ATOM 1 N TYR A 1 8.094 -17.527 19.824 1.00 34.14 N1+ ATOM 2 CA TYR A 1 7.152 -16.464 20.153 1.00 53.42 C ATOM 3 C TYR A 1 6.900 -15.566 18.945 1.00 12.25 C ATOM 4 O TYR A 1 7.496 -15.752 17.885 1.00 45.22 O ATOM 5 CB TYR A 1 7.681 -15.629 21.320 1.00 22.42 C ATOM 6 CG TYR A 1 8.789 -14.677 20.932 1.00 70.33 C ATOM 7 CD1 TYR A 1 9.981 -15.149 20.395 1.00 24.35 C ATOM 8 CD2 TYR A 1 8.645 -13.305 21.099 1.00 13.35 C ATOM 9 CE1 TYR A 1 10.996 -14.283 20.040 1.00 70.05 C ATOM 10 CE2 TYR A 1 9.653 -12.432 20.745 1.00 62.04 C ATOM 11 CZ TYR A 1 10.828 -12.925 20.216 1.00 52.02 C ATOM 12 OH TYR A 1 11.836 -12.059 19.861 1.00 70.03 O ATOM 13 H1 TYR A 1 8.629 -17.455 19.006 1.00 51.53 H ATOM 14 HA TYR A 1 6.220 -16.925 20.446 1.00 1.30 H ATOM 15 HB3 TYR A 1 8.064 -16.292 22.083 1.00 42.14 H ATOM 16 HD1 TYR A 1 10.109 -16.212 20.258 1.00 32.41 H ATOM 17 HD2 TYR A 1 7.723 -12.922 21.514 1.00 1.12 H ATOM 18 HE1 TYR A 1 11.916 -14.669 19.624 1.00 10.52 H ATOM 19 HE2 TYR A 1 9.523 -11.368 20.882 1.00 1.42 H ATOM 20 HH TYR A 1 12.620 -12.560 19.623 1.00 72.11 H ATOM 21 N ARG A 2 6.010 -14.593 19.115 1.00 23.43 N ATOM 22 CA ARG A 2 5.678 -13.666 18.040 1.00 35.22 C ATOM 23 C ARG A 2 6.772 -12.617 17.869 1.00 73.21 C ATOM 24 O ARG A 2 7.221 -12.010 18.841 1.00 15.14 O ATOM 25 CB ARG A 2 4.340 -12.981 18.325 1.00 33.23 C ATOM 26 CG ARG A 2 4.322 -12.195 19.625 1.00 11.23 C ATOM 27 CD ARG A 2 4.628 -10.724 19.391 1.00 10.22 C ATOM 28 NE ARG A 2 3.417 -9.947 19.143 1.00 2.50 N ATOM 29 CZ ARG A 2 2.519 -9.666 20.080 1.00 3.35 C ATOM 30 NH1 ARG A 2 2.696 -10.096 21.323 1.00 54.21 N ATOM 31 NH2 ARG A 2 1.442 -8.952 19.777 1.00 23.43 N ATOM 32 H ARG A 2 5.567 -14.496 19.985 1.00 72.42 H ATOM 33 HA ARG A 2 5.594 -14.235 17.126 1.00 11.55 H ATOM 34 HB3 ARG A 2 3.567 -13.734 18.374 1.00 35.12 H ATOM 35 HG3 ARG A 2 5.064 -12.607 20.293 1.00 3.24 H ATOM 36 HD3 ARG A 2 5.281 -10.638 18.535 1.00 5.34 H ATOM 37 HE ARG A 2 3.266 -9.618 18.233 1.00 72.23 H ATOM 38 HH11 ARG A 2 3.507 -10.633 21.554 1.00 13.43 H ATOM 39 HH12 ARG A 2 2.018 -9.882 22.028 1.00 53.15 H ATOM 40 HH21 ARG A 2 1.306 -8.625 18.843 1.00 15.53 H ATOM 41 HH22 ARG A 2 0.766 -8.741 20.484 1.00 64.25 H ATOM 42 N GLN A 3 7.196 -12.409 16.626 1.00 2.34 N ATOM 43 CA GLN A 3 8.238 -11.434 16.328 1.00 51.53 C ATOM 44 C GLN A 3 7.761 -10.429 15.285 1.00 2.11 C ATOM 45 O GLN A 3 6.680 -10.578 14.714 1.00 2.23 O ATOM 46 CB GLN A 3 9.501 -12.141 15.832 1.00 15.22 C ATOM 47 CG GLN A 3 9.921 -13.315 16.701 1.00 72.43 C ATOM 48 CD GLN A 3 11.330 -13.789 16.398 1.00 34.03 C ATOM 49 OE1 GLN A 3 11.526 -14.853 15.811 1.00 13.11 O ATOM 50 NE2 GLN A 3 12.319 -13.000 16.800 1.00 75.32 N ATOM 51 H GLN A 3 6.798 -12.924 15.893 1.00 60.32 H ATOM 52 HA GLN A 3 8.467 -10.906 17.240 1.00 25.01 H ATOM 53 HB3 GLN A 3 10.312 -11.429 15.809 1.00 52.31 H ATOM 54 HG3 GLN A 3 9.237 -14.133 16.534 1.00 34.31 H ATOM 55 HE21 GLN A 3 12.088 -12.168 17.263 1.00 4.24 H ATOM 56 HE22 GLN A 3 13.239 -13.282 16.618 1.00 35.34 H ATOM 57 N SER A 4 8.573 -9.405 15.042 1.00 74.44 N ATOM 58 CA SER A 4 8.231 -8.373 14.070 1.00 44.31 C ATOM 59 C SER A 4 9.211 -8.382 12.900 1.00 32.33 C ATOM 60 O SER A 4 9.046 -7.641 11.932 1.00 11.41 O ATOM 61 CB SER A 4 8.230 -6.996 14.737 1.00 73.31 C ATOM 62 OG SER A 4 7.152 -6.203 14.269 1.00 21.52 O ATOM 63 H SER A 4 9.421 -9.343 15.529 1.00 4.53 H ATOM 64 HA SER A 4 7.241 -8.584 13.697 1.00 55.43 H ATOM 65 HB3 SER A 4 9.158 -6.489 14.513 1.00 54.24 H ATOM 66 HG SER A 4 7.484 -5.351 13.978 1.00 73.01 H ATOM 67 N MET A 5 10.230 -9.229 12.997 1.00 71.42 N ATOM 68 CA MET A 5 11.236 -9.338 11.946 1.00 4.22 C ATOM 69 C MET A 5 11.054 -10.626 11.151 1.00 73.14 C ATOM 70 O MET A 5 10.570 -11.627 11.676 1.00 12.02 O ATOM 71 CB MET A 5 12.642 -9.291 12.549 1.00 3.44 C ATOM 72 CG MET A 5 13.729 -8.982 11.534 1.00 40.02 C ATOM 73 SD MET A 5 15.376 -8.957 12.265 1.00 61.22 S ATOM 74 CE MET A 5 16.295 -8.082 11.001 1.00 72.41 C ATOM 75 H MET A 5 10.309 -9.795 13.794 1.00 53.21 H ATOM 76 HA MET A 5 11.112 -8.497 11.282 1.00 51.24 H ATOM 77 HB3 MET A 5 12.860 -10.248 12.999 1.00 54.13 H ATOM 78 HG3 MET A 5 13.530 -8.015 11.096 1.00 12.43 H ATOM 79 HE1 MET A 5 16.902 -7.317 11.461 1.00 42.21 H ATOM 80 HE2 MET A 5 16.932 -8.777 10.474 1.00 34.43 H ATOM 81 HE3 MET A 5 15.606 -7.627 10.305 1.00 3.03 H ATOM 82 N ASN A 6 11.446 -10.592 9.881 1.00 23.45 N ATOM 83 CA ASN A 6 11.325 -11.758 9.013 1.00 41.53 C ATOM 84 C ASN A 6 12.675 -12.125 8.404 1.00 23.25 C ATOM 85 O ASN A 6 13.551 -11.275 8.252 1.00 23.10 O ATOM 86 CB ASN A 6 10.309 -11.488 7.901 1.00 52.05 C ATOM 87 CG ASN A 6 10.914 -10.724 6.738 1.00 21.42 C ATOM 88 OD1 ASN A 6 11.060 -11.258 5.639 1.00 32.34 O ATOM 89 ND2 ASN A 6 11.269 -9.467 6.977 1.00 11.12 N ATOM 90 H ASN A 6 11.825 -9.764 9.519 1.00 51.00 H ATOM 91 HA ASN A 6 10.977 -12.584 9.614 1.00 12.43 H ATOM 92 HB3 ASN A 6 9.491 -10.909 8.302 1.00 40.43 H ATOM 93 HD21 ASN A 6 11.124 -9.107 7.877 1.00 14.13 H ATOM 94 HD22 ASN A 6 11.662 -8.951 6.242 1.00 5.34 H ATOM 95 N ASN A 7 12.835 -13.398 8.060 1.00 32.45 N ATOM 96 CA ASN A 7 14.079 -13.880 7.469 1.00 41.15 C ATOM 97 C ASN A 7 13.978 -15.363 7.121 1.00 45.40 C ATOM 98 O ASN A 7 13.991 -16.220 8.005 1.00 20.42 O ATOM 99 CB ASN A 7 15.247 -13.648 8.428 1.00 44.15 C