1.00 0.18 H ATOM 2077 HB2 MET B 43 0.485 -10.516 -7.432 1.00 0.31 H ATOM 2078 HB3 MET B 43 0.462 -9.036 -6.485 1.00 0.22 H ATOM 2079 HG2 MET B 43 -1.494 -8.269 -7.560 1.00 0.18 H ATOM 2080 HG3 MET B 43 -1.385 -9.522 -8.797 1.00 0.40 H ATOM 2081 HE1 MET B 43 -1.482 -9.117 -4.873 1.00 0.16 H ATOM 2082 HE2 MET B 43 -0.463 -10.529 -5.157 1.00 0.34 H ATOM 2083 HE3 MET B 43 -2.044 -10.720 -4.397 1.00 0.35 H ATOM 2084 N HIS B 44 0.833 -8.816 -10.878 1.00 0.16 N ATOM 2085 CA HIS B 44 0.766 -9.421 -12.199 1.00 0.19 C ATOM 2086 C HIS B 44 2.080 -9.227 -12.947 1.00 0.25 C ATOM 2087 O HIS B 44 2.348 -9.910 -13.933 1.00 0.61 O ATOM 2088 CB HIS B 44 -0.388 -8.823 -13.005 1.00 0.26 C ATOM 2089 CG HIS B 44 -1.346 -9.850 -13.536 1.00 0.47 C ATOM 2090 ND1 HIS B 44 -2.696 -9.853 -13.242 1.00 0.54 N ATOM 2091 CD2 HIS B 44 -1.142 -10.912 -14.354 1.00 1.09 C ATOM 2092 CE1 HIS B 44 -3.276 -10.870 -13.852 1.00 1.18 C ATOM 2093 NE2 HIS B 44 -2.355 -11.526 -14.530 1.00 1.53 N ATOM 2094 H HIS B 44 0.636 -7.860 -10.775 1.00 0.16 H ATOM 2095 HA HIS B 44 0.594 -10.479 -12.071 1.00 0.18 H ATOM 2096 HB2 HIS B 44 -0.943 -8.145 -12.373 1.00 0.76 H ATOM 2097 HB3 HIS B 44 0.015 -8.276 -13.845 1.00 0.65 H ATOM 2098 HD1 HIS B 44 -3.167 -9.201 -12.663 1.00 0.19 H ATOM 2099 HD2 HIS B 44 -0.199 -11.225 -14.777 1.00 1.22 H ATOM 2100 HE1 HIS B 44 -4.325 -11.121 -13.806 1.00 1.39 H ATOM 2101 HE2 HIS B 44 -2.514 -12.338 -15.065 1.00 2.12 H ATOM 2102 N GLU B 45 2.896 -8.295 -12.471 1.00 0.14 N ATOM 2103 CA GLU B 45 4.178 -8.011 -13.109 1.00 0.11 C ATOM 2104 C GLU B 45 5.354 -8.572 -12.306 1.00 0.07 C ATOM 2105 O GLU B 45 6.349 -9.012 -12.881 1.00 0.03 O ATOM 2106 CB GLU B 45 4.357 -6.500 -13.315 1.00 0.10 C ATOM 2107 CG GLU B 45 4.238 -5.677 -12.033 1.00 0.07 C ATOM 2108 CD GLU B 45 4.674 -4.238 -12.210 1.00 0.22 C ATOM 2109 OE1 GLU B 45 5.886 -3.995 -12.389 1.00 0.49 O ATOM 2110 OE2 GLU B 45 3.809 -3.337 -12.158 1.00 0.43 O1- ATOM 2111 H GLU B 45 2.625 -7.782 -11.682 1.00 0.38 H ATOM 2112 HA GLU B 45 4.170 -8.490 -14.075 1.00 0.18 H ATOM 2113 HB2 GLU B 45 5.335 -6.323 -13.739 1.00 0.16 H ATOM 2114 HB3 GLU B 45 3.606 -6.155 -14.014 1.00 0.11 H ATOM 2115 HG2 GLU B 45 3.207 -5.684 -11.707 1.00 0.09 H ATOM 2116 HG3 GLU B 45 4.855 -6.133 -11.270 1.00 0.09 H ATOM 2117 N PHE B 46 5.242 -8.573 -10.980 1.00 0.11 N ATOM 2118 CA PHE B 46 6.319 -9.068 -10.125 1.00 0.10 C ATOM 2119 C PHE B 46 6.374 -10.593 -10.110 1.00 0.10 C ATOM 2120 O PHE B 46 7.353 -11.184 -9.649 1.00 0.11 O ATOM 2121 CB PHE B 46 6.159 -8.531 -8.703 1.00 0.11 C ATOM 2122 CG PHE B 46 6.755 -7.168 -8.519 1.00 0.13 C ATOM 2123 CD1 PHE B 46 8.124 -7.014 -8.386 1.00 0.14 C ATOM 2124 CD2 PHE B 46 5.952 -6.039 -8.490 1.00 0.16 C ATOM 2125 CE1 PHE B 46 8.683 -5.763 -8.230 1.00 0.14 C ATOM 2126 CE2 PHE B 46 6.505 -4.784 -8.336 1.00 0.17 C ATOM 2127 CZ PHE B 46 7.873 -4.646 -8.203 1.00 0.15 C ATOM 2128 H PHE B 46 4.425 -8.226 -10.567 1.00 0.16 H ATOM 2129 HA PHE B 46 7.249 -8.701 -10.530 1.00 0.11 H ATOM 2130 HB2 PHE B 46 5.108 -8.470 -8.463 1.00 0.11 H ATOM 2131 HB3 PHE B 46 6.644 -9.205 -8.011 1.00 0.12 H ATOM 2132 HD1 PHE B 46 8.759 -7.887 -8.406 1.00 0.16 H ATOM 2133 HD2 PHE B 46 4.882 -6.146 -8.590 1.00 0.19 H ATOM 2134 HE1 PHE B 46 9.752 -5.656 -8.126 1.00 0.16 H ATOM 2135 HE2 PHE B 46 5.871 -3.911 -8.315 1.00 0.21 H ATOM 2136 HZ PHE B 46 8.307 -3.664 -8.084 1.00 0.16 H ATOM 2137 N SER B 47 5.338 -11.224 -10.643 1.00 0.09 N ATOM 2138 CA SER B 47 5.266 -12.675 -10.685 1.00 0.10 C ATOM 2139 C SER B 47 6.306 -13.247 -11.650 1.00 0.09 C ATOM 2140 O SER B 47 6.639 -14.431 -11.590 1.00 0.13 O ATOM 2141 CB SER B 47 3.856 -13.099 -11.093 1.00 0.13 C ATOM 2142 OG SER B 47 3.251 -12.106 -11.907 1.00 0.49 O ATOM 2143 H SER B 47 4.600 -10.702 -11.022 1.00 0.09 H ATOM 2144 HA SER B 47 5.472 -13.046 -9.692 1.00 0.13 H ATOM 2145 HB2 SER B 47 3.903 -14.026 -11.647 1.00 0.59 H ATOM 2146 HB3 SER B 47 3.252 -13.238 -10.208 1.00 0.46 H ATOM 2147 HG SER B 47 3.176 -12.435 -12.814 1.00 0.28 H ATOM 2148 N GLU B 48 6.838 -12.390 -12.515 1.00 0.13 N ATOM 2149 CA GLU B 48 7.835 -12.803 -13.494 1.00 0.12 C ATOM 2150 C GLU B 48 9.230 -12.868 -12.880 1.00 0.09 C ATOM 2151 O GLU B 48 10.138 -13.470 -13.451 1.00 0.07 O ATOM 2152 CB GLU B 48 7.838 -11.840 -14.679 1.00 0.15 C ATOM 2153 CG GLU B 48 6.543 -11.847 -15.467 1.00 0.17 C ATOM 2154 CD GLU B 48 6.172 -13.229 -15.955 1.00 0.71 C ATOM 2155 OE1 GLU B 48 6.801 -13.715 -16.918 1.00 0.76 O1- ATOM 2156 OE2 GLU B 48 5.261 -13.848 -15.371 1.00 1.67 O ATOM 2157 H GLU B 48 6.547 -11.454 -12.499 1.00 0.20 H ATOM 2158 HA GLU B 48 7.563 -13.787 -13.846 1.00 0.13 H ATOM 2159 HB2 GLU B 48 8.009 -10.839 -14.315 1.00 0.17 H ATOM 2160 HB3 GLU B 48 8.640 -12.112 -15.348 1.00 0.15 H ATOM 2161 HG2 GLU B 48 5.749 -11.479 -14.833 1.00 0.46 H ATOM 2162 HG3 GLU B 48 6.652 -11.196 -16.322 1.00 0.69 H ATOM 2163 N LYS B 49 9.398 -12.247 -11.721 1.00 0.10 N ATOM 2164 CA LYS B 49 10.692 -12.239 -11.048 1.00 0.10 C ATOM 2165 C LYS B 49 10.926 -13.543 -10.301 1.00 0.15 C ATOM 2166 O LYS B 49 12.015 -14.111 -10.367 1.00 0.23 O ATOM 2167 CB LYS B 49 10.788 -11.059 -10.082 1.00 0.09 C ATOM 2168 CG