ATOM 23 N LYS A 4 -10.458 6.266 2.487 1.00 14.45 N ATOM 24 CA LYS A 4 -9.388 7.018 1.844 1.00 0.12 C ATOM 25 C LYS A 4 -8.209 6.110 1.512 1.00 4.22 C ATOM 26 O LYS A 4 -7.553 5.577 2.407 1.00 64.42 O ATOM 27 CB LYS A 4 -8.926 8.163 2.749 1.00 22.00 C ATOM 28 CG LYS A 4 -7.540 8.684 2.411 1.00 64.31 C ATOM 29 CD LYS A 4 -7.464 9.176 0.976 1.00 74.12 C ATOM 30 CE LYS A 4 -6.051 9.602 0.606 1.00 13.13 C ATOM 31 NZ LYS A 4 -5.736 10.968 1.107 1.00 45.44 N ATOM 32 H LYS A 4 -10.318 5.912 3.391 1.00 2.41 H ATOM 33 HA LYS A 4 -9.778 7.432 0.927 1.00 53.34 H ATOM 34 HB2 LYS A 4 -9.627 8.980 2.662 1.00 2.33 H ATOM 35 HB3 LYS A 4 -8.917 7.815 3.772 1.00 4.42 H ATOM 36 HG2 LYS A 4 -7.302 9.503 3.073 1.00 21.53 H ATOM 37 HG3 LYS A 4 -6.823 7.888 2.547 1.00 22.35 H ATOM 38 HD2 LYS A 4 -7.772 8.379 0.315 1.00 53.53 H ATOM 39 HD3 LYS A 4 -8.128 10.020 0.858 1.00 54.15 H ATOM 40 HE2 LYS A 4 -5.354 8.900 1.037 1.00 64.24 H ATOM 41 HE3 LYS A 4 -5.956 9.590 -0.470 1.00 5.12 H ATOM 42 HZ1 LYS A 4 -4.755 11.005 1.452 1.00 31.13 H ATOM 43 HZ2 LYS A 4 -6.377 11.220 1.887 1.00 64.42 H ATOM 44 HZ3 LYS A 4 -5.849 11.663 0.343 1.00 51.45 H ATOM 45 N ARG A 5 -7.943 5.941 0.221 1.00 42.23 N ATOM 46 CA ARG A 5 -6.841 5.099 -0.228 1.00 30.21 C ATOM 47 C ARG A 5 -5.857 5.897 -1.078 1.00 24.21 C ATOM 48 O ARG A 5 -6.219 6.907 -1.681 1.00 44.24 O ATOM 49 CB ARG A 5 -7.375 3.909 -1.028 1.00 40.23 C ATOM 50 CG ARG A 5 -8.271 4.309 -2.189 1.00 64.14 C ATOM 51 CD ARG A 5 -8.327 3.220 -3.250 1.00 14.31 C ATOM 52 NE ARG A 5 -9.161 2.096 -2.836 1.00 35.43 N ATOM 53 CZ ARG A 5 -10.489 2.108 -2.880 1.00 64.13 C ATOM 54 NH1 ARG A 5 -11.131 3.182 -3.319 1.00 44.32 N ATOM 55 NH2 ARG A 5 -11.177 1.045 -2.486 1.00 33.25 N ATOM 56 H ARG A 5 -8.501 6.394 -0.445 1.00 63.22 H ATOM 57 HA ARG A 5 -6.327 4.730 0.647 1.00 11.00 H ATOM 58 HB2 ARG A 5 -6.539 3.351 -1.424 1.00 3.41 H ATOM 59 HB3 ARG A 5 -7.942 3.271 -0.368 1.00 23.21 H ATOM 60 HG2 ARG A 5 -9.270 4.486 -1.817 1.00 62.13 H ATOM 61 HG3 ARG A 5 -7.885 5.214 -2.635 1.00 3.50 H ATOM 62 HD2 ARG A 5 -8.734 3.641 -4.157 1.00 42.50 H ATOM 63 HD3 ARG A 5 -7.325 2.865 -3.435 1.00 41.15 H ATOM 64 HE ARG A 5 -8.708 1.291 -2.507 1.00 11.10 H ATOM 65 HH11 ARG A 5 -10.614 3.985 -3.618 1.00 23.12 H ATOM 66 HH12 ARG A 5 -12.130 3.189 -3.353 1.00 3.12 H ATOM 67 HH21 ARG A 5 -10.697 0.234 -2.154 1.00 33.34 H ATOM 68 HH22 ARG A 5 -12.177 1.056 -2.519 1.00 64.42 H ATOM 69 N LYS A 6 -4.611 5.436 -1.120 1.00 54.44 N ATOM 70 CA LYS A 6 -3.574 6.106 -1.897 1.00 3.24 C