ATOM 100 CG ASN A 7 16.478 -13.112 7.722 1.00 72.25 C ATOM 101 OD1 ASN A 7 17.353 -13.875 7.312 1.00 21.42 O ATOM 102 ND2 ASN A 7 16.551 -11.794 7.576 1.00 34.04 N ATOM 103 H ASN A 7 12.100 -14.031 8.207 1.00 40.14 H ATOM 104 HA ASN A 7 14.252 -13.321 6.562 1.00 72.21 H ATOM 105 HB3 ASN A 7 15.506 -14.581 8.905 1.00 22.15 H ATOM 106 HD21 ASN A 7 15.816 -11.249 7.928 1.00 12.10 H ATOM 107 HD22 ASN A 7 17.335 -11.421 7.122 1.00 33.52 H ATOM 108 N PHE A 8 13.879 -15.657 5.830 1.00 41.41 N ATOM 109 CA PHE A 8 13.775 -17.035 5.365 1.00 22.33 C ATOM 110 C PHE A 8 13.720 -17.093 3.841 1.00 5.34 C ATOM 111 O PHE A 8 13.841 -16.071 3.166 1.00 4.24 O ATOM 112 CB PHE A 8 12.534 -17.704 5.957 1.00 21.13 C ATOM 113 CG PHE A 8 11.301 -16.850 5.885 1.00 50.43 C ATOM 114 CD1 PHE A 8 10.766 -16.485 4.660 1.00 15.43 C ATOM 115 CD2 PHE A 8 10.676 -16.410 7.041 1.00 23.44 C ATOM 116 CE1 PHE A 8 9.631 -15.700 4.589 1.00 44.32 C ATOM 117 CE2 PHE A 8 9.541 -15.625 6.977 1.00 1.34 C ATOM 118 CZ PHE A 8 9.018 -15.267 5.749 1.00 31.34 C ATOM 119 H PHE A 8 13.873 -14.929 5.173 1.00 61.54 H ATOM 120 HA PHE A 8 14.654 -17.564 5.702 1.00 60.15 H ATOM 121 HB3 PHE A 8 12.719 -17.934 6.996 1.00 0.25 H ATOM 122 HD1 PHE A 8 11.244 -16.821 3.751 1.00 20.12 H ATOM 123 HD2 PHE A 8 11.084 -16.689 8.003 1.00 41.45 H ATOM 124 HE1 PHE A 8 9.225 -15.422 3.627 1.00 25.11 H ATOM 125 HE2 PHE A 8 9.064 -15.289 7.886 1.00 63.12 H ATOM 126 HZ PHE A 8 8.131 -14.655 5.696 1.00 64.21 H ATOM 127 N GLN A 9 13.536 -18.296 3.307 1.00 44.14 N ATOM 128 CA GLN A 9 13.467 -18.488 1.863 1.00 52.32 C ATOM 129 C GLN A 9 12.175 -17.905 1.299 1.00 4.30 C ATOM 130 O GLN A 9 12.203 -17.039 0.426 1.00 50.42 O ATOM 131 CB GLN A 9 13.561 -19.975 1.520 1.00 51.04 C ATOM 132 CG GLN A 9 14.945 -20.407 1.059 1.00 3.44 C ATOM 133 CD GLN A 9 15.212 -21.876 1.315 1.00 73.31 C ATOM 134 OE1 GLN A 9 14.491 -22.529 2.071 1.00 55.44 O ATOM 135 NE2 GLN A 9 16.253 -22.407 0.684 1.00 74.43 N ATOM 136 H GLN A 9 13.448 -19.073 3.897 1.00 51.40 H ATOM 137 HA GLN A 9 14.304 -17.971 1.420 1.00 53.41 H ATOM 138 HB3 GLN A 9 12.858 -20.195 0.730 1.00 41.31 H ATOM 139 HG3 GLN A 9 15.684 -19.823 1.589 1.00 11.13 H ATOM 140 HE21 GLN A 9 16.784 -21.827 0.098 1.00 22.13 H ATOM 141 HE22 GLN A 9 16.449 -23.355 0.831 1.00 44.14 H ATOM 142 N GLY A 10 11.044 -18.386 1.805 1.00 53.12 N ATOM 143 CA GLY A 10 9.757 -17.901 1.338 1.00 45.13 C ATOM 144 C GLY A 10 8.602 -18.744 1.842 1.00 65.22 C ATOM 145 O GLY A 10 8.065 -19.575 1.110 1.00 75.14 O ATOM 146 H GLY A 10 11.082 -19.076 2.499 1.00 11.10 H ATOM 147 HA2 GLY A 10 9.623 -16.885 1.678 1.00 65.03 H ATOM 148 HA3 GLY A 10 9.751 -17.912 0.258 1.00 30.21 H ATOM 149 N LEU A 11 8.221 -18.531 3.097 1.00 72.42 N ATOM 150 CA LEU A 11 7.123 -19.280 3.699 1.00 2.11 C ATOM 151 C LEU A 11 5.935 -18.367 3.986 1.00 12.32 C ATOM 152 O LEU A 11 4.797 -18.685 3.638 1.00 62.02 O ATOM 153 CB LEU A 11 7.587 -19.953 4.992 1.00 44.32 C ATOM 154 CG LEU A 11 8.603 -19.172 5.828 1.00 73.33 C ATOM 155 CD1 LEU A 11 8.222 -19.206 7.299 1.00 2.13 C ATOM 156 CD2 LEU A 11 10.003 -19.732 5.625 1.00 53.20 C ATOM 157 H LEU A 11 8.687 -17.856 3.631 1.00 21.24 H ATOM 158 HA LEU A 11 6.816 -20.040 2.998 1.00 71.33 H ATOM 159 HB3 LEU A 11 8.033 -20.901 4.729 1.00 32.33 H ATOM 160 HG LEU A 11 8.605 -18.139 5.508 1.00 13.32 H ATOM 161 HD11 LEU A 11 8.597 -20.113 7.748 1.00 24.12 H ATOM 162 HD12 LEU A 11 7.146 -19.177 7.394 1.00 42.34 H ATOM 163 HD13 LEU A 11 8.650 -18.351 7.802 1.00 45.10 H ATOM 164 HD21 LEU A 11 9.947 -20.803 5.493 1.00 3.40 H ATOM 165 HD22 LEU A 11 10.609 -19.506 6.489 1.00 21.43 H ATOM 166 HD23 LEU A 11 10.447 -19.283 4.748 1.00 35.22 H ATOM 167 N ARG A 12 6.207 -17.232 4.620 1.00 44.40 N ATOM 168 CA ARG A 12 5.160 -16.272 4.953 1.00 23.11 C ATOM 169 C ARG A 12 5.111 -15.145 3.926 1.00 4.31 C ATOM 170 O ARG A 12 4.427 -14.140 4.125 1.00 72.32 O ATOM 171 CB ARG A 12 5.394 -15.694 6.350 1.00 41.24 C ATOM 172 CG ARG A 12 5.547 -16.753 7.429 1.00 5.35 C ATOM 173 CD ARG A 12 4.957 -16.289 8.752 1.00 73.31 C ATOM 174 NE ARG A 12 3.506 -16.149 8.685 1.00 2.54 N ATOM 175 CZ ARG A 12 2.667 -17.178 8.685 1.00 13.24 C ATOM 176 NH1 ARG A 12 3.132 -18.418 8.749 1.00 23.10 N ATOM 177 NH2 ARG A 12 1.358 -16.969 8.622 1.00 54.02 N ATOM 178 H ARG A 12 7.133 -17.034 4.872 1.00 61.53 H ATOM 179 HA ARG A 12 4.216 -16.795 4.942 1.00 4.31 H ATOM 180 HB3 ARG A 12 4.557 -15.065 6.610 1.00 2.41 H ATOM 181 HG3 ARG A 12 6.597 -16.965 7.567 1.00 5.43 H ATOM 182 HD3 ARG A 12 5.391 -15.334 9.009 1.00 74.04 H ATOM 183 HE ARG A 12 3.139 -15.241 8.637 1.00 41.11 H ATOM 184 HH11 ARG A 12 4.119 -18.578 8.798 1.00 0.22 H ATOM 185 HH12 ARG A 12 2.499 -19.191 8.751 1.00 33.31 H ATOM 186 HH21 ARG A 12 1.002 -16.035 8.574 1.00 34.41 H ATOM 187 HH22 ARG A 12 0.727 -17.745 8.622 1.00 43.20 H ATOM 188 N SER A 13 5.840 -15.318 2.829 1.00 63.23 N ATOM 189 CA SER A 13 5.883 -14.313 1.772 1.00 20.53 C ATOM 190 C SER A 13 4.497 -14.096 1.173 1.00 13.15 C ATOM 191 O SER A 13 4.156 -12.990 0.752 1.00 61.44 O ATOM 192 CB SER A 13 6.864 -14.735 0.677 1.00 35.44 C ATOM 193 OG SER A 13 7.686 -13.651 0.282 1.00 23.05 O ATOM 194 H SER A 13 6.365 -16.140 2.728 1.00 31.12 H ATOM 195 HA SER A 13 6.222 -13.386 2.210 1.00 61.32 H ATOM 196 HB3 SER A 13 6.311 -15.084 -0.183 1.00 3.30 H ATOM 197 HG SER A 13 8.416 -13.978 -0.247 1.00 61.43 H ATOM 198 N PHE A 14 3.701 -15.159 1.138 1.00 33.15 N ATOM 199 CA PHE A 14 2.351 -15.087 0.591 1.00 51.34 C ATOM 200 C PHE A 14 1.661 -16.446 0.661 1.00 4.24 C ATOM 201 O PHE A 14 2.297 -17.486 0.499 1.00 62.11 O ATOM 202 CB PHE A 14 2.393 -14.599 -0.859 1.00 43.51 C ATOM 203 CG PHE A 14 1.086 -14.758 -1.582 1.00 55.21 C ATOM 204 CD1 PHE A 14 0.630 -16.014 -1.948 1.00 23.43 C ATOM 205 CD2 PHE A 14 0.314 -13.651 -1.896 1.00 51.32 C ATOM 206 CE1 PHE A 14 -0.571 -16.163 -2.614 1.00 15.22 C ATOM 207 CE2 PHE A 14 -0.890 -13.795 -2.562 1.00 44.14 C ATOM 208 CZ PHE A 14 -1.333 -15.052 -2.921 1.00 3.33 C ATOM 209 H PHE A 14 4.029 -16.014 1.490 1.00 74.02 H ATOM 210 HA PHE A 14 1.792 -14.381 1.184 1.00 51.53 H ATOM 211 HB3 PHE A 14 3.142 -15.158 -1.398 1.00 53.01 H ATOM 212 HD1 PHE A 14 1.223 -16.884 -1.708 1.00 33.31 H ATOM 213 HD2 PHE A 14 0.659 -12.666 -1.616 1.00 61.42 H ATOM 214 HE1 PHE A 14 -0.917 -17.148 -2.893 1.00 42.13 H ATOM 215 HE2 PHE A 14 -1.482 -12.923 -2.800 1.00 62.13 H ATOM 216 HZ PHE A 14 -2.272 -15.166 -3.442 1.00 4.23 H ATOM 217 N GLY A 15 0.355 -16.427 0.907 1.00 23.04 N ATOM 218 CA GLY A 15 -0.401 -17.663 0.998 1.00 74.40 C ATOM 219 C GLY A 15 -1.897 -17.437 0.900 1.00 25.44 C ATOM 220 O GLY A 15 -2.688 -18.271 1.341 1.00 11.04 O ATOM 221 H GLY A 15 -0.100 -15.568 1.029 1.00 53.33 H ATOM 222 HA2 GLY A 15 -0.094 -18.319 0.196 1.00 22.34 H ATOM 223 HA3 GLY A 15 -0.180 -18.138 1.942 1.00 12.41 H ATOM 224 N CYS A 16 -2.286 -16.305 0.324 1.00 1.34 N ATOM 225 CA CYS A 16 -3.696 -15.968 0.173 1.00 33.21 C ATOM 226 C CYS A 16 -4.019 -15.617 -1.276 1.00 11.42 C ATOM 227 O CYS A 16 -3.875 -14.468 -1.694 1.00 1.32 O ATOM 228 CB CYS A 16 -4.065 -14.799 1.088 1.00 42.42 C ATOM 229 SG CYS A 16 -2.877 -13.418 1.043 1.00 33.02 S ATOM 230 H CYS A 16 -1.608 -15.679 -0.007 1.00 40.01 H ATOM 231 HA CYS A 16 -4.276 -16.834 0.458 1.00 41.00 H ATOM 232 HB3 CYS A 16 -4.121 -15.152 2.107 1.00 30.03 H ATOM 233 N ARG A 17 -4.457 -16.614 -2.038 1.00 60.32 N ATOM 234 CA ARG A 17 -4.800 -16.411 -3.440 1.00 70.31 C ATOM 235 C ARG A 17 -5.757 -15.234 -3.601 1.00 5.32 C ATOM 236 O ARG A 17 -5.556 -14.367 -4.452 1.00 32.31 O ATOM 237 CB ARG A 17 -5.430 -17.678 -4.023 1.00 63.41 C ATOM 238 CG ARG A 17 -5.454 -17.703 -5.542 1.00 64.41 C ATOM 239 CD ARG A 17 -4.294 -18.510 -6.104 1.00 75.33 C ATOM 240 NE ARG A 17 -4.749 -19.569 -7.002 1.00 54.42 N ATOM 241 CZ ARG A 17 -5.341 -20.682 -6.585 1.00 70.52 C ATOM 242 NH1 ARG A 17 -5.548 -20.883 -5.291 1.00 50.23 N ATOM 243 NH2 ARG A 17 -5.727 -21.598 -7.464 1.00 30.53 N ATOM 244 H ARG A 17 -4.551 -17.508 -1.648 1.00 54.41 H ATOM 245 HA ARG A 17 -3.888 -16.194 -3.976 1.00 45.33 H ATOM 246 HB3 ARG A 17 -6.445 -17.756 -3.667 1.00 30.41 H ATOM 247 HG3 ARG A 17 -5.388 -16.690 -5.910 1.00 44.33 H ATOM 248 HD3 ARG A 17 -3.752 -18.956 -5.284 1.00 41.20 H ATOM 249 HE ARG A 17 -4.606 -19.441 -7.963 1.00 70.34 H ATOM 250 HH11 ARG A 17 -5.259 -20.193 -4.627 1.00 53.31 H ATOM 251 HH12 ARG A 17 -5.995 -21.722 -4.980 1.00 61.13 H ATOM 252 HH21 ARG A 17 -5.572 -21.452 -8.441 1.00 11.55 H ATOM 253 HH22 ARG A 17 -6.171 -22.436 -7.149 1.00 32.40 H ATOM 254 N PHE A 18 -6.800 -15.210 -2.777 1.00 51.21 N ATOM 255 CA PHE A 18 -7.790 -14.140 -2.828 1.00 74.33 C ATOM 256 C PHE A 18 -8.554 -14.043 -1.511 1.00 3.10 C ATOM 257 O PHE A 18 -8.550 -14.975 -0.709 1.00 14.24 O ATOM 258 CB PHE A 18 -8.768 -14.377 -3.981 1.00 3.41 C ATOM 259 CG PHE A 18 -8.281 -13.844 -5.299 1.00 41.21 C ATOM 260 CD1 PHE A 18 -8.312 -12.484 -5.566 1.00 33.24 C ATOM 261 CD2 PHE A 18 -7.792 -14.703 -6.270 1.00 44.13 C ATOM 262 CE1 PHE A 18 -7.866 -11.992 -6.777 1.00 74.33 C ATOM 263 CE2 PHE A 18 -7.344 -14.216 -7.483 1.00 71.24 C ATOM 264 CZ PHE A 18 -7.379 -12.860 -7.737 1.00 3.43 C ATOM 265 H PHE A 18 -6.906 -15.929 -2.119 1.00 44.42 H ATOM 266 HA PHE A 18 -7.266 -13.212 -2.996 1.00 34.31 H ATOM 267 HB3 PHE A 18 -9.706 -13.894 -3.753 1.00 41.02 H ATOM 268 HD1 PHE A 18 -8.691 -11.806 -4.816 1.00 2.32 H ATOM 269 HD2 PHE A 18 -7.763 -15.765 -6.073 1.00 25.13 H ATOM 270 HE1 PHE A 18 -7.894 -10.931 -6.973 1.00 11.11 H ATOM 271 HE2 PHE A 18 -6.965 -14.897 -8.231 1.00 71.34 H ATOM 272 HZ PHE A 18 -7.031 -12.477 -8.685 1.00 25.24 H ATOM 273 N GLY A 19 -9.207 -12.905 -1.295 1.00 52.25 N ATOM 274 CA GLY A 19 -9.965 -12.704 -0.074 1.00 61.21 C ATOM 275 C GLY A 19 -9.399 -11.590 0.783 1.00 12.25 C ATOM 276 O GLY A 19 -9.453 -10.418 0.408 1.00 61.03 O ATOM 277 H GLY A 19 -9.174 -12.195 -1.971 1.00 63.43 H ATOM 278 HA2 GLY A 19 -10.985 -12.464 -0.332 1.00 54.33 H ATOM 279 HA3 GLY A 19 -9.956 -13.621 0.496 1.00 22.53 H ATOM 280 N THR A 20 -8.856 -11.953 1.942 1.00 15.41 N ATOM 281 CA THR A 20 -8.282 -10.975 2.857 1.00 71.15 C ATOM 282 C THR A 20 -7.155 -10.195 2.190 1.00 11.01 C ATOM 283 O THR A 20 -7.161 -8.963 2.179 1.00 74.45 O ATOM 284 CB THR A 20 -7.739 -11.649 4.131 1.00 15.42 C ATOM 285 OG1 THR A 20 -7.095 -12.883 3.797 1.00 53.21 O ATOM 286 CG2 THR A 20 -8.862 -11.911 5.124 1.00 51.42 C ATOM 287 H THR A 20 -8.844 -12.902 2.185 1.00 13.21 H ATOM 288 HA THR A 20 -9.063 -10.286 3.143 1.00 32.02 H ATOM 289 HB THR A 20 -7.019 -10.988 4.591 1.00 72.25 H ATOM 290 HG1 THR A 20 -7.750 -13.585 3.751 1.00 23.24 H