LYS B 49 10.638 -9.711 -10.761 1.00 0.12 C ATOM 2169 CD LYS B 49 11.477 -8.647 -10.075 1.00 0.05 C ATOM 2170 CE LYS B 49 11.313 -7.292 -10.745 1.00 1.11 C ATOM 2171 NZ LYS B 49 11.669 -7.335 -12.188 1.00 1.14 N1+ ATOM 2172 H LYS B 49 8.637 -11.787 -11.308 1.00 0.13 H ATOM 2173 HA LYS B 49 11.454 -12.135 -11.804 1.00 0.13 H ATOM 2174 HB2 LYS B 49 10.009 -11.152 -9.341 1.00 0.08 H ATOM 2175 HB3 LYS B 49 11.749 -11.088 -9.589 1.00 0.09 H ATOM 2176 HG2 LYS B 49 10.953 -9.798 -11.790 1.00 0.16 H ATOM 2177 HG3 LYS B 49 9.601 -9.416 -10.724 1.00 0.16 H ATOM 2178 HD2 LYS B 49 11.163 -8.566 -9.046 1.00 0.84 H ATOM 2179 HD3 LYS B 49 12.517 -8.937 -10.115 1.00 0.77 H ATOM 2180 HE2 LYS B 49 10.285 -6.982 -10.647 1.00 1.66 H ATOM 2181 HE3 LYS B 49 11.952 -6.579 -10.246 1.00 1.68 H ATOM 2182 HZ1 LYS B 49 11.706 -6.372 -12.577 1.00 2.01 H ATOM 2183 HZ2 LYS B 49 10.955 -7.879 -12.715 1.00 0.52 H ATOM 2184 HZ3 LYS B 49 12.595 -7.785 -12.319 1.00 1.55 H ATOM 2185 N GLN B 50 9.889 -14.008 -9.599 1.00 0.20 N ATOM 2186 CA GLN B 50 9.951 -15.248 -8.825 1.00 0.30 C ATOM 2187 C GLN B 50 11.117 -15.237 -7.834 1.00 0.13 C ATOM 2188 O GLN B 50 12.200 -15.745 -8.127 1.00 0.29 O ATOM 2189 CB GLN B 50 10.069 -16.453 -9.763 1.00 0.53 C ATOM 2190 CG GLN B 50 8.805 -16.719 -10.568 1.00 1.05 C ATOM 2191 CD GLN B 50 9.085 -17.440 -11.872 1.00 1.30 C ATOM 2192 OE1 GLN B 50 10.141 -17.262 -12.479 1.00 1.37 O ATOM 2193 NE2 GLN B 50 8.144 -18.260 -12.310 1.00 1.60 N ATOM 2194 H GLN B 50 9.051 -13.505 -9.614 1.00 0.23 H ATOM 2195 HA GLN B 50 9.031 -15.333 -8.269 1.00 0.42 H ATOM 2196 HB2 GLN B 50 10.880 -16.277 -10.454 1.00 0.80 H ATOM 2197 HB3 GLN B 50 10.290 -17.329 -9.175 1.00 0.26 H ATOM 2198 HG2 GLN B 50 8.143 -17.331 -9.974 1.00 1.12 H ATOM 2199 HG3 GLN B 50 8.328 -15.778 -10.788 1.00 1.35 H ATOM 2200 HE21 GLN B 50 7.330 -18.363 -11.772 1.00 1.73 H ATOM 2201 HE22 GLN B 50 8.301 -18.737 -13.155 1.00 1.75 H ATOM 2202 N PRO B 51 10.907 -14.667 -6.631 1.00 0.16 N ATOM 2203 CA PRO B 51 11.952 -14.595 -5.612 1.00 0.27 C ATOM 2204 C PRO B 51 12.276 -15.973 -5.052 1.00 0.20 C ATOM 2205 O PRO B 51 13.380 -16.485 -5.227 1.00 0.19 O ATOM 2206 CB PRO B 51 11.364 -13.703 -4.508 1.00 0.48 C ATOM 2207 CG PRO B 51 10.047 -13.205 -5.011 1.00 0.51 C ATOM 2208 CD PRO B 51 9.642 -14.078 -6.170 1.00 0.41 C ATOM 2209 HA PRO B 51 12.854 -14.146 -6.001 1.00 0.33 H ATOM 2210 HB2 PRO B 51 11.238 -14.286 -3.608 1.00 0.57 H ATOM 2211 HB3 PRO B 51 12.041 -12.884 -4.314 1.00 0.56 H ATOM 2212 HG2 PRO B 51 9.315 -13.279 -4.222 1.00 0.54 H ATOM 2213 HG3 PRO B 51 10.146 -12.179 -5.331 1.00 0.62 H ATOM 2214 HD2 PRO B 51 8.960 -14.848 -5.840 1.00 0.49 H ATOM 2215 HD3 PRO B 51 9.190 -13.482 -6.951 1.00 0.50 H ATOM 2216 N MET B 52 11.297 -16.572 -4.389 1.00 0.17 N ATOM 2217 CA MET B 52 11.463 -17.898 -3.810 1.00 0.11 C ATOM 2218 C MET B 52 10.587 -18.898 -4.548 1.00 0.09 C ATOM 2219 O MET B 52 10.506 -20.066 -4.167 1.00 0.08 O ATOM 2220 CB MET B 52 11.084 -17.885 -2.328 1.00 0.12 C ATOM 2221 CG MET B 52 11.781 -16.804 -1.528 1.00 0.18 C ATOM 2222 SD MET B 52 13.521 -17.173 -1.231 1.00 0.26 S ATOM 2223 CE MET B 52 13.386 -18.539 -0.076 1.00 0.43 C ATOM 2224 H MET B 52 10.443 -16.108 -4.277 1.00 0.21 H ATOM 2225 HA MET B 52 12.497 -18.187 -3.913 1.00 0.08 H ATOM 2226 HB2 MET B 52 10.018 -17.734 -2.245 1.00 0.23 H ATOM 2227 HB3 MET B 52 11.335 -18.840 -1.896 1.00 0.11 H ATOM 2228 HG2 MET B 52 11.713 -15.871 -2.073 1.00 0.29 H ATOM 2229 HG3 MET B 52 11.281 -16.696 -0.576 1.00 0.17 H ATOM 2230 HE1 MET B 52 14.372 -18.911 0.155 1.00 0.44 H ATOM 2231 HE2 MET B 52 12.797 -19.329 -0.517 1.00 1.15 H ATOM 2232 HE3 MET B 52 12.909 -18.196 0.830 1.00 1.19 H ATOM 2233 N LEU B 53 9.940 -18.418 -5.614 1.00 0.10 N ATOM 2234 CA LEU B 53 9.044 -19.239 -6.427 1.00 0.11 C ATOM 2235 C LEU B 53 7.827 -19.665 -5.617 1.00 0.08 C ATOM 2236 O LEU B 53 7.246 -20.725 -5.849 1.00 0.10 O ATOM 2237 CB LEU B 53 9.775 -20.461 -6.984 1.00 0.19 C ATOM 2238 CG LEU B 53 10.710 -20.160 -8.153 1.00 0.25 C ATOM 2239 CD1 LEU B 53 11.814 -21.197 -8.241 1.00 0.62 C ATOM 2240 CD2 LEU B 53 9.928 -20.110 -9.453 1.00 1.07 C ATOM 2241 H LEU B 53 10.079 -17.485 -5.867 1.00 0.11 H ATOM 2242 HA LEU B 53 8.707 -18.630 -7.254 1.00 0.13 H ATOM 2243 HB2 LEU B 53 10.352 -20.906 -6.184 1.00 0.16 H ATOM 2244 HB3 LEU B 53 9.037 -21.176 -7.314 1.00 0.29 H ATOM 2245 HG LEU B 53 11.168 -19.194 -8.001 1.00 0.75 H ATOM 2246 HD11 LEU B 53 12.417 -21.156 -7.345 1.00 1.14 H ATOM 2247 HD12 LEU B 53 12.433 -20.987 -9.100 1.00 1.09 H ATOM 2248 HD13 LEU B 53 11.380 -22.180 -8.339 1.00 0.50 H ATOM 2249 HD21 LEU B 53 9.127 -19.391 -9.365 1.00 1.52 H ATOM 2250 HD22 LEU B 53 9.516 -21.087 -9.666 1.00 1.40 H ATOM 2251 HD23 LEU B 53 10.589 -19.817 -10.255 1.00 1.11 H ATOM 2252 N ASP B 54 7.454 -18.821 -4.671 1.00 0.09 N ATOM 2253 CA ASP B 54 6.313 -19.071 -3.811 1.00 0.12 C ATOM 2254 C ASP B 54 5.288 -17.953 -3.959 1.00 0.10 C ATOM 2255 O ASP B 54 5.598 -16.874 -4.470 1.00 0.18 O ATOM 2256 CB ASP B 54 6.760 -19.168 -2.353 1.00 0.19 C ATOM 2257 CG ASP B 54 7.196 -17.827 -1.798 1.00 0.24 C ATOM 2258 OD1 ASP B 54 8.126 -17.217 -2.370 1.00 0.26 O ATOM 