ATOM 71 C LYS A 6 -2.379 5.184 -2.117 1.00 20.22 C ATOM 72 O LYS A 6 -2.037 4.378 -1.252 1.00 72.32 O ATOM 73 CB LYS A 6 -3.122 7.384 -1.186 1.00 40.53 C ATOM 74 CG LYS A 6 -2.087 8.178 -1.963 1.00 63.24 C ATOM 75 CD LYS A 6 -2.262 9.673 -1.761 1.00 13.04 C ATOM 76 CE LYS A 6 -1.982 10.078 -0.322 1.00 14.11 C ATOM 77 NZ LYS A 6 -2.089 11.550 -0.129 1.00 2.43 N ATOM 78 H LYS A 6 -4.384 4.626 -0.618 1.00 20.41 H ATOM 79 HA LYS A 6 -3.994 6.366 -2.857 1.00 3.43 H ATOM 80 HB2 LYS A 6 -3.983 8.016 -1.025 1.00 70.35 H ATOM 81 HB3 LYS A 6 -2.697 7.118 -0.230 1.00 1.45 H ATOM 82 HG2 LYS A 6 -1.100 7.893 -1.627 1.00 13.42 H ATOM 83 HG3 LYS A 6 -2.188 7.952 -3.015 1.00 70.55 H ATOM 84 HD2 LYS A 6 -1.578 10.200 -2.410 1.00 34.42 H ATOM 85 HD3 LYS A 6 -3.279 9.944 -2.011 1.00 44.31 H ATOM 86 HE2 LYS A 6 -2.696 9.586 0.322 1.00 41.53 H ATOM 87 HE3 LYS A 6 -0.984 9.760 -0.061 1.00 23.12 H ATOM 88 HZ1 LYS A 6 -1.807 11.805 0.840 1.00 40.14 H ATOM 89 HZ2 LYS A 6 -3.068 11.862 -0.287 1.00 0.04 H ATOM 90 HZ3 LYS A 6 -1.468 12.045 -0.801 1.00 64.12 H ATOM 91 N VAL A 7 -1.747 5.310 -3.279 1.00 25.11 N ATOM 92 CA VAL A 7 -0.587 4.490 -3.611 1.00 31.10 C ATOM 93 C VAL A 7 0.709 5.275 -3.441 1.00 14.11 C ATOM 94 O VAL A 7 0.828 6.405 -3.915 1.00 2.25 O ATOM 95 CB VAL A 7 -0.669 3.962 -5.056 1.00 31.30 C ATOM 96 CG1 VAL A 7 -0.824 5.114 -6.037 1.00 72.13 C ATOM 97 CG2 VAL A 7 0.559 3.128 -5.388 1.00 52.13 C ATOM 98 H VAL A 7 -2.066 5.971 -3.927 1.00 73.15 H ATOM 99 HA VAL A 7 -0.574 3.643 -2.941 1.00 41.42 H ATOM 100 HB VAL A 7 -1.541 3.329 -5.138 1.00 3.24 H ATOM 101 HG11 VAL A 7 0.043 5.156 -6.681 1.00 13.32 H ATOM 102 HG12 VAL A 7 -1.710 4.961 -6.636 1.00 23.02 H ATOM 103 HG13 VAL A 7 -0.913 6.042 -5.492 1.00 44.02 H ATOM 104 HG21 VAL A 7 1.447 3.732 -5.271 1.00 23.50 H ATOM 105 HG22 VAL A 7 0.609 2.280 -4.722 1.00 14.50 H ATOM 106 HG23 VAL A 7 0.494 2.780 -6.409 1.00 54.11 H ATOM 107 N TYR A 8 1.676 4.669 -2.763 1.00 61.34 N ATOM 108 CA TYR A 8 2.964 5.312 -2.529 1.00 35.42 C ATOM 109 C TYR A 8 4.013 4.803 -3.513 1.00 5.23 C ATOM 110 O TYR A 8 4.801 3.914 -3.191 1.00 65.15 O ATOM 111 CB TYR A 8 3.430 5.060 -1.094 1.00 71.23 C ATOM 112 CG TYR A 8 4.223 6.204 -0.505 1.00 43.34 C ATOM 113 CD1 TYR A 8 3.671 7.474 -0.390 1.00 73.50 C ATOM 114 CD2 TYR A 8 5.528 6.016 -0.065 1.00 1.42 C ATOM 115 CE1 TYR A 8 4.392 8.521 0.145 1.00 2.52 C ATOM 116 CE2 TYR A 8 6.258 7.058 0.474 1.00 13.31 C ATOM 117 CZ TYR A 8 5.686 8.309 0.576 1.00 15.41 C ATOM 118 OH TYR A 8 6.408 9.350 1.112 