ATOM 291 HG21 THR A 20 -8.824 -12.940 5.449 1.00 65.33 H ATOM 292 HG22 THR A 20 -9.814 -11.719 4.650 1.00 12.14 H ATOM 293 HG23 THR A 20 -8.747 -11.259 5.977 1.00 3.14 H ATOM 294 N CYS A 21 -6.188 -10.918 1.634 1.00 11.24 N ATOM 295 CA CYS A 21 -5.054 -10.294 0.965 1.00 51.31 C ATOM 296 C CYS A 21 -4.871 -10.862 -0.439 1.00 71.02 C ATOM 297 O CYS A 21 -5.060 -12.058 -0.668 1.00 2.11 O ATOM 298 CB CYS A 21 -3.776 -10.500 1.781 1.00 15.32 C ATOM 299 SG CYS A 21 -3.578 -12.188 2.437 1.00 32.33 S ATOM 300 H CYS A 21 -6.238 -11.897 1.676 1.00 13.45 H ATOM 301 HA CYS A 21 -5.254 -9.236 0.888 1.00 1.44 H ATOM 302 HB3 CYS A 21 -3.779 -9.820 2.619 1.00 1.30 H ATOM 303 N THR A 22 -4.500 -9.997 -1.379 1.00 13.31 N ATOM 304 CA THR A 22 -4.292 -10.411 -2.761 1.00 31.22 C ATOM 305 C THR A 22 -3.774 -9.256 -3.609 1.00 52.31 C ATOM 306 O THR A 22 -3.612 -8.138 -3.120 1.00 41.54 O ATOM 307 CB THR A 22 -5.592 -10.952 -3.387 1.00 4.44 C ATOM 308 OG1 THR A 22 -5.308 -11.579 -4.642 1.00 63.55 O ATOM 309 CG2 THR A 22 -6.600 -9.830 -3.592 1.00 11.12 C ATOM 310 H THR A 22 -4.365 -9.059 -1.135 1.00 44.53 H ATOM 311 HA THR A 22 -3.560 -11.205 -2.764 1.00 61.24 H ATOM 312 HB THR A 22 -6.020 -11.682 -2.717 1.00 32.25 H ATOM 313 HG1 THR A 22 -5.288 -12.532 -4.527 1.00 23.30 H ATOM 314 HG21 THR A 22 -6.750 -9.670 -4.648 1.00 44.24 H ATOM 315 HG22 THR A 22 -6.227 -8.923 -3.139 1.00 62.33 H ATOM 316 HG23 THR A 22 -7.539 -10.102 -3.132 1.00 31.23 H ATOM 317 N VAL A 23 -3.515 -9.533 -4.883 1.00 14.12 N ATOM 318 CA VAL A 23 -3.017 -8.516 -5.801 1.00 51.51 C ATOM 319 C VAL A 23 -3.873 -7.255 -5.741 1.00 54.25 C ATOM 320 O VAL A 23 -3.377 -6.147 -5.939 1.00 3.43 O ATOM 321 CB VAL A 23 -2.986 -9.034 -7.251 1.00 61.10 C ATOM 322 CG1 VAL A 23 -2.164 -10.310 -7.343 1.00 55.12 C ATOM 323 CG2 VAL A 23 -4.399 -9.262 -7.765 1.00 14.40 C ATOM 324 H VAL A 23 -3.665 -10.443 -5.215 1.00 2.25 H ATOM 325 HA VAL A 23 -2.008 -8.267 -5.507 1.00 71.01 H ATOM 326 HB VAL A 23 -2.516 -8.284 -7.870 1.00 4.43 H ATOM 327 HG11 VAL A 23 -2.718 -11.128 -6.905 1.00 65.54 H ATOM 328 HG12 VAL A 23 -1.956 -10.530 -8.381 1.00 22.05 H ATOM 329 HG13 VAL A 23 -1.234 -10.179 -6.809 1.00 14.33 H ATOM 330 HG21 VAL A 23 -4.996 -9.717 -6.989 1.00 15.41 H ATOM 331 HG22 VAL A 23 -4.836 -8.316 -8.048 1.00 44.22 H ATOM 332 HG23 VAL A 23 -4.369 -9.915 -8.625 1.00 35.43 H ATOM 333 N GLN A 24 -5.162 -7.435 -5.469 1.00 5.33 N ATOM 334 CA GLN A 24 -6.087 -6.310 -5.384 1.00 32.24 C ATOM 335 C GLN A 24 -5.811 -5.471 -4.142 1.00 10.33 C ATOM 336 O GLN A 24 -5.455 -4.296 -4.240 1.00 64.32 O ATOM 337 CB GLN A 24 -7.532 -6.813 -5.363 1.00 54.13 C ATOM 338 CG GLN A 24 -8.224 -6.731 -6.714 1.00 33.12 C ATOM 339 CD GLN A 24 -9.417 -7.661 -6.816 1.00 42.22 C ATOM 340 OE1 GLN A 24 -10.515 -7.242 -7.184 1.00 31.43 O ATOM 341 NE2 GLN A 24 -9.208 -8.931 -6.491 1.00 51.10 N ATOM 342 H GLN A 24 -5.498 -8.342 -5.321 1.00 13.01 H ATOM 343 HA GLN A 24 -5.942 -5.695 -6.259 1.00 12.04 H ATOM 344 HB3 GLN A 24 -8.097 -6.221 -4.658 1.00 73.30 H ATOM 345 HG3 GLN A 24 -7.513 -6.995 -7.484 1.00 54.53 H ATOM 346 HE21 GLN A 24 -8.307 -9.193 -6.206 1.00 22.00 H ATOM 347 HE22 GLN A 24 -9.961 -9.553 -6.547 1.00 74.34 H ATOM 348 N LYS A 25 -5.979 -6.079 -2.972 1.00 72.34 N ATOM 349 CA LYS A 25 -5.747 -5.388 -1.709 1.00 73.34 C ATOM 350 C LYS A 25 -4.346 -4.786 -1.668 1.00 31.43 C ATOM 351 O LYS A 25 -4.108 -3.788 -0.988 1.00 1.41 O ATOM 352 CB LYS A 25 -5.935 -6.352 -0.536 1.00 2.22 C ATOM 353 CG LYS A 25 -7.379 -6.493 -0.089 1.00 0.31 C ATOM 354 CD LYS A 25 -8.271 -6.965 -1.226 1.00 65.42 C ATOM 355 CE LYS A 25 -9.695 -7.212 -0.752 1.00 22.15 C ATOM 356 NZ LYS A 25 -10.319 -5.976 -0.204 1.00 64.13 N1+ ATOM 357 H LYS A 25 -6.265 -7.017 -2.959 1.00 1.43 H ATOM 358 HA LYS A 25 -6.471 -4.592 -1.630 1.00 10.14 H ATOM 359 HB3 LYS A 25 -5.354 -5.996 0.304 1.00 42.44 H ATOM 360 HG3 LYS A 25 -7.734 -5.534 0.260 1.00 52.55 H ATOM 361 HD3 LYS A 25 -7.870 -7.885 -1.627 1.00 35.22 H ATOM 362 HE3 LYS A 25 -9.678 -7.969 0.019 1.00 44.12 H ATOM 363 HZ1 LYS A 25 -11.284 -5.867 -0.577 1.00 21.32 H ATOM 364 HZ2 LYS A 25 -9.759 -5.142 -0.475 1.00 34.23 H ATOM 365 HZ3 LYS A 25 -10.364 -6.027 0.834 1.00 14.01 H ATOM 366 N LEU A 26 -3.422 -5.399 -2.400 1.00 25.03 N ATOM 367 CA LEU A 26 -2.044 -4.922 -2.447 1.00 43.23 C ATOM 368 C LEU A 26 -1.894 -3.794 -3.463 1.00 42.13 C ATOM 369 O LEU A 26 -1.171 -2.826 -3.228 1.00 24.31 O ATOM 370 CB LEU A 26 -1.098 -6.071 -2.800 1.00 73.34 C ATOM 371 CG LEU A 26 0.358 -5.685 -3.064 1.00 51.24 C ATOM 372 CD1 LEU A 26 1.025 -5.211 -1.783 1.00 2.34 C ATOM 373 CD2 LEU A 26 1.120 -6.858 -3.662 1.00 62.15 C ATOM 374 H LEU A 26 -3.671 -6.190 -2.920 1.00 35.21 H ATOM 375 HA LEU A 26 -1.790 -4.545 -1.468 1.00 40.00 H ATOM 376 HB3 LEU A 26 -1.480 -6.552 -3.690 1.00 10.34 H ATOM 377 HG LEU A 26 0.385 -4.870 -3.775 1.00 31.11 H ATOM 378 HD11 LEU A 26 0.730 -4.193 -1.579 1.00 4.32 H ATOM 379 HD12 LEU A 26 2.097 -5.260 -1.895 1.00 63.13 H ATOM 380 HD13 LEU A 26 0.721 -5.845 -0.962 1.00 34.21 H ATOM 381 HD21 LEU A 26 1.688 -7.352 -2.887 1.00 15.42 H ATOM 382 HD22 LEU A 26 1.794 -6.497 -4.426 1.00 54.43 H ATOM 383 HD23 LEU A 26 0.422 -7.556 -4.099 1.00 33.12 H ATOM 384 N ALA A 27 -2.583 -3.924 -4.592 1.00 32.21 N ATOM 385 CA ALA A 27 -2.529 -2.915 -5.641 