2259 OD2 ASP B 54 6.605 -17.379 -0.790 1.00 0.28 O1- ATOM 2260 H ASP B 54 7.968 -17.997 -4.539 1.00 0.08 H ATOM 2261 HA ASP B 54 5.864 -20.007 -4.110 1.00 0.14 H ATOM 2262 HB2 ASP B 54 5.941 -19.535 -1.755 1.00 0.25 H ATOM 2263 HB3 ASP B 54 7.591 -19.856 -2.279 1.00 0.17 H ATOM 2264 N VAL B 55 4.070 -18.219 -3.511 1.00 0.11 N ATOM 2265 CA VAL B 55 2.988 -17.241 -3.592 1.00 0.12 C ATOM 2266 C VAL B 55 3.056 -16.181 -2.472 1.00 0.08 C ATOM 2267 O VAL B 55 2.939 -14.991 -2.759 1.00 0.04 O ATOM 2268 CB VAL B 55 1.597 -17.917 -3.571 1.00 0.17 C ATOM 2269 CG1 VAL B 55 0.544 -16.994 -4.168 1.00 0.08 C ATOM 2270 CG2 VAL B 55 1.626 -19.246 -4.315 1.00 0.32 C ATOM 2271 H VAL B 55 3.892 -19.098 -3.123 1.00 0.18 H ATOM 2272 HA VAL B 55 3.090 -16.733 -4.540 1.00 0.13 H ATOM 2273 HB VAL B 55 1.327 -18.110 -2.544 1.00 0.24 H ATOM 2274 HG11 VAL B 55 0.805 -16.766 -5.191 1.00 0.09 H ATOM 2275 HG12 VAL B 55 0.501 -16.079 -3.594 1.00 0.16 H ATOM 2276 HG13 VAL B 55 -0.420 -17.482 -4.141 1.00 0.11 H ATOM 2277 HG21 VAL B 55 0.643 -19.694 -4.288 1.00 0.35 H ATOM 2278 HG22 VAL B 55 2.336 -19.908 -3.842 1.00 0.42 H ATOM 2279 HG23 VAL B 55 1.916 -19.077 -5.341 1.00 0.36 H ATOM 2280 N PRO B 56 3.233 -16.580 -1.183 1.00 0.10 N ATOM 2281 CA PRO B 56 3.296 -15.624 -0.064 1.00 0.10 C ATOM 2282 C PRO B 56 4.297 -14.489 -0.274 1.00 0.07 C ATOM 2283 O PRO B 56 3.937 -13.317 -0.148 1.00 0.14 O ATOM 2284 CB PRO B 56 3.719 -16.488 1.124 1.00 0.14 C ATOM 2285 CG PRO B 56 3.214 -17.842 0.788 1.00 0.15 C ATOM 2286 CD PRO B 56 3.369 -17.972 -0.701 1.00 0.14 C ATOM 2287 HA PRO B 56 2.323 -15.198 0.137 1.00 0.11 H ATOM 2288 HB2 PRO B 56 4.795 -16.477 1.218 1.00 0.15 H ATOM 2289 HB3 PRO B 56 3.268 -16.112 2.029 1.00 0.17 H ATOM 2290 HG2 PRO B 56 3.803 -18.592 1.295 1.00 0.14 H ATOM 2291 HG3 PRO B 56 2.175 -17.927 1.067 1.00 0.19 H ATOM 2292 HD2 PRO B 56 4.344 -18.371 -0.943 1.00 0.14 H ATOM 2293 HD3 PRO B 56 2.590 -18.600 -1.108 1.00 0.16 H ATOM 2294 N LYS B 57 5.546 -14.835 -0.595 1.00 0.09 N ATOM 2295 CA LYS B 57 6.590 -13.829 -0.811 1.00 0.06 C ATOM 2296 C LYS B 57 6.200 -12.855 -1.912 1.00 0.07 C ATOM 2297 O LYS B 57 6.414 -11.650 -1.791 1.00 0.12 O ATOM 2298 CB LYS B 57 7.927 -14.479 -1.176 1.00 0.12 C ATOM 2299 CG LYS B 57 8.883 -14.646 -0.005 1.00 0.17 C ATOM 2300 CD LYS B 57 10.222 -13.983 -0.292 1.00 0.47 C ATOM 2301 CE LYS B 57 11.233 -14.261 0.810 1.00 0.23 C ATOM 2302 NZ LYS B 57 12.594 -13.780 0.451 1.00 0.62 N1+ ATOM 2303 H LYS B 57 5.771 -15.796 -0.691 1.00 0.16 H ATOM 2304 HA LYS B 57 6.709 -13.278 0.109 1.00 0.06 H ATOM 2305 HB2 LYS B 57 7.739 -15.455 -1.597 1.00 0.09 H ATOM 2306 HB3 LYS B 57 8.414 -13.868 -1.922 1.00 0.20 H ATOM 2307 HG2 LYS B 57 8.447 -14.196 0.873 1.00 0.43 H ATOM 2308 HG3 LYS B 57 9.045 -15.700 0.170 1.00 0.58 H ATOM 2309 HD2 LYS B 57 10.608 -14.362 -1.224 1.00 0.95 H ATOM 2310 HD3 LYS B 57 10.072 -12.915 -0.371 1.00 0.86 H ATOM 2311 HE2 LYS B 57 10.910 -13.759 1.709 1.00 0.36 H ATOM 2312 HE3 LYS B 57 11.269 -15.325 0.986 1.00 0.62 H ATOM 2313 HZ1 LYS B 57 12.726 -13.795 -0.580 1.00 1.03 H ATOM 2314 HZ2 LYS B 57 13.315 -14.388 0.886 1.00 0.99 H ATOM 2315 HZ3 LYS B 57 12.732 -12.802 0.793 1.00 0.38 H ATOM 2316 N LEU B 58 5.616 -13.387 -2.974 1.00 0.07 N ATOM 2317 CA LEU B 58 5.204 -12.576 -4.111 1.00 0.11 C ATOM 2318 C LEU B 58 4.098 -11.601 -3.709 1.00 0.11 C ATOM 2319 O LEU B 58 4.123 -10.426 -4.078 1.00 0.14 O ATOM 2320 CB LEU B 58 4.742 -13.500 -5.256 1.00 0.14 C ATOM 2321 CG LEU B 58 4.396 -12.846 -6.610 1.00 0.16 C ATOM 2322 CD1 LEU B 58 2.956 -12.352 -6.632 1.00 0.17 C ATOM 2323 CD2 LEU B 58 5.350 -11.709 -6.950 1.00 0.27 C ATOM 2324 H LEU B 58 5.448 -14.352 -2.991 1.00 0.07 H ATOM 2325 HA LEU B 58 6.063 -12.013 -4.430 1.00 0.13 H ATOM 2326 HB2 LEU B 58 5.526 -14.222 -5.434 1.00 0.16 H ATOM 2327 HB3 LEU B 58 3.868 -14.034 -4.913 1.00 0.26 H ATOM 2328 HG LEU B 58 4.491 -13.595 -7.383 1.00 0.30 H ATOM 2329 HD11 LEU B 58 2.760 -11.858 -7.571 1.00 0.17 H ATOM 2330 HD12 LEU B 58 2.800 -11.656 -5.820 1.00 0.24 H ATOM 2331 HD13 LEU B 58 2.287 -13.191 -6.520 1.00 0.28 H ATOM 2332 HD21 LEU B 58 5.187 -11.404 -7.973 1.00 0.31 H ATOM 2333 HD22 LEU B 58 6.371 -12.042 -6.835 1.00 0.47 H ATOM 2334 HD23 LEU B 58 5.165 -10.869 -6.295 1.00 0.23 H ATOM 2335 N ALA B 59 3.141 -12.092 -2.935 1.00 0.08 N ATOM 2336 CA ALA B 59 2.022 -11.276 -2.489 1.00 0.09 C ATOM 2337 C ALA B 59 2.481 -10.117 -1.606 1.00 0.14 C ATOM 2338 O ALA B 59 2.162 -8.958 -1.874 1.00 0.31 O ATOM 2339 CB ALA B 59 1.009 -12.142 -1.754 1.00 0.07 C ATOM 2340 H ALA B 59 3.185 -13.038 -2.660 1.00 0.06 H ATOM 2341 HA ALA B 59 1.539 -10.873 -3.367 1.00 0.11 H ATOM 2342 HB1 ALA B 59 1.465 -12.551 -0.864 1.00 0.09 H ATOM 2343 HB2 ALA B 59 0.689 -12.947 -2.399 1.00 0.08 H ATOM 2344 HB3 ALA B 59 0.156 -11.541 -1.477 1.00 0.08 H ATOM 2345 N VAL B 60 3.249 -10.425 -0.569 1.00 0.02 N ATOM 2346 CA VAL B 60 3.730 -9.397 0.358 1.00 0.05 C ATOM 2347 C VAL B 60 4.754 -8.468 -0.307 1.00 0.08 C ATOM 2348 O VAL B 60 4.886 -7.304 0.079 1.00 0.12 O ATOM 2349 CB VAL B 60 4.325 -10.017 1.650 1.00 0.07 C ATOM 2350 CG1 VAL B 60 5.469 -10.961 1.335 1.00 0.07 C ATOM 2351 CG2 VAL