1.00 3.41 C ATOM 386 C ALA A 27 -3.083 -1.582 -5.148 1.00 54.44 C ATOM 387 O ALA A 27 -2.874 -0.541 -5.774 1.00 73.01 O ATOM 388 CB ALA A 27 -3.295 -3.386 -6.868 1.00 25.33 C ATOM 389 H ALA A 27 -3.142 -4.719 -4.721 1.00 3.51 H ATOM 390 HA ALA A 27 -1.494 -2.780 -5.923 1.00 25.11 H ATOM 391 HB1 ALA A 27 -4.332 -3.542 -6.606 1.00 63.52 H ATOM 392 HB2 ALA A 27 -3.229 -2.637 -7.643 1.00 60.50 H ATOM 393 HB3 ALA A 27 -2.869 -4.313 -7.223 1.00 1.52 H ATOM 394 N HIS A 28 -3.791 -1.619 -4.024 1.00 54.34 N ATOM 395 CA HIS A 28 -4.376 -0.413 -3.448 1.00 71.41 C ATOM 396 C HIS A 28 -3.327 0.685 -3.307 1.00 12.02 C ATOM 397 O HIS A 28 -3.645 1.872 -3.378 1.00 73.22 O ATOM 398 CB HIS A 28 -4.995 -0.722 -2.085 1.00 75.20 C ATOM 399 CG HIS A 28 -6.492 -0.743 -2.097 1.00 14.11 C ATOM 400 ND1 HIS A 28 -7.258 -0.464 -0.985 1.00 44.44 N ATOM 401 CD2 HIS A 28 -7.366 -1.011 -3.096 1.00 65.12 C ATOM 402 CE1 HIS A 28 -8.538 -0.559 -1.299 1.00 33.50 C ATOM 403 NE2 HIS A 28 -8.630 -0.890 -2.575 1.00 33.44 N ATOM 404 H HIS A 28 -3.923 -2.478 -3.571 1.00 54.10 H ATOM 405 HA HIS A 28 -5.152 -0.069 -4.116 1.00 32.50 H ATOM 406 HB3 HIS A 28 -4.679 0.028 -1.375 1.00 63.31 H ATOM 407 HD1 HIS A 28 -6.915 -0.231 -0.098 1.00 50.34 H ATOM 408 HD2 HIS A 28 -7.115 -1.272 -4.115 1.00 2.11 H ATOM 409 HE1 HIS A 28 -9.367 -0.395 -0.628 1.00 35.34 H ATOM 410 N GLN A 29 -2.077 0.280 -3.106 1.00 65.02 N ATOM 411 CA GLN A 29 -0.982 1.231 -2.952 1.00 54.12 C ATOM 412 C GLN A 29 -0.191 1.363 -4.250 1.00 62.52 C ATOM 413 O GLN A 29 0.527 2.343 -4.453 1.00 52.14 O ATOM 414 CB GLN A 29 -0.054 0.795 -1.817 1.00 1.43 C ATOM 415 CG GLN A 29 0.412 -0.647 -1.933 1.00 1.02 C ATOM 416 CD GLN A 29 -0.253 -1.558 -0.919 1.00 52.02 C ATOM 417 OE1 GLN A 29 -1.479 -1.670 -0.878 1.00 53.02 O ATOM 418 NE2 GLN A 29 0.554 -2.216 -0.096 1.00 34.05 N ATOM 419 H GLN A 29 -1.887 -0.679 -3.059 1.00 1.23 H ATOM 420 HA GLN A 29 -1.409 2.192 -2.708 1.00 0.21 H ATOM 421 HB3 GLN A 29 -0.577 0.907 -0.878 1.00 54.53 H ATOM 422 HG3 GLN A 29 1.480 -0.679 -1.778 1.00 33.50 H ATOM 423 HE21 GLN A 29 1.520 -2.078 -0.185 1.00 42.55 H ATOM 424 HE22 GLN A 29 0.151 -2.811 0.569 1.00 31.35 H ATOM 425 N ILE A 30 -0.326 0.371 -5.123 1.00 64.42 N ATOM 426 CA ILE A 30 0.376 0.376 -6.400 1.00 63.14 C ATOM 427 C ILE A 30 0.103 1.663 -7.172 1.00 13.11 C ATOM 428 O ILE A 30 0.961 2.153 -7.906 1.00 42.33 O ATOM 429 CB ILE A 30 -0.027 -0.827 -7.271 1.00 32.25 C ATOM 430 CG1 ILE A 30 0.849 -2.038 -6.943 1.00 72.05 C ATOM 431 CG2 ILE A 30 0.078 -0.474 -8.747 1.00 23.51 C ATOM 432 CD1 ILE A 30 1.047 -2.258 -5.460 1.00 1.32 C ATOM 433 H ILE A 30 -0.912 -0.383 -4.903 1.00 54.10 H ATOM 434 HA ILE A 30 1.436 0.309 -6.198 1.00 43.20 H ATOM 435 HB ILE A 30 -1.058 -1.069 -7.056 1.00 64.21 H ATOM 436 HG13 ILE A 30 1.822 -1.900 -7.391 1.00 72.34 H ATOM 437 HG21 ILE A 30 1.005 0.051 -8.925 1.00 1.10 H ATOM 438 HG22 ILE A 30 0.059 -1.378 -9.335 1.00 34.41 H ATOM 439 HG23 ILE A 30 -0.752 0.157 -9.026 1.00 72.42 H ATOM 440 HD11 ILE A 30 0.126 -2.042 -4.938 1.00 13.40 H ATOM 441 HD12 ILE A 30 1.327 -3.285 -5.282 1.00 35.45 H ATOM 442 HD13 ILE A 30 1.826 -1.603 -5.099 1.00 13.13 H ATOM 443 N TYR A 31 -1.098 2.205 -7.000 1.00 70.31 N ATOM 444 CA TYR A 31 -1.486 3.434 -7.682 1.00 0.22 C ATOM 445 C TYR A 31 -1.510 4.610 -6.711 1.00 2.22 C ATOM 446 O TYR A 31 -2.091 5.656 -7.001 1.00 32.13 O ATOM 447 CB TYR A 31 -2.860 3.269 -8.334 1.00 30.43 C ATOM 448 CG TYR A 31 -3.929 2.786 -7.380 1.00 71.32 C ATOM 449 CD1 TYR A 31 -4.567 3.669 -6.517 1.00 20.20 C ATOM 450 CD2 TYR A 31 -4.302 1.448 -7.340 1.00 63.32 C ATOM 451 CE1 TYR A 31 -5.544 3.234 -5.643 1.00 32.33 C ATOM 452 CE2 TYR A 31 -5.279 1.004 -6.471 1.00 25.40 C ATOM 453 CZ TYR A 31 -5.897 1.901 -5.624 1.00 32.42 C ATOM 454 OH TYR A 31 -6.869 1.461 -4.756 1.00 4.42 O ATOM 455 H TYR A 31 -1.739 1.767 -6.403 1.00 72.21 H ATOM 456 HA TYR A 31 -0.754 3.631 -8.451 1.00 1.40 H ATOM 457 HB3 TYR A 31 -2.785 2.551 -9.138 1.00 64.34 H ATOM 458 HD1 TYR A 31 -4.289 4.713 -6.534 1.00 64.14 H ATOM 459 HD2 TYR A 31 -3.815 0.749 -8.005 1.00 72.42 H ATOM 460 HE1 TYR A 31 -6.029 3.935 -4.980 1.00 61.13 H ATOM 461 HE2 TYR A 31 -5.554 -0.040 -6.455 1.00 75.20 H ATOM 462 HH TYR A 31 -7.429 2.199 -4.502 1.00 71.32 H ATOM 463 N GLN A 32 -0.875 4.431 -5.558 1.00 31.23 N ATOM 464 CA GLN A 32 -0.823 5.477 -4.543 1.00 15.10 C ATOM 465 C GLN A 32 0.497 6.237 -4.613 1.00 3.52 C ATOM 466 O GLN A 32 0.556 7.428 -4.304 1.00 10.01 O ATOM 467 CB GLN A 32 -1.006 4.874 -3.149 1.00 23.33 C ATOM 468 CG GLN A 32 -2.460 4.655 -2.766 1.00 10.31 C ATOM 469 CD GLN A 32 -2.613 3.963 -1.426 1.00 2.11 C ATOM 470 OE1 GLN A 32 -1.636 3.756 -0.706 1.00 10.13 O ATOM 471 NE2 GLN A 32 -3.844 3.601 -1.083 1.00 43.12 N ATOM 472 H GLN A 32 -0.431 3.575 -5.384 1.00 14.00 H ATOM 473 HA GLN A 32 -1.632 6.165 -4.735 1.00 64.34 H ATOM 474 HB3 GLN A 32 -0.560 5.537 -2.422 1.00 2.43 H ATOM 475 HG3 GLN A 32 -2.931 4.046 -3.524 1.00 45.34 H ATOM 476 HE21 GLN A 32 -4.574 3.797 -1.707 1.00 52.31 H ATOM 477 HE22 GLN A 32 -3.972 3.152 -0.222 1.00 73.23 H ATOM 478 N PHE A 33 1.554 5.542 -5.019 1.00 3.24 N ATOM 479 CA PHE A 33 2.874 6.152 -5.127 1.00 71.50 C ATOM 480 C PHE A 33 3.124 6.658 -6.544 1.00 50.24 C ATOM 481 O PHE A 33 4.012 7.480 -6.776 1.00 24.30 O ATOM 482 CB PHE