B 60 4.781 -8.932 2.618 1.00 0.13 C ATOM 2352 H VAL B 60 3.501 -11.364 -0.423 1.00 0.11 H ATOM 2353 HA VAL B 60 2.875 -8.802 0.643 1.00 0.06 H ATOM 2354 HB VAL B 60 3.548 -10.589 2.136 1.00 0.07 H ATOM 2355 HG11 VAL B 60 5.077 -11.943 1.113 1.00 0.95 H ATOM 2356 HG12 VAL B 60 6.130 -11.022 2.187 1.00 0.85 H ATOM 2357 HG13 VAL B 60 6.016 -10.590 0.480 1.00 0.91 H ATOM 2358 HG21 VAL B 60 5.443 -8.249 2.107 1.00 0.17 H ATOM 2359 HG22 VAL B 60 5.304 -9.386 3.445 1.00 0.11 H ATOM 2360 HG23 VAL B 60 3.921 -8.392 2.987 1.00 0.15 H ATOM 2361 N LEU B 61 5.455 -8.970 -1.322 1.00 0.08 N ATOM 2362 CA LEU B 61 6.448 -8.171 -2.035 1.00 0.11 C ATOM 2363 C LEU B 61 5.805 -6.925 -2.633 1.00 0.11 C ATOM 2364 O LEU B 61 6.379 -5.836 -2.604 1.00 0.13 O ATOM 2365 CB LEU B 61 7.109 -9.001 -3.140 1.00 0.13 C ATOM 2366 CG LEU B 61 8.312 -8.348 -3.826 1.00 0.17 C ATOM 2367 CD1 LEU B 61 9.479 -8.212 -2.857 1.00 0.17 C ATOM 2368 CD2 LEU B 61 8.724 -9.147 -5.052 1.00 0.17 C ATOM 2369 H LEU B 61 5.309 -9.903 -1.591 1.00 0.06 H ATOM 2370 HA LEU B 61 7.200 -7.868 -1.325 1.00 0.13 H ATOM 2371 HB2 LEU B 61 7.433 -9.937 -2.708 1.00 0.13 H ATOM 2372 HB3 LEU B 61 6.366 -9.211 -3.892 1.00 0.13 H ATOM 2373 HG LEU B 61 8.034 -7.355 -4.151 1.00 0.22 H ATOM 2374 HD11 LEU B 61 9.266 -7.433 -2.142 1.00 0.24 H ATOM 2375 HD12 LEU B 61 10.374 -7.962 -3.406 1.00 0.21 H ATOM 2376 HD13 LEU B 61 9.627 -9.148 -2.339 1.00 0.11 H ATOM 2377 HD21 LEU B 61 9.001 -10.149 -4.755 1.00 0.12 H ATOM 2378 HD22 LEU B 61 9.567 -8.668 -5.529 1.00 0.19 H ATOM 2379 HD23 LEU B 61 7.898 -9.192 -5.745 1.00 0.20 H ATOM 2380 N THR B 62 4.602 -7.088 -3.162 1.00 0.10 N ATOM 2381 CA THR B 62 3.884 -5.973 -3.753 1.00 0.09 C ATOM 2382 C THR B 62 3.332 -5.055 -2.667 1.00 0.09 C ATOM 2383 O THR B 62 3.331 -3.835 -2.814 1.00 0.08 O ATOM 2384 CB THR B 62 2.736 -6.459 -4.656 1.00 0.10 C ATOM 2385 OG1 THR B 62 1.773 -7.203 -3.897 1.00 0.18 O ATOM 2386 CG2 THR B 62 3.272 -7.330 -5.777 1.00 0.12 C ATOM 2387 H THR B 62 4.195 -7.979 -3.164 1.00 0.10 H ATOM 2388 HA THR B 62 4.581 -5.414 -4.360 1.00 0.07 H ATOM 2389 HB THR B 62 2.251 -5.598 -5.093 1.00 0.15 H ATOM 2390 HG1 THR B 62 2.198 -7.961 -3.478 1.00 0.58 H ATOM 2391 HG21 THR B 62 2.481 -7.958 -6.147 1.00 0.86 H ATOM 2392 HG22 THR B 62 4.078 -7.944 -5.404 1.00 0.73 H ATOM 2393 HG23 THR B 62 3.639 -6.703 -6.577 1.00 0.64 H ATOM 2394 N ALA B 63 2.893 -5.657 -1.564 1.00 0.10 N ATOM 2395 CA ALA B 63 2.333 -4.915 -0.443 1.00 0.11 C ATOM 2396 C ALA B 63 3.323 -3.892 0.096 1.00 0.11 C ATOM 2397 O ALA B 63 2.984 -2.724 0.286 1.00 0.12 O ATOM 2398 CB ALA B 63 1.923 -5.872 0.668 1.00 0.10 C ATOM 2399 H ALA B 63 2.949 -6.632 -1.506 1.00 0.10 H ATOM 2400 HA ALA B 63 1.447 -4.399 -0.787 1.00 0.12 H ATOM 2401 HB1 ALA B 63 1.312 -6.661 0.255 1.00 0.11 H ATOM 2402 HB2 ALA B 63 1.359 -5.335 1.419 1.00 0.11 H ATOM 2403 HB3 ALA B 63 2.806 -6.298 1.119 1.00 0.09 H ATOM 2404 N VAL B 64 4.552 -4.334 0.328 1.00 0.09 N ATOM 2405 CA VAL B 64 5.580 -3.450 0.855 1.00 0.10 C ATOM 2406 C VAL B 64 5.963 -2.372 -0.164 1.00 0.12 C ATOM 2407 O VAL B 64 6.240 -1.231 0.208 1.00 0.12 O ATOM 2408 CB VAL B 64 6.830 -4.233 1.332 1.00 0.10 C ATOM 2409 CG1 VAL B 64 7.573 -4.874 0.170 1.00 0.12 C ATOM 2410 CG2 VAL B 64 7.752 -3.329 2.138 1.00 0.11 C ATOM 2411 H VAL B 64 4.769 -5.276 0.147 1.00 0.09 H ATOM 2412 HA VAL B 64 5.156 -2.955 1.713 1.00 0.09 H ATOM 2413 HB VAL B 64 6.495 -5.027 1.984 1.00 0.09 H ATOM 2414 HG11 VAL B 64 6.948 -5.631 -0.283 1.00 0.11 H ATOM 2415 HG12 VAL B 64 8.484 -5.328 0.529 1.00 0.13 H ATOM 2416 HG13 VAL B 64 7.811 -4.118 -0.564 1.00 0.13 H ATOM 2417 HG21 VAL B 64 8.639 -3.875 2.417 1.00 0.11 H ATOM 2418 HG22 VAL B 64 7.240 -2.996 3.030 1.00 0.11 H ATOM 2419 HG23 VAL B 64 8.028 -2.472 1.541 1.00 0.13 H ATOM 2420 N GLN B 65 5.951 -2.719 -1.447 1.00 0.15 N ATOM 2421 CA GLN B 65 6.283 -1.758 -2.489 1.00 0.19 C ATOM 2422 C GLN B 65 5.206 -0.679 -2.560 1.00 0.13 C ATOM 2423 O GLN B 65 5.506 0.514 -2.604 1.00 0.16 O ATOM 2424 CB GLN B 65 6.411 -2.451 -3.845 1.00 0.34 C ATOM 2425 CG GLN B 65 6.870 -1.513 -4.957 1.00 0.57 C ATOM 2426 CD GLN B 65 6.335 -1.917 -6.320 1.00 0.79 C ATOM 2427 OE1 GLN B 65 5.283 -2.546 -6.421 1.00 0.98 O ATOM 2428 NE2 GLN B 65 7.043 -1.545 -7.377 1.00 0.80 N ATOM 2429 H GLN B 65 5.717 -3.638 -1.699 1.00 0.16 H ATOM 2430 HA GLN B 65 7.226 -1.297 -2.234 1.00 0.22 H ATOM 2431 HB2 GLN B 65 7.124 -3.262 -3.757 1.00 0.22 H ATOM 2432 HB3 GLN B 65 5.449 -2.859 -4.117 1.00 0.49 H ATOM 2433 HG2 GLN B 65 6.518 -0.516 -4.732 1.00 0.58 H ATOM 2434 HG3 GLN B 65 7.951 -1.510 -4.994 1.00 0.62 H ATOM 2435 HE21 GLN B 65 7.864 -1.033 -7.230 1.00 0.70 H ATOM 2436 HE22 GLN B 65 6.714 -1.798 -8.267 1.00 0.94 H ATOM 2437 N ILE B 66 3.953 -1.122 -2.550 1.00 0.15 N ATOM 2438 CA ILE B 66 2.809 -0.221 -2.600 1.00 0.16 C ATOM 2439 C ILE B 66 2.842 0.754 -1.424 1.00 0.11 C ATOM 2440 O ILE B 66 2.645 1.959 -1.593 1.00 0.27 O ATOM 2441 CB ILE B 66 1.480 -1.017 -2.583 1.00 0.27 C ATOM 2442 CG1 ILE B 66 1.270 -1.721 -3.929 1.00 0.64 C ATOM 2443 CG2 ILE B 66 0.304 -0.105 -2.262 1.00 0.89 C ATOM 2444 CD1 ILE B 66 0.224 -2.820 -3.891 1.00 1.38 C ATOM 2445 H ILE