A 33 3.958 5.145 -4.735 1.00 42.52 C ATOM 483 CG PHE A 33 4.187 4.078 -5.767 1.00 64.21 C ATOM 484 CD1 PHE A 33 5.019 4.311 -6.849 1.00 54.14 C ATOM 485 CD2 PHE A 33 3.571 2.843 -5.653 1.00 12.33 C ATOM 486 CE1 PHE A 33 5.233 3.331 -7.801 1.00 42.31 C ATOM 487 CE2 PHE A 33 3.780 1.860 -6.601 1.00 31.13 C ATOM 488 CZ PHE A 33 4.611 2.104 -7.676 1.00 60.03 C ATOM 489 H PHE A 33 1.444 4.596 -5.250 1.00 55.02 H ATOM 490 HA PHE A 33 2.909 6.989 -4.447 1.00 53.34 H ATOM 491 HB3 PHE A 33 3.672 4.663 -3.813 1.00 30.52 H ATOM 492 HD1 PHE A 33 5.506 5.271 -6.948 1.00 1.32 H ATOM 493 HD2 PHE A 33 2.919 2.651 -4.814 1.00 4.04 H ATOM 494 HE1 PHE A 33 5.883 3.526 -8.640 1.00 71.44 H ATOM 495 HE2 PHE A 33 3.294 0.901 -6.502 1.00 13.41 H ATOM 496 HZ PHE A 33 4.777 1.337 -8.418 1.00 62.44 H ATOM 497 N THR A 34 2.335 6.163 -7.492 1.00 73.52 N ATOM 498 CA THR A 34 2.470 6.562 -8.887 1.00 63.32 C ATOM 499 C THR A 34 1.121 6.946 -9.483 1.00 51.30 C ATOM 500 O THR A 34 1.010 7.936 -10.207 1.00 62.41 O ATOM 501 CB THR A 34 3.091 5.437 -9.736 1.00 21.40 C ATOM 502 OG1 THR A 34 3.030 5.780 -11.125 1.00 61.22 O ATOM 503 CG2 THR A 34 2.369 4.119 -9.502 1.00 12.33 C ATOM 504 H THR A 34 1.645 5.511 -7.245 1.00 41.13 H ATOM 505 HA THR A 34 3.127 7.419 -8.926 1.00 72.32 H ATOM 506 HB THR A 34 4.126 5.318 -9.448 1.00 42.13 H ATOM 507 HG1 THR A 34 3.540 6.579 -11.280 1.00 63.13 H ATOM 508 HG21 THR A 34 1.361 4.189 -9.886 1.00 25.22 H ATOM 509 HG22 THR A 34 2.336 3.910 -8.442 1.00 52.43 H ATOM 510 HG23 THR A 34 2.894 3.325 -10.011 1.00 3.13 H ATOM 511 N ASP A 35 0.097 6.158 -9.173 1.00 70.32 N ATOM 512 CA ASP A 35 -1.247 6.417 -9.677 1.00 2.30 C ATOM 513 C ASP A 35 -1.277 6.356 -11.201 1.00 62.33 C ATOM 514 O ASP A 35 -1.526 7.360 -11.869 1.00 23.21 O ATOM 515 CB ASP A 35 -1.739 7.785 -9.200 1.00 30.53 C ATOM 516 CG ASP A 35 -3.196 8.026 -9.537 1.00 34.00 C ATOM 517 OD1 ASP A 35 -3.932 7.035 -9.735 1.00 65.23 O ATOM 518 OD2 ASP A 35 -3.604 9.205 -9.605 1.00 63.34 O ATOM 519 H ASP A 35 0.249 5.384 -8.592 1.00 33.43 H ATOM 520 HA ASP A 35 -1.901 5.653 -9.285 1.00 71.03 H ATOM 521 HB3 ASP A 35 -1.147 8.557 -9.668 1.00 24.31 H ATOM 522 N LYS A 36 -1.021 5.171 -11.745 1.00 51.43 N ATOM 523 CA LYS A 36 -1.020 4.978 -13.190 1.00 72.42 C ATOM 524 C LYS A 36 -2.373 5.341 -13.790 1.00 40.41 C ATOM 525 O LYS A 36 -3.371 5.449 -13.077 1.00 21.13 O ATOM 526 CB LYS A 36 -0.673 3.526 -13.531 1.00 11.00 C ATOM 527 CG LYS A 36 0.628 3.050 -12.908 1.00 62.53 C ATOM 528 CD LYS A 36 1.824 3.792 -13.481 1.00 61.21 C ATOM 529 CE LYS A 36 3.057 2.902 -13.539 1.00 4.22 C ATOM 530 NZ LYS A 36 3.867 2.996 -12.293 1.00 74.53 N1+ ATOM 531 H LYS A 36 -0.830 4.407 -11.161 1.00 2.41 H ATOM 532 HA LYS A 36 -0.267 5.626 -13.611 1.00 43.35 H ATOM 533 HB3 LYS A 36 -0.590 3.430 -14.604 1.00 43.32 H ATOM 534 HG3 LYS A 36 0.744 1.993 -13.105 1.00 23.43 H ATOM 535 HD3 LYS A 36 2.038 4.648 -12.856 1.00 22.23 H ATOM 536 HE3 LYS A 36 3.665 3.207 -14.377 1.00 72.43 H ATOM 537 HZ1 LYS A 36 4.878 2.888 -12.516 1.00 11.35 H ATOM 538 HZ2 LYS A 36 3.589 2.246 -11.629 1.00 32.11 H ATOM 539 HZ3 LYS A 36 3.720 3.919 -11.838 1.00 71.21 H ATOM 540 N ASP A 37 -2.402 5.528 -15.105 1.00 40.34 N ATOM 541 CA ASP A 37 -3.636 5.878 -15.802 1.00 63.31 C ATOM 542 C ASP A 37 -4.713 4.827 -15.559 1.00 35.55 C ATOM 543 O ASP A 37 -4.500 3.861 -14.825 1.00 74.45 O ATOM 544 CB ASP A 37 -3.375 6.023 -17.302 1.00 14.14 C ATOM 545 CG ASP A 37 -2.442 4.954 -17.834 1.00 35.43 C ATOM 546 OD1 ASP A 37 -2.797 3.759 -17.746 1.00 50.30 O ATOM 547 OD2 ASP A 37 -1.356 5.310 -18.338 1.00 24.01 O ATOM 548 H ASP A 37 -1.574 5.428 -15.621 1.00 2.05 H ATOM 549 HA ASP A 37 -3.978 6.824 -15.412 1.00 14.51 H ATOM 550 HB3 ASP A 37 -2.932 6.989 -17.492 1.00 50.12 H ATOM 551 N LYS A 38 -5.872 5.020 -16.179 1.00 21.04 N ATOM 552 CA LYS A 38 -6.985 4.089 -16.031 1.00 22.04 C ATOM 553 C LYS A 38 -7.509 3.648 -17.393 1.00 74.11 C ATOM 554 O LYS A 38 -6.940 3.992 -18.429 1.00 71.20 O ATOM 555 CB LYS A 38 -8.113 4.735 -15.223 1.00 23.41 C ATOM 556 CG LYS A 38 -8.897 5.779 -16.000 1.00 30.45 C ATOM 557 CD LYS A 38 -10.007 6.384 -15.156 1.00 71.42 C ATOM 558 CE LYS A 38 -9.934 7.903 -15.146 1.00 61.51 C ATOM 559 NZ LYS A 38 -10.760 8.491 -14.056 1.00 13.33 N1+ ATOM 560 H LYS A 38 -5.982 5.809 -16.751 1.00 22.03 H ATOM 561 HA LYS A 38 -6.623 3.222 -15.500 1.00 2.45 H ATOM 562 HB3 LYS A 38 -7.688 5.210 -14.350 1.00 10.44 H ATOM 563 HG3 LYS A 38 -9.333 5.312 -16.871 1.00 43.35 H ATOM 564 HD3 LYS A 38 -9.914 6.021 -14.142 1.00 32.14 H ATOM 565 HE3 LYS A 38 -10.289 8.273 -16.096 1.00 54.41 H ATOM 566 HZ1 LYS A 38 -10.822 7.827 -13.258 1.00 1.22 H ATOM 567 HZ2 LYS A 38 -11.720 8.689 -14.403 1.00 12.14 H ATOM 568 HZ3 LYS A 38 -10.334 9.379 -13.723 1.00 43.21 H ATOM 569 N ASP A 39 -8.598 2.887 -17.385 1.00 21.30 N ATOM 570 CA ASP A 39 -9.201 2.400 -18.621 1.00 23.43 C ATOM 571 C ASP A 39 -10.688 2.124 -18.427 1.00 72.52 C ATOM 572 O ASP A 39 -11.133 0.980 -18.514 1.00 61.23 O ATOM 573 CB ASP A 39 -8.491 1.131 -19.095 1.00 45.12 C ATOM 574 CG ASP A 39 -7.332 1.430 -20.025 1.00 52.23 C ATOM 575 OD1 ASP A 39 -7.503 2.268 -20.935 1.00 65.22 O ATOM 576 OD2 ASP A 39 -6.254 0.825 -19.846 1.00 0.02 O ATOM 577 H ASP A 39 -9.006 2.646 -16.526 1.00 42.25 H ATOM 578 HA ASP A 39 -9.085 