B 66 3.794 -2.091 -2.511 1.00 0.20 H ATOM 2446 HA ILE B 66 2.862 0.337 -3.522 1.00 0.19 H ATOM 2447 HB ILE B 66 1.546 -1.762 -1.805 1.00 0.89 H ATOM 2448 HG12 ILE B 66 0.959 -0.993 -4.665 1.00 0.77 H ATOM 2449 HG13 ILE B 66 2.205 -2.164 -4.245 1.00 1.59 H ATOM 2450 HG21 ILE B 66 0.311 0.739 -2.936 1.00 0.81 H ATOM 2451 HG22 ILE B 66 0.390 0.247 -1.245 1.00 1.24 H ATOM 2452 HG23 ILE B 66 -0.620 -0.650 -2.375 1.00 1.60 H ATOM 2453 HD11 ILE B 66 0.375 -3.431 -3.014 1.00 1.63 H ATOM 2454 HD12 ILE B 66 0.317 -3.432 -4.775 1.00 1.45 H ATOM 2455 HD13 ILE B 66 -0.762 -2.380 -3.860 1.00 2.27 H ATOM 2456 N ALA B 67 3.116 0.220 -0.238 1.00 0.16 N ATOM 2457 CA ALA B 67 3.187 1.029 0.971 1.00 0.13 C ATOM 2458 C ALA B 67 4.267 2.101 0.845 1.00 0.06 C ATOM 2459 O ALA B 67 4.059 3.252 1.226 1.00 0.09 O ATOM 2460 CB ALA B 67 3.449 0.141 2.178 1.00 0.16 C ATOM 2461 H ALA B 67 3.268 -0.748 -0.176 1.00 0.31 H ATOM 2462 HA ALA B 67 2.230 1.510 1.107 1.00 0.23 H ATOM 2463 HB1 ALA B 67 2.664 -0.595 2.261 1.00 0.23 H ATOM 2464 HB2 ALA B 67 3.473 0.744 3.073 1.00 0.14 H ATOM 2465 HB3 ALA B 67 4.397 -0.359 2.055 1.00 0.22 H ATOM 2466 N SER B 68 5.409 1.716 0.288 1.00 0.08 N ATOM 2467 CA SER B 68 6.526 2.637 0.106 1.00 0.06 C ATOM 2468 C SER B 68 6.161 3.762 -0.865 1.00 0.16 C ATOM 2469 O SER B 68 6.404 4.941 -0.591 1.00 0.21 O ATOM 2470 CB SER B 68 7.751 1.880 -0.416 1.00 0.06 C ATOM 2471 OG SER B 68 8.047 0.755 0.396 1.00 0.28 O ATOM 2472 H SER B 68 5.507 0.787 -0.007 1.00 0.16 H ATOM 2473 HA SER B 68 6.762 3.068 1.066 1.00 0.07 H ATOM 2474 HB2 SER B 68 7.559 1.537 -1.422 1.00 0.22 H ATOM 2475 HB3 SER B 68 8.605 2.540 -0.418 1.00 0.14 H ATOM 2476 HG SER B 68 7.386 0.068 0.250 1.00 0.82 H ATOM 2477 N GLU B 69 5.559 3.387 -1.990 1.00 0.26 N ATOM 2478 CA GLU B 69 5.167 4.344 -3.018 1.00 0.35 C ATOM 2479 C GLU B 69 4.174 5.379 -2.485 1.00 0.24 C ATOM 2480 O GLU B 69 4.199 6.539 -2.893 1.00 0.18 O ATOM 2481 CB GLU B 69 4.565 3.608 -4.218 1.00 0.52 C ATOM 2482 CG GLU B 69 5.582 2.827 -5.035 1.00 0.44 C ATOM 2483 CD GLU B 69 6.495 3.726 -5.844 1.00 1.20 C ATOM 2484 OE1 GLU B 69 6.107 4.130 -6.960 1.00 1.60 O1- ATOM 2485 OE2 GLU B 69 7.609 4.039 -5.373 1.00 1.71 O ATOM 2486 H GLU B 69 5.374 2.432 -2.136 1.00 0.32 H ATOM 2487 HA GLU B 69 6.060 4.859 -3.342 1.00 0.43 H ATOM 2488 HB2 GLU B 69 3.817 2.916 -3.861 1.00 0.59 H ATOM 2489 HB3 GLU B 69 4.092 4.330 -4.868 1.00 0.84 H ATOM 2490 HG2 GLU B 69 6.187 2.235 -4.364 1.00 0.29 H ATOM 2491 HG3 GLU B 69 5.053 2.173 -5.714 1.00 0.67 H ATOM 2492 N TYR B 70 3.303 4.968 -1.574 1.00 0.23 N ATOM 2493 CA TYR B 70 2.318 5.885 -1.015 1.00 0.15 C ATOM 2494 C TYR B 70 2.896 6.697 0.140 1.00 0.08 C ATOM 2495 O TYR B 70 2.524 7.855 0.343 1.00 0.12 O ATOM 2496 CB TYR B 70 1.072 5.124 -0.564 1.00 0.24 C ATOM 2497 CG TYR B 70 0.156 4.750 -1.703 1.00 0.32 C ATOM 2498 CD1 TYR B 70 -0.340 5.721 -2.565 1.00 0.57 C ATOM 2499 CD2 TYR B 70 -0.212 3.431 -1.923 1.00 0.75 C ATOM 2500 CE1 TYR B 70 -1.172 5.384 -3.613 1.00 0.56 C ATOM 2501 CE2 TYR B 70 -1.045 3.087 -2.969 1.00 0.85 C ATOM 2502 CZ TYR B 70 -1.522 4.066 -3.812 1.00 0.50 C ATOM 2503 OH TYR B 70 -2.342 3.727 -4.860 1.00 0.59 O ATOM 2504 H TYR B 70 3.318 4.030 -1.277 1.00 0.30 H ATOM 2505 HA TYR B 70 2.037 6.570 -1.802 1.00 0.16 H ATOM 2506 HB2 TYR B 70 1.374 4.215 -0.067 1.00 0.29 H ATOM 2507 HB3 TYR B 70 0.512 5.737 0.126 1.00 0.25 H ATOM 2508 HD1 TYR B 70 -0.066 6.753 -2.407 1.00 0.99 H ATOM 2509 HD2 TYR B 70 0.163 2.665 -1.260 1.00 1.12 H ATOM 2510 HE1 TYR B 70 -1.547 6.153 -4.273 1.00 0.90 H ATOM 2511 HE2 TYR B 70 -1.321 2.054 -3.124 1.00 1.29 H ATOM 2512 HH TYR B 70 -2.933 3.019 -4.589 1.00 0.92 H ATOM 2513 N LEU B 71 3.816 6.101 0.887 1.00 0.09 N ATOM 2514 CA LEU B 71 4.436 6.792 2.014 1.00 0.17 C ATOM 2515 C LEU B 71 5.301 7.947 1.520 1.00 0.22 C ATOM 2516 O LEU B 71 5.399 8.986 2.175 1.00 0.26 O ATOM 2517 CB LEU B 71 5.258 5.828 2.877 1.00 0.24 C ATOM 2518 CG LEU B 71 4.554 5.385 4.176 1.00 0.27 C ATOM 2519 CD1 LEU B 71 5.141 4.090 4.727 1.00 0.32 C ATOM 2520 CD2 LEU B 71 4.634 6.482 5.233 1.00 0.32 C ATOM 2521 H LEU B 71 4.082 5.178 0.677 1.00 0.11 H ATOM 2522 HA LEU B 71 3.637 7.201 2.616 1.00 0.17 H ATOM 2523 HB2 LEU B 71 5.485 4.953 2.285 1.00 0.24 H ATOM 2524 HB3 LEU B 71 6.185 6.316 3.138 1.00 0.28 H ATOM 2525 HG LEU B 71 3.509 5.209 3.963 1.00 0.24 H ATOM 2526 HD11 LEU B 71 6.192 4.226 4.940 1.00 0.36 H ATOM 2527 HD12 LEU B 71 5.016 3.298 4.005 1.00 0.31 H ATOM 2528 HD13 LEU B 71 4.624 3.824 5.640 1.00 0.35 H ATOM 2529 HD21 LEU B 71 5.607 6.465 5.700 1.00 1.06 H ATOM 2530 HD22 LEU B 71 3.874 6.317 5.984 1.00 1.10 H ATOM 2531 HD23 LEU B 71 4.476 7.443 4.767 1.00 0.57 H ATOM 2532 N LYS B 72 5.926 7.767 0.361 1.00 0.23 N ATOM 2533 CA LYS B 72 6.753 8.816 -0.225 1.00 0.27 C ATOM 2534 C LYS B 72 5.859 9.917 -0.797 1.00 0.24 C ATOM 2535 O LYS B 72 6.274 11.067 -0.933 1.00 0.29 O ATOM 2536 CB LYS B 72 7.655 8.249 -1.331 1.00 0.31 C ATOM 2537 CG LYS B 72 6.904 7.929 -2.616 1.00 0.38 C ATOM 2538 CD LYS B 72 7.811 7.363 -3.696 1.00 0.40 C ATOM 2539 CE LYS B 72 7.070 7.252 -5.019 1.00 0.52 C ATOM 2540 NZ LYS B 72 7.886 6.581 -6.065 1.00 0.58 N1+ ATOM 2541 H LYS B 72 5.848 6.903 -0.101 1.00 0.22 H ATOM 2542 HA LYS B 72 7.368 9.234 0.558 1.00 0.30 H ATOM 2543 HB2 LYS B 72 8.425 8.971 -1.558 1.00 0.35 H ATOM 2544 HB3 LYS B 72 8.119 7.341 -0.974 1.00 0.27 H ATOM 2545 HG2 LYS B 72 6.133 7.206 -2.398 1.00 0.40 H ATOM 2546 HG3 LYS B 72 6.449 8.836 -2.985 1.00 0.42 H ATOM 2547 HD2 LYS B 72 8.661 8.020 -3.822 1.00 0.40 H ATOM 2548 HD3 LYS B 72 8.148 6.383 -3.395 1.00 0.41 H ATOM 2549 HE2 LYS B 72 6.164 6.685 -4.865 1.00 0.54 H ATOM 2550 HE3 LYS B 72 6.817 8.246 -5.354 1.00 0.58 H ATOM 2551 HZ1 LYS B 72 7.446 6.712 -7.001 1.00 0.57 H ATOM 2552 HZ2 LYS B 72 7.945 5.556 -5.866 1.00 0.54 H ATOM 2553 HZ3 LYS B 72 8.845 6.976 -6.084 1.00 0.70 H ATOM 2554 N LEU B 73 4.621 9.555 -1.119 1.00 0.17 N ATOM 2555 CA LEU B 73 3.667 10.498 -1.682 1.00 0.14 C ATOM 2556 C LEU B 73 3.191 11.465 -0.604 1.00 0.11 C ATOM 2557 O LEU B 73 3.196 12.679 -0.801 1.00 0.09 O ATOM 2558 CB LEU B 73 2.478 9.742 -2.304 1.00 0.13 C ATOM 2559 CG LEU B 73 1.646 10.490 -3.365 1.00 0.12 C ATOM 2560 CD1 LEU B 73 0.818 11.605 -2.740 1.00 0.08 C ATOM 2561 CD2 LEU B 73 2.530 11.047 -4.472 1.00 0.15 C ATOM 2562 H LEU B 73 4.341 8.626 -0.971 1.00 0.14 H ATOM 2563 HA LEU B 73 4.176 11.057 -2.448 1.00 0.15 H ATOM 2564 HB2 LEU B 73 2.864 8.843 -2.762 1.00 0.15 H ATOM 2565 HB3 LEU B 73 1.813 9.451 -1.503 1.00 0.11 H ATOM 2566 HG LEU B 73 0.957 9.791 -3.819 1.00 0.13 H ATOM 2567 HD11 LEU B 73 1.477 12.354 -2.328 1.00 0.09 H ATOM 2568 HD12 LEU B 73 0.199 11.197 -1.955 1.00 0.04 H ATOM 2569 HD13 LEU B 73 0.191 12.054 -3.497 1.00 0.10 H ATOM 2570 HD21 LEU B 73 2.961 11.985 -4.153 1.00 0.16 H ATOM 2571 HD22 LEU B 73 1.934 11.209 -5.358 1.00 0.17 H ATOM 2572 HD23 LEU B 73 3.319 10.342 -4.692 1.00 0.15 H ATOM 2573 N LYS B 74 2.799 10.929 0.546 1.00 0.11 N ATOM 2574 CA LYS B 74 2.331 11.771 1.641 1.00 0.10 C ATOM 2575 C LYS B 74 3.485 12.586 2.221 1.00 0.13 C ATOM 2576 O LYS B 74 3.272 13.582 2.911 1.00 0.13 O ATOM 2577 CB LYS B 74 1.653 10.942 2.736 1.00 0.12 C ATOM 2578 CG LYS B 74 2.612 10.121 3.585 1.00 0.20 C ATOM 2579 CD LYS B 74 1.886 9.355 4.685 1.00 0.28 C ATOM 2580 CE LYS B 74 1.470 10.258 5.839 1.00 0.32 C ATOM 2581 NZ LYS B 74 2.632 10.921 6.488 1.00 0.43 N1+ ATOM 2582 H LYS B 74 2.818 9.952 0.656 1.00 0.13 H ATOM 2583 HA LYS B 74 1.607 12.459 1.230 1.00 0.08 H ATOM 2584 HB2 LYS B 74 1.116 11.613 3.387 1.00 0.16 H ATOM 2585 HB3 LYS B 74 0.948 10.268 2.274 1.00 0.08 H ATOM 2586 HG2 LYS B 74 3.124 9.417 2.947 1.00 0.18 H ATOM 2587 HG3 LYS B 74 3.332 10.785 4.036 1.00 0.39 H ATOM 2588 HD2 LYS B 74 1.002 8.898 4.267 1.00 0.31 H ATOM 2589 HD3 LYS B 74 2.540 8.585 5.064 1.00 0.51 H ATOM 2590 HE2 LYS B 74 0.798 11.013 5.469 1.00 0.71 H ATOM 2591 HE3 LYS B 74 0.958 9.656 6.575 1.00 0.47 H ATOM 2592 HZ1 LYS B 74 3.361 11.141 5.784 1.00 0.45 H ATOM 2593 HZ2 LYS B 74 3.041 10.297 7.212 1.00 1.29 H ATOM 2594 HZ3 LYS B 74 2.330 11.808 6.942 1.00 1.27 H ATOM 2595 N GLU B 75 4.707 12.159 1.927 1.00 0.17 N ATOM 2596 CA GLU B 75 5.891 12.859 2.396 1.00 0.20 C ATOM 2597 C GLU B 75 5.977 14.229 1.733 1.00 0.16 C ATOM 2598 O GLU B 75 6.139 15.245 2.409 1.00 0.20 O ATOM 2599 CB GLU B 75 7.145 12.041 2.090 1.00 0.27 C ATOM 2600 CG GLU B 75 8.436 12.679 2.578 1.00 0.36 C ATOM 2601 CD GLU B 75 8.520 12.749 4.090 1.00 0.45 C ATOM 2602 OE1 GLU B 75 8.120 11.773 4.759 1.00 0.44 O1- ATOM 2603 OE2 GLU B 75 8.996 13.777 4.617 1.00 0.55 O ATOM 2604 H GLU B 75 4.814 11.349 1.387 1.00 0.18 H ATOM 2605 HA GLU B 75 5.801 12.988 3.464 1.00 0.22 H ATOM 2606 HB2 GLU B 75 7.049 11.072 2.558 1.00 0.25 H ATOM 2607 HB3 GLU B 75 7.218 11.906 1.021 1.00 0.27 H ATOM 2608 HG2 GLU B 75 9.270 12.098 2.214 1.00 0.36 H ATOM 2609 HG3 GLU B 75 8.498 13.682 2.182 1.00 0.40 H ATOM 2610 N GLU B 76 5.834 14.255 0.407 1.00 0.13 N ATOM 2611 CA GLU B 76 5.897 15.509 -0.341 1.00 0.11 C ATOM 2612 C GLU B 76 4.748 16.427 0.066 1.00 0.08 C ATOM 2613 O GLU B 76 4.875 17.652 0.022 1.00 0.08 O ATOM 2614 CB GLU B 76 5.872 15.259 -1.856 1.00 0.17 C ATOM 2615 CG GLU B 76 4.486 14.983 -2.426 1.00 0.18 C ATOM 2616 CD GLU B 76 4.300 15.542 -3.824 1.00 0.21 C ATOM 2617 OE1 GLU B 76 4.630 14.832 -4.799 1.00 0.20 O ATOM 2618 OE2 GLU B 76 3.824 16.691 -3.952 1.00 0.34 O1- ATOM 2619 H GLU B 76 5.681 13.414 -0.076 1.00 0.18 H ATOM 2620 HA GLU B 76 6.826 15.992 -0.081 1.00 0.11 H ATOM 2621 HB2 GLU B 76 6.273 16.127 -2.356 1.00 0.19 H ATOM 2622 HB3 GLU B 76 6.501 14.409 -2.075 1.00 0.31 H ATOM 2623 HG2 GLU B 76 4.332 13.915 -2.462 1.00 0.28 H ATOM 2624 HG3 GLU B 76 3.749 15.429 -1.775 1.00 0.22 H ATOM 2625 N TYR B 77 3.640 15.821 0.484 1.00 0.07 N ATOM 2626 CA TYR B 77 2.468 16.569 0.912 1.00 0.11 C ATOM 2627 C TYR B 77 2.813 17.470 2.091 1.00 0.13 C ATOM 2628 O TYR B 77 2.424 18.635 2.136 1.00 0.22 O ATOM 2629 CB TYR B 77 1.339 15.607 1.297 1.00 0.13 C ATOM 2630 CG TYR B 77 0.137 16.287 1.921 1.00 0.15 C ATOM 2631 CD1 TYR B 77 -0.459 17.375 1.305 1.00 0.12 C ATOM 2632 CD2 TYR B 77 -0.395 15.847 3.128 1.00 0.22 C ATOM 2633 CE1 TYR B 77 -1.550 18.007 1.863 1.00 0.14 C ATOM 2634 CE2 TYR B 77 -1.486 16.476 3.697 1.00 0.25 C ATOM 2635 CZ TYR B 77 -2.060 17.556 3.058 1.00 0.20 C ATOM 2636 OH TYR B 77 -3.140 18.196 3.624 1.00 0.23 O ATOM 2637 H TYR B 77 3.613 14.843 0.500 1.00 0.08 H ATOM 2638 HA TYR B 77 2.144 17.182 0.084 1.00 0.16 H ATOM 2639 HB2 TYR B 77 1.002 15.087 0.411 1.00 0.14 H ATOM 2640 HB3 TYR B 77 1.719 14.887 2.006 1.00 0.12 H ATOM 2641 HD1 TYR B 77 -0.057 17.728 0.368 1.00 0.09 H ATOM 2642 HD2 TYR B 77 0.058 14.999 3.624 1.00 0.25 H ATOM 2643 HE1 TYR B 77 -1.999 18.850 1.360 1.00 0.11 H ATOM 2644 HE2 TYR B 77 -1.887 16.121 4.635 1.00 0.30 H ATOM 2645 HH TYR B 77 -3.891 18.160 3.021 1.00 0.26 H ATOM 2646 N GLN B 78 3.550 16.923 3.043 1.00 0.22 N ATOM 2647 CA GLN B 78 3.952 17.673 4.219 1.00 0.30 C ATOM 2648 C GLN B 78 5.135 18.581 3.902 1.00 0.37 C ATOM 2649 O GLN B 78 5.221 19.702 4.401 1.00 0.84 O ATOM 2650 CB GLN B 78 4.310 16.714 5.354 1.00 0.28 C ATOM 2651 CG GLN B 78 3.115 15.947 5.899 1.00 0.17 C ATOM 2652 CD GLN B 78 3.513 14.712 6.687 1.00 0.26 C ATOM 2653 OE1 GLN B 78 2.766 13.734 6.752 1.00 0.53 O ATOM 2654 NE2 GLN B 78 4.696 14.739 7.282 1.00 0.24 N ATOM 2655 H GLN B 78 3.831 15.986 2.951 1.00 0.30 H ATOM 2656 HA GLN B 78 3.117 18.285 4.526 1.00 0.34 H ATOM 2657 HB2 GLN B 78 5.035 15.998 4.989 1.00 0.27 H ATOM 2658 HB3 GLN B 78 4.751 17.277 6.162 1.00 0.41 H ATOM 2659 HG2 GLN B 78 2.551 16.600 6.550 1.00 0.38 H ATOM 2660 HG3 GLN B 78 2.492 15.641 5.071 1.00 0.15 H ATOM 2661 HE21 GLN B 78 5.248 15.547 7.184 1.00 0.39 H ATOM 2662 HE22 GLN B 78 4.974 13.953 7.794 1.00 0.28 H ATOM 2663 N ARG B 79 6.022 18.099 3.039 1.00 0.28 N ATOM 2664 CA ARG B 79 7.219 18.846 2.663 1.00 0.30 C ATOM 2665 C ARG B 79 6.899 20.153 1.939 1.00 0.27 C ATOM 2666 O ARG B 79 7.450 21.201 2.272 1.00 0.23 O ATOM 2667 CB ARG B 79 8.125 17.992 1.781 1.00 0.34 C ATOM 2668 CG ARG B 79 8.764 16.823 2.511 1.00 0.63 C ATOM 2669 CD ARG B 79 9.312 17.242 3.866 1.00 0.85 C ATOM 2670 NE ARG B 79 10.364 16.339 4.326 1.00 1.45 N ATOM 2671 CZ ARG B 79 11.418 16.731 5.035 1.00 1.28 C ATOM 2672 NH1 ARG B 79 11.485 17.974 5.500 1.00 0.73 N1+ ATOM 2673 NH2 ARG B 79 12.386 15.867 5.317 1.00 2.05 N ATOM 2674 H ARG B 79 5.870 17.210 2.648 1.00 0.59 H ATOM 2675 HA ARG B 79 7.752 19.081 3.571 1.00 0.31 H ATOM 2676 HB2 ARG B 79 7.543 17.601 0.960 1.00 0.39 H ATOM 2677 HB3 ARG B 79 8.914 18.615 1.386 1.00 0.21 H ATOM 2678 HG2 ARG B 79 8.020 16.053 2.657 1.00 0.71 H ATOM 2679 HG3 ARG B 79 9.571 16.434 1.910 1.00 0.66 H ATOM 2680 HD2 ARG B 79 9.717 18.241 3.784 1.00 1.19 H ATOM 2681 HD3 ARG B 79 8.507 17.238 4.584 1.00 0.56 H ATOM 2682 HE ARG B 79 10.293 15.392 4.061 1.00 2.17 H ATOM 2683 HH11 ARG B 79 10.731 18.625 5.323 1.00 0.56 H ATOM 2684 HH12 ARG B 79 12.282 18.275 6.026 1.00 1.08 H ATOM 2685 HH21 ARG B 79 12.323 14.917 4.997 1.00 2.70 H ATOM 2686 HH22 ARG B 79 13.188 16.159 5.843 1.00 2.07 H ATOM 2687 N LEU B 80 6.013 20.099 0.954 1.00 0.30 N ATOM 2688 CA LEU B 80 5.670 21.298 0.194 1.00 0.28 C ATOM 2689 C LEU B 80 4.819 22.256 1.027 1.00 0.23 C ATOM 2690 O LEU B 80 4.806 23.460 0.780 1.00 0.28 O ATOM 2691 CB LEU B 80 4.967 20.939 -1.126 1.00 0.31 C ATOM 2692 CG LEU B 80 3.462 21.227 -1.186 1.00 0.48 C ATOM 2693 CD1 LEU B 80 3.029 21.546 -2.610 1.00 0.79 C ATOM 2694 CD2 LEU B 80 2.671 20.048 -0.650 1.00 0.44 C ATOM 2695 H LEU B 80 5.581 19.241 0.734 1.00 0.34 H ATOM 2696 HA LEU B 80 6.599 21.798 -0.040 1.00 0.28 H ATOM 2697 HB2 LEU B 80 5.448 21.495 -1.918 1.00 0.34 H ATOM 2698 HB3 LEU B 80 5.116 19.886 -1.313 1.00 0.23 H ATOM 2699 HG LEU B 80 3.241 22.087 -0.571 1.00 0.95 H ATOM 2700 HD11 LEU B 80 3.342 20.751 -3.271 1.00 0.82 H ATOM 2701 HD12 LEU B 80 3.479 22.476 -2.926 1.00 1.16 H ATOM 2702 HD13 LEU B 80 1.954 21.638 -2.644 1.00 0.88 H ATOM 2703 HD21 LEU B 80 3.111 19.711 0.278 1.00 0.86 H ATOM 2704 HD22 LEU B 80 2.689 19.244 -1.369 1.00 0.48 H ATOM 2705 HD23 LEU B 80 1.651 20.354 -0.473 1.00 0.52 H ATOM 2706 N ARG B 81 4.125 21.725 2.028 1.00 0.20 N ATOM 2707 CA ARG B 81 3.286 22.556 2.881 1.00 0.15 C ATOM 2708 C ARG B 81 4.130 23.306 3.910 1.00 0.15 C ATOM 2709 O ARG B 81 3.936 24.502 4.132 1.00 0.43 O ATOM 2710 CB ARG B 81 2.223 21.716 3.584 1.00 0.22 C ATOM 2711 CG ARG B 81 1.049 21.340 2.688 1.00 0.32 C ATOM 2712 CD ARG B 81 -0.106 20.750 3.488 1.00 0.65 C ATOM 2713 NE ARG B 81 -0.240 21.364 4.814 1.00 1.05 N ATOM 2714 CZ ARG B 81 -1.038 20.902 5.779 1.00 1.70 C ATOM 2715 NH1 ARG B 81 -1.811 19.843 5.570 1.00 2.04 N1+ ATOM 2716 NH2 ARG B 81 -1.082 21.517 6.954 1.00 2.12 N ATOM 2717 H ARG B 81 4.176 20.760 2.192 1.00 0.25 H ATOM 2718 HA ARG B 81 2.797 23.279 2.248 1.00 0.21 H ATOM 2719 HB2 ARG B 81 2.680 20.806 3.944 1.00 0.24 H ATOM 2720 HB3 ARG B 81 1.844 22.273 4.424 1.00 0.20 H ATOM 2721 HG2 ARG B 81 0.700 22.217 2.168 1.00 0.21 H ATOM 2722 HG3 ARG B 81 1.382 20.606 1.968 1.00 0.42 H ATOM 2723 HD2 ARG B 81 -1.019 20.910 2.935 1.00 0.43 H ATOM 2724 HD3 ARG B 81 0.060 19.691 3.601 1.00 0.98 H ATOM 2725 HE ARG B 81 0.305 22.162 5.000 1.00 0.99 H ATOM 2726 HH11 ARG B 81 -1.808 19.378 4.683 1.00 1.86 H ATOM 2727 HH12 ARG B 81 -2.398 19.499 6.308 1.00 2.56 H ATOM 2728 HH21 ARG B 81 -0.514 22.331 7.121 1.00 2.02 H ATOM 2729 HH22 ARG B 81 -1.670 21.166 7.687 1.00 2.61 H ATOM 2730 N GLU B 82 