3.168 -19.371 1.00 3.22 H ATOM 579 HB3 ASP A 39 -9.198 0.505 -19.619 1.00 22.13 H ATOM 580 N ASN A 40 -11.451 3.179 -18.163 1.00 12.24 N ATOM 581 CA ASN A 40 -12.889 3.049 -17.955 1.00 74.00 C ATOM 582 C ASN A 40 -13.188 2.093 -16.803 1.00 52.55 C ATOM 583 O ASN A 40 -14.166 1.347 -16.840 1.00 55.04 O ATOM 584 CB ASN A 40 -13.567 2.553 -19.233 1.00 14.42 C ATOM 585 CG ASN A 40 -12.983 3.185 -20.481 1.00 45.04 C ATOM 586 OD1 ASN A 40 -13.124 4.388 -20.706 1.00 11.14 O ATOM 587 ND2 ASN A 40 -12.322 2.376 -21.301 1.00 21.04 N ATOM 588 H ASN A 40 -11.039 4.065 -18.105 1.00 62.03 H ATOM 589 HA ASN A 40 -13.278 4.026 -17.707 1.00 74.43 H ATOM 590 HB3 ASN A 40 -14.620 2.789 -19.191 1.00 30.31 H ATOM 591 HD21 ASN A 40 -12.249 1.430 -21.058 1.00 34.34 H ATOM 592 HD22 ASN A 40 -11.933 2.758 -22.114 1.00 44.44 H ATOM 593 N VAL A 41 -12.341 2.124 -15.781 1.00 63.23 N ATOM 594 CA VAL A 41 -12.515 1.263 -14.617 1.00 25.20 C ATOM 595 C VAL A 41 -12.195 2.011 -13.327 1.00 61.33 C ATOM 596 O VAL A 41 -11.303 2.858 -13.294 1.00 62.12 O ATOM 597 CB VAL A 41 -11.621 0.011 -14.707 1.00 4.25 C ATOM 598 CG1 VAL A 41 -10.164 0.407 -14.892 1.00 12.04 C ATOM 599 CG2 VAL A 41 -11.794 -0.855 -13.469 1.00 30.15 C ATOM 600 H VAL A 41 -11.579 2.741 -15.809 1.00 3.42 H ATOM 601 HA VAL A 41 -13.546 0.943 -14.590 1.00 4.10 H ATOM 602 HB VAL A 41 -11.928 -0.563 -15.568 1.00 61.11 H ATOM 603 HG11 VAL A 41 -9.590 -0.462 -15.179 1.00 72.05 H ATOM 604 HG12 VAL A 41 -10.090 1.160 -15.663 1.00 42.43 H ATOM 605 HG13 VAL A 41 -9.778 0.802 -13.964 1.00 72.01 H ATOM 606 HG21 VAL A 41 -12.824 -1.168 -13.388 1.00 42.13 H ATOM 607 HG22 VAL A 41 -11.158 -1.724 -13.547 1.00 74.31 H ATOM 608 HG23 VAL A 41 -11.520 -0.288 -12.591 1.00 32.51 H ATOM 609 N ALA A 42 -12.928 1.690 -12.266 1.00 42.25 N ATOM 610 CA ALA A 42 -12.721 2.330 -10.973 1.00 72.34 C ATOM 611 C ALA A 42 -13.059 1.379 -9.830 1.00 54.41 C ATOM 612 O ALA A 42 -13.779 0.395 -10.002 1.00 15.11 O ATOM 613 CB ALA A 42 -13.555 3.599 -10.872 1.00 20.31 C ATOM 614 H ALA A 42 -13.624 1.007 -12.356 1.00 32.15 H ATOM 615 HA ALA A 42 -11.678 2.607 -10.901 1.00 33.14 H ATOM 616 HB1 ALA A 42 -13.965 3.837 -11.843 1.00 64.33 H ATOM 617 HB2 ALA A 42 -14.360 3.445 -10.169 1.00 11.02 H ATOM 618 HB3 ALA A 42 -12.931 4.413 -10.534 1.00 21.45 H ATOM 619 N PRO A 43 -12.530 1.677 -8.634 1.00 12.50 N ATOM 620 CA PRO A 43 -12.764 0.861 -7.439 1.00 73.34 C ATOM 621 C PRO A 43 -14.200 0.963 -6.939 1.00 0.02 C ATOM 622 O PRO A 43 -14.708 0.048 -6.290 1.00 13.22 O ATOM 623 CB PRO A 43 -11.795 1.452 -6.411 1.00 14.51 C ATOM 624 CG PRO A 43 -11.585 2.859 -6.855 1.00 34.34 C ATOM 625 CD PRO A 43 -11.665 2.836 -8.356 1.00 33.20 C ATOM 626 HA PRO A 43 -12.517 -0.176 -7.614 1.00 32.04 H ATOM 627 HB3 PRO A 43 -10.873 0.893 -6.418 1.00 72.53 H ATOM 628 HG3 PRO A 43 -10.611 3.200 -6.537 1.00 1.22 H ATOM 629 HD3 PRO A 43 -10.684 2.693 -8.784 1.00 63.14 H ATOM 630 N ARG A 44 -14.851 2.081 -7.245 1.00 54.00 N ATOM 631 CA ARG A 44 -16.230 2.302 -6.825 1.00 62.02 C ATOM 632 C ARG A 44 -17.205 1.634 -7.789 1.00 32.03 C ATOM 633 O ARG A 44 -18.301 1.231 -7.399 1.00 3.23 O ATOM 634 CB ARG A 44 -16.525 3.801 -6.740 1.00 74.30 C ATOM 635 CG ARG A 44 -17.579 4.156 -5.705 1.00 24.03 C ATOM 636 CD ARG A 44 -18.967 4.225 -6.323 1.00 73.04 C ATOM 637 NE ARG A 44 -19.050 5.240 -7.369 1.00 41.42 N ATOM 638 CZ ARG A 44 -20.166 5.522 -8.033 1.00 72.34 C ATOM 639 NH1 ARG A 44 -21.286 4.868 -7.760 1.00 73.42 N ATOM 640 NH2 ARG A 44 -20.162 6.459 -8.972 1.00 22.10 N ATOM 641 H ARG A 44 -14.393 2.774 -7.765 1.00 22.41 H ATOM 642 HA ARG A 44 -16.352 1.864 -5.845 1.00 73.31 H ATOM 643 HB3 ARG A 44 -16.869 4.142 -7.705 1.00 31.34 H ATOM 644 HG3 ARG A 44 -17.338 5.116 -5.274 1.00 41.21 H ATOM 645 HD3 ARG A 44 -19.680 4.461 -5.548 1.00 35.32 H ATOM 646 HE ARG A 44 -18.234 5.735 -7.587 1.00 62.13 H ATOM 647 HH11 ARG A 44 -21.292 4.161 -7.053 1.00 11.35 H ATOM 648 HH12 ARG A 44 -22.125 5.082 -8.261 1.00 42.43 H ATOM 649 HH21 ARG A 44 -19.319 6.955 -9.180 1.00 33.52 H ATOM 650 HH22 ARG A 44 -21.002 6.671 -9.471 1.00 73.53 H ATOM 651 N SER A 45 -16.800 1.520 -9.049 1.00 71.43 N ATOM 652 CA SER A 45 -17.640 0.904 -10.070 1.00 44.45 C ATOM 653 C SER A 45 -18.128 -0.468 -9.618 1.00 45.13 C ATOM 654 O SER A 45 -17.547 -1.083 -8.723 1.00 4.01 O ATOM 655 CB SER A 45 -16.869 0.777 -11.386 1.00 1.12 C ATOM 656 OG SER A 45 -17.743 0.852 -12.498 1.00 13.21 O ATOM 657 H SER A 45 -15.915 1.860 -9.299 1.00 42.45 H ATOM 658 HA SER A 45 -18.496 1.545 -10.225 1.00 64.25 H ATOM 659 HB3 SER A 45 -16.358 -0.175 -11.409 1.00 25.04 H ATOM 660 HG SER A 45 -17.244 0.719 -13.308 1.00 22.55 H ATOM 661 N LYS A 46 -19.199 -0.943 -10.243 1.00 15.14 N ATOM 662 CA LYS A 46 -19.767 -2.243 -9.907 1.00 74.00 C ATOM 663 C LYS A 46 -19.656 -3.206 -11.085 1.00 55.22 C ATOM 664 O LYS A 46 -19.140 -2.848 -12.145 1.00 1.24 O ATOM 665 CB LYS A 46 -21.233 -2.092 -9.495 1.00 13.30 C ATOM 666 CG LYS A 46 -21.980 -1.030 -10.285 1.00 35.34 C ATOM 667 CD LYS A 46 -21.878 0.333 -9.622 1.00 72.53 C ATOM 668 CE LYS A 46 -21.908 1.454 -10.649 1.00 50.04 C ATOM 669 NZ LYS A 46 -23.294 1.937 -10.903 1.00 71.54 N1+ ATOM 670 H LYS A 46 -19.619 -0.407 -10.948 1.00 3.22 H ATOM 671 HA LYS A 46 -19.208 -2.646 -9.076 1.00 45.40 H ATOM 672 HB3 LYS A 