5.083 22.606 4.522 1.00 0.39 N ATOM 2731 CA GLU B 82 5.959 23.216 5.521 1.00 0.44 C ATOM 2732 C GLU B 82 6.941 24.187 4.873 1.00 0.34 C ATOM 2733 O GLU B 82 7.619 24.954 5.557 1.00 0.27 O ATOM 2734 CB GLU B 82 6.730 22.143 6.287 1.00 0.69 C ATOM 2735 CG GLU B 82 7.771 21.418 5.448 1.00 0.48 C ATOM 2736 CD GLU B 82 8.500 20.342 6.226 1.00 0.92 C ATOM 2737 OE1 GLU B 82 7.996 19.930 7.293 1.00 1.27 O ATOM 2738 OE2 GLU B 82 9.584 19.911 5.777 1.00 1.70 O1- ATOM 2739 H GLU B 82 5.191 21.650 4.308 1.00 0.67 H ATOM 2740 HA GLU B 82 5.337 23.763 6.214 1.00 0.48 H ATOM 2741 HB2 GLU B 82 7.235 22.608 7.122 1.00 1.13 H ATOM 2742 HB3 GLU B 82 6.028 21.413 6.664 1.00 1.43 H ATOM 2743 HG2 GLU B 82 7.280 20.961 4.603 1.00 0.67 H ATOM 2744 HG3 GLU B 82 8.494 22.141 5.095 1.00 1.07 H ATOM 2745 N GLN B 83 7.017 24.144 3.553 1.00 0.35 N ATOM 2746 CA GLN B 83 7.909 25.020 2.811 1.00 0.31 C ATOM 2747 C GLN B 83 7.281 26.404 2.642 1.00 0.28 C ATOM 2748 O GLN B 83 7.963 27.369 2.303 1.00 0.30 O ATOM 2749 CB GLN B 83 8.215 24.406 1.443 1.00 0.36 C ATOM 2750 CG GLN B 83 9.412 25.025 0.735 1.00 0.39 C ATOM 2751 CD GLN B 83 9.681 24.398 -0.623 1.00 0.29 C ATOM 2752 OE1 GLN B 83 10.117 25.073 -1.554 1.00 0.45 O ATOM 2753 NE2 GLN B 83 9.432 23.102 -0.743 1.00 0.89 N ATOM 2754 H GLN B 83 6.464 23.499 3.062 1.00 0.42 H ATOM 2755 HA GLN B 83 8.826 25.114 3.371 1.00 0.29 H ATOM 2756 HB2 GLN B 83 8.407 23.353 1.573 1.00 0.34 H ATOM 2757 HB3 GLN B 83 7.350 24.530 0.811 1.00 0.40 H ATOM 2758 HG2 GLN B 83 9.227 26.081 0.597 1.00 0.43 H ATOM 2759 HG3 GLN B 83 10.287 24.892 1.354 1.00 0.50 H ATOM 2760 HE21 GLN B 83 9.098 22.617 0.041 1.00 1.39 H ATOM 2761 HE22 GLN B 83 9.595 22.679 -1.615 1.00 0.86 H ATOM 2762 N LEU B 84 5.981 26.493 2.900 1.00 0.27 N ATOM 2763 CA LEU B 84 5.263 27.759 2.764 1.00 0.26 C ATOM 2764 C LEU B 84 5.414 28.617 4.014 1.00 0.19 C ATOM 2765 O LEU B 84 5.249 29.838 3.964 1.00 0.26 O ATOM 2766 CB LEU B 84 3.774 27.515 2.476 1.00 0.39 C ATOM 2767 CG LEU B 84 3.303 27.850 1.049 1.00 0.50 C ATOM 2768 CD1 LEU B 84 3.456 29.338 0.753 1.00 0.62 C ATOM 2769 CD2 LEU B 84 4.059 27.019 0.018 1.00 1.24 C ATOM 2770 H LEU B 84 5.494 25.691 3.190 1.00 0.29 H ATOM 2771 HA LEU B 84 5.700 28.288 1.934 1.00 0.38 H ATOM 2772 HB2 LEU B 84 3.556 26.475 2.666 1.00 0.75 H ATOM 2773 HB3 LEU B 84 3.197 28.112 3.167 1.00 0.48 H ATOM 2774 HG LEU B 84 2.253 27.607 0.964 1.00 0.61 H ATOM 2775 HD11 LEU B 84 4.501 29.581 0.644 1.00 1.01 H ATOM 2776 HD12 LEU B 84 3.034 29.914 1.563 1.00 0.61 H ATOM 2777 HD13 LEU B 84 2.935 29.577 -0.163 1.00 0.90 H ATOM 2778 HD21 LEU B 84 3.782 25.979 0.119 1.00 1.19 H ATOM 2779 HD22 LEU B 84 5.122 27.123 0.177 1.00 1.62 H ATOM 2780 HD23 LEU B 84 3.810 27.363 -0.974 1.00 1.58 H ATOM 2781 N LYS B 85 5.719 27.984 5.136 1.00 0.35 N ATOM 2782 CA LYS B 85 5.891 28.715 6.382 1.00 0.59 C ATOM 2783 C LYS B 85 7.359 29.076 6.573 1.00 0.72 C ATOM 2784 O LYS B 85 8.220 28.617 5.821 1.00 0.98 O ATOM 2785 CB LYS B 85 5.377 27.908 7.579 1.00 0.69 C ATOM 2786 CG LYS B 85 6.150 26.624 7.839 1.00 0.66 C ATOM 2787 CD LYS B 85 6.049 26.194 9.295 1.00 0.84 C ATOM 2788 CE LYS B 85 4.638 25.755 9.662 1.00 1.01 C ATOM 2789 NZ LYS B 85 4.555 25.295 11.070 1.00 1.80 N1+ ATOM 2790 H LYS B 85 5.841 27.013 5.124 1.00 0.37 H ATOM 2791 HA LYS B 85 5.321 29.631 6.302 1.00 0.67 H ATOM 2792 HB2 LYS B 85 5.441 28.524 8.465 1.00 0.76 H ATOM 2793 HB3 LYS B 85 4.342 27.651 7.406 1.00 0.77 H ATOM 2794 HG2 LYS B 85 5.747 25.839 7.215 1.00 0.61 H ATOM 2795 HG3 LYS B 85 7.189 26.785 7.592 1.00 0.65 H ATOM 2796 HD2 LYS B 85 6.724 25.369 9.460 1.00 0.96 H ATOM 2797 HD3 LYS B 85 6.334 27.025 9.924 1.00 0.81 H ATOM 2798 HE2 LYS B 85 3.966 26.590 9.529 1.00 1.61 H ATOM 2799 HE3 LYS B 85 4.341 24.946 9.009 1.00 0.40 H ATOM 2800 HZ1 LYS B 85 4.765 26.081 11.719 1.00 1.75 H ATOM 2801 HZ2 LYS B 85 5.241 24.532 11.238 1.00 2.67 H ATOM 2802 HZ3 LYS B 85 3.600 24.937 11.275 1.00 1.94 H ATOM 2803 N LYS B 86 7.641 29.907 7.559 1.00 0.59 N ATOM 2804 CA LYS B 86 9.005 30.317 7.833 1.00 0.82 C ATOM 2805 C LYS B 86 9.465 29.751 9.167 1.00 0.82 C ATOM 2806 O LYS B 86 8.957 30.204 10.214 1.00 1.02 O ATOM 2807 CB LYS B 86 9.108 31.843 7.828 1.00 1.00 C ATOM 2808 CG LYS B 86 10.503 32.353 7.518 1.00 1.09 C ATOM 2809 CD LYS B 86 10.512 33.855 7.296 1.00 1.23 C ATOM 2810 CE LYS B 86 11.907 34.352 6.965 1.00 1.10 C ATOM 2811 NZ LYS B 86 12.864 34.097 8.074 1.00 0.86 N1+ ATOM 2812 H LYS B 86 6.917 30.256 8.122 1.00 0.39 H ATOM 2813 HA LYS B 86 9.634 29.921 7.052 1.00 0.91 H ATOM 2814 HB2 LYS B 86 8.430 32.234 7.084 1.00 1.02 H ATOM 2815 HB3 LYS B 86 8.820 32.217 8.799 1.00 1.06 H ATOM 2816 HG2 LYS B 86 11.152 32.117 8.347 1.00 1.04 H ATOM 2817 HG3 LYS B 86 10.865 31.865 6.625 1.00 1.14 H ATOM 2818 HD2 LYS B 86 9.849 34.096 6.476 1.00 1.26 H ATOM 2819 HD3 LYS B 86 10.167 34.344 8.194 1.00 1.42 H ATOM 2820 HE2 LYS B 86 12.255 33.843 6.079 1.00 1.25 H ATOM 2821 HE3 LYS B 86 11.861 35.413 6.775 1.00 1.11 H ATOM 2822 HZ1 LYS B 86 12.668 34.737 8.869 1.00 0.78 H ATOM 2823 HZ2 LYS B 86 13.840 34.253 7.751 1.00 0.91 H ATOM 2824 HZ3 LYS B 86 12.778 33.115 8.405 1.00 0.79 H TER 2825 LYS B 86