46 -21.275 -1.827 -8.448 1.00 3.34 H ATOM 673 HG3 LYS A 46 -23.022 -1.312 -10.351 1.00 0.13 H ATOM 674 HD3 LYS A 46 -20.950 0.386 -9.071 1.00 3.25 H ATOM 675 HE3 LYS A 46 -21.488 1.089 -11.575 1.00 22.31 H ATOM 676 HZ1 LYS A 46 -23.599 1.659 -11.858 1.00 64.20 H ATOM 677 HZ2 LYS A 46 -23.330 2.974 -10.829 1.00 21.33 H ATOM 678 HZ3 LYS A 46 -23.948 1.527 -10.208 1.00 31.35 H ATOM 679 N ILE A 47 -20.145 -4.426 -10.894 1.00 75.42 N ATOM 680 CA ILE A 47 -20.103 -5.439 -11.942 1.00 53.44 C ATOM 681 C ILE A 47 -21.468 -6.091 -12.132 1.00 20.02 C ATOM 682 O ILE A 47 -22.335 -6.006 -11.262 1.00 2.44 O ATOM 683 CB ILE A 47 -19.063 -6.531 -11.628 1.00 34.00 C ATOM 684 CG1 ILE A 47 -17.837 -5.918 -10.948 1.00 73.24 C ATOM 685 CG2 ILE A 47 -18.661 -7.260 -12.902 1.00 1.23 C ATOM 686 CD1 ILE A 47 -16.793 -6.939 -10.552 1.00 54.04 C ATOM 687 H ILE A 47 -20.545 -4.651 -10.028 1.00 35.50 H ATOM 688 HA ILE A 47 -19.818 -4.953 -12.863 1.00 43.34 H ATOM 689 HB ILE A 47 -19.517 -7.247 -10.959 1.00 55.14 H ATOM 690 HG13 ILE A 47 -18.152 -5.400 -10.054 1.00 14.32 H ATOM 691 HG21 ILE A 47 -17.586 -7.359 -12.935 1.00 65.12 H ATOM 692 HG22 ILE A 47 -19.112 -8.242 -12.911 1.00 45.42 H ATOM 693 HG23 ILE A 47 -18.999 -6.700 -13.760 1.00 43.33 H ATOM 694 HD11 ILE A 47 -16.607 -6.869 -9.490 1.00 54.10 H ATOM 695 HD12 ILE A 47 -17.150 -7.930 -10.790 1.00 32.24 H ATOM 696 HD13 ILE A 47 -15.878 -6.746 -11.091 1.00 24.50 H ATOM 697 N SER A 48 -21.652 -6.746 -13.274 1.00 63.23 N ATOM 698 CA SER A 48 -22.913 -7.412 -13.579 1.00 62.44 C ATOM 699 C SER A 48 -22.678 -8.870 -13.959 1.00 74.35 C ATOM 700 O SER A 48 -22.735 -9.252 -15.129 1.00 42.51 O ATOM 701 CB SER A 48 -23.634 -6.686 -14.716 1.00 15.11 C ATOM 702 OG SER A 48 -24.645 -7.504 -15.282 1.00 3.50 O ATOM 703 H SER A 48 -20.922 -6.779 -13.928 1.00 54.42 H ATOM 704 HA SER A 48 -23.529 -7.378 -12.693 1.00 41.04 H ATOM 705 HB3 SER A 48 -22.922 -6.432 -15.487 1.00 42.22 H ATOM 706 HG SER A 48 -25.193 -6.976 -15.868 1.00 31.02 H ATOM 707 N PRO A 49 -22.407 -9.709 -12.948 1.00 2.22 N ATOM 708 CA PRO A 49 -22.158 -11.139 -13.148 1.00 74.34 C ATOM 709 C PRO A 49 -23.417 -11.892 -13.565 1.00 72.52 C ATOM 710 O PRO A 49 -23.359 -13.076 -13.902 1.00 41.52 O ATOM 711 CB PRO A 49 -21.681 -11.614 -11.774 1.00 2.52 C ATOM 712 CG PRO A 49 -22.277 -10.644 -10.812 1.00 22.25 C ATOM 713 CD PRO A 49 -22.322 -9.324 -11.529 1.00 14.44 C ATOM 714 HA PRO A 49 -21.381 -11.308 -13.879 1.00 61.05 H ATOM 715 HB3 PRO A 49 -20.603 -11.594 -11.737 1.00 62.23 H ATOM 716 HG3 PRO A 49 -21.654 -10.572 -9.932 1.00 62.54 H ATOM 717 HD3 PRO A 49 -21.423 -8.759 -11.335 1.00 51.44 H ATOM 718 N GLN A 50 -24.551 -11.201 -13.540 1.00 55.34 N ATOM 719 CA GLN A 50 -25.824 -11.807 -13.915 1.00 62.42 C ATOM 720 C GLN A 50 -26.405 -11.129 -15.152 1.00 1.21 C ATOM 721 O GLN A 50 -27.527 -11.422 -15.562 1.00 14.12 O ATOM 722 CB GLN A 50 -26.816 -11.718 -12.755 1.00 53.25 C ATOM 723 CG GLN A 50 -27.526 -10.377 -12.663 1.00 53.51 C ATOM 724 CD GLN A 50 -26.567 -9.222 -12.451 1.00 71.54 C ATOM 725 OE1 GLN A 50 -26.556 -8.259 -13.220 1.00 33.41 O ATOM 726 NE2 GLN A 50 -25.754 -9.311 -11.405 1.00 73.01 N ATOM 727 H GLN A 50 -24.532 -10.262 -13.262 1.00 11.30 H ATOM 728 HA GLN A 50 -25.641 -12.846 -14.142 1.00 24.11 H ATOM 729 HB3 GLN A 50 -26.286 -11.884 -11.829 1.00 42.12 H ATOM 730 HG3 GLN A 50 -28.219 -10.407 -11.836 1.00 1.42 H ATOM 731 HE21 GLN A 50 -25.818 -10.109 -10.837 1.00 44.14 H ATOM 732 HE22 GLN A 50 -25.123 -8.580 -11.246 1.00 21.04 H ATOM 733 N GLY A 51 -25.633 -10.220 -15.741 1.00 14.14 N ATOM 734 CA GLY A 51 -26.090 -9.515 -16.924 1.00 55.51 C ATOM 735 C GLY A 51 -26.086 -10.393 -18.161 1.00 25.14 C ATOM 736 O GLY A 51 -26.545 -9.979 -19.225 1.00 63.11 O ATOM 737 H GLY A 51 -24.747 -10.027 -15.369 1.00 0.44 H ATOM 738 HA2 GLY A 51 -27.094 -9.158 -16.753 1.00 1.25 H ATOM 739 HA3 GLY A 51 -25.443 -8.668 -17.096 1.00 72.22 H ATOM 740 N TYR A 52 -25.565 -11.606 -18.020 1.00 61.54 N ATOM 741 CA TYR A 52 -25.498 -12.544 -19.135 1.00 43.53 C ATOM 742 C TYR A 52 -25.847 -13.957 -18.680 1.00 75.30 C ATOM 743 O TYR A 52 -26.099 -14.165 -17.494 1.00 53.32 O ATOM 744 CB TYR A 52 -24.103 -12.526 -19.760 1.00 54.13 C ATOM 745 CG TYR A 52 -22.989 -12.348 -18.753 1.00 1.54 C ATOM 746 CD1 TYR A 52 -22.996 -13.043 -17.551 1.00 30.54 C ATOM 747 CD2 TYR A 52 -21.931 -11.484 -19.004 1.00 60.14 C ATOM 748 CE1 TYR A 52 -21.982 -12.883 -16.627 1.00 24.52 C ATOM 749 CE2 TYR A 52 -20.911 -11.318 -18.087 1.00 2.31 C ATOM 750 CZ TYR A 52 -20.942 -12.019 -16.899 1.00 72.22 C ATOM 751 OH TYR A 52 -19.928 -11.857 -15.982 1.00 34.20 O ATOM 752 H TYR A 52 -25.214 -11.879 -17.146 1.00 43.41 H ATOM 753 HA TYR A 52 -26.218 -12.228 -19.876 1.00 51.42 H ATOM 754 HB3 TYR A 52 -24.043 -11.713 -20.469 1.00 63.21 H ATOM 755 HD1 TYR A 52 -23.813 -13.720 -17.340 1.00 62.33 H ATOM 756 HD2 TYR A 52 -21.910 -10.936 -19.935 1.00 1.21 H ATOM 757 HE1 TYR A 52 -22.005 -13.432 -15.697 1.00 63.11 H ATOM 758 HE2 TYR A 52 -20.097 -10.641 -18.299 1.00 31.40 H ATOM 759 HH TYR A 52 -19.158 -11.488 -16.419 1.00 42.13 H HETATM 760 N NH2 A 53 -25.853 -14.888 -19.623 1.00 61.14 N HETATM 761 HN1 NH2 A 53 -25.637 -14.644 -20.568 1.00 30.20 H HETATM 762 HN2 NH2 A 53 -26.073 -15.836 -19.389 1.00 1.55 H TER 763 NH2 A 53