1.00 1.42 O ATOM 119 H TYR A 8 1.521 3.768 -2.410 1.00 64.54 H ATOM 120 HA TYR A 8 2.836 6.374 -2.674 1.00 52.54 H ATOM 121 HB2 TYR A 8 2.567 4.899 -0.466 1.00 32.14 H ATOM 122 HB3 TYR A 8 4.053 4.178 -1.074 1.00 14.43 H ATOM 123 HD1 TYR A 8 2.657 7.637 -0.729 1.00 33.34 H ATOM 124 HD2 TYR A 8 5.973 5.035 -0.146 1.00 64.31 H ATOM 125 HE1 TYR A 8 3.945 9.502 0.227 1.00 64.33 H ATOM 126 HE2 TYR A 8 7.270 6.892 0.812 1.00 40.21 H ATOM 127 HH TYR A 8 5.880 9.796 1.779 1.00 4.11 H ATOM 128 N GLU A 9 4.018 5.375 -4.713 1.00 2.55 N ATOM 129 CA GLU A 9 4.970 4.981 -5.744 1.00 2.03 C ATOM 130 C GLU A 9 6.399 5.302 -5.315 1.00 24.32 C ATOM 131 O GLU A 9 7.360 4.786 -5.886 1.00 5.23 O ATOM 132 CB GLU A 9 4.650 5.688 -7.062 1.00 64.33 C ATOM 133 CG GLU A 9 4.866 7.191 -7.015 1.00 0.35 C ATOM 134 CD GLU A 9 4.392 7.888 -8.275 1.00 11.43 C ATOM 135 OE1 GLU A 9 3.938 7.188 -9.204 1.00 14.54 O ATOM 136 OE2 GLU A 9 4.475 9.133 -8.331 1.00 61.15 O ATOM 137 H GLU A 9 3.365 6.080 -4.909 1.00 34.41 H ATOM 138 HA GLU A 9 4.881 3.914 -5.887 1.00 11.24 H ATOM 139 HB2 GLU A 9 5.281 5.279 -7.838 1.00 51.13 H ATOM 140 HB3 GLU A 9 3.617 5.501 -7.315 1.00 5.42 H ATOM 141 HG2 GLU A 9 4.322 7.593 -6.172 1.00 71.24 H ATOM 142 HG3 GLU A 9 5.920 7.388 -6.887 1.00 32.43 H ATOM 143 N ASN A 10 6.531 6.156 -4.306 1.00 45.11 N ATOM 144 CA ASN A 10 7.842 6.547 -3.800 1.00 43.35 C ATOM 145 C ASN A 10 8.549 5.362 -3.148 1.00 44.41 C ATOM 146 O ASN A 10 9.778 5.314 -3.093 1.00 2.04 O ATOM 147 CB ASN A 10 7.704 7.691 -2.794 1.00 21.11 C ATOM 148 CG ASN A 10 7.867 9.052 -3.440 1.00 41.54 C ATOM 149 OD1 ASN A 10 7.078 9.442 -4.302 1.00 62.10 O ATOM 150 ND2 ASN A 10 8.895 9.785 -3.027 1.00 24.13 N ATOM 151 H ASN A 10 5.727 6.534 -3.890 1.00 62.03 H ATOM 152 HA ASN A 10 8.432 6.886 -4.639 1.00 42.04 H ATOM 153 HB2 ASN A 10 6.726 7.644 -2.339 1.00 50.40 H ATOM 154 HB3 ASN A 10 8.458 7.582 -2.030 1.00 11.34 H ATOM 155 HD21 ASN A 10 9.483 9.410 -2.337 1.00 51.43 H ATOM 156 HD22 ASN A 10 9.024 10.670 -3.427 1.00 32.41 H ATOM 157 N TYR A 11 7.765 4.411 -2.657 1.00 34.24 N ATOM 158 CA TYR A 11 8.315 3.227 -2.006 1.00 71.15 C ATOM 159 C TYR A 11 8.818 2.223 -3.038 1.00 20.42 C ATOM 160 O TYR A 11 8.339 2.164 -4.170 1.00 55.13 O ATOM 161 CB TYR A 11 7.259 2.572 -1.114 1.00 14.32 C ATOM 162 CG TYR A 11 7.570 2.669 0.362 1.00 35.35 C ATOM 163 CD1 TYR A 11 8.022 3.858 0.921 1.00 2.13 C ATOM 164 CD2 TYR A 11 7.411 1.571 1.200 1.00 63.34 C ATOM 165 CE1 TYR A 11 8.308 3.950 2.270 1.00 50.30 C ATOM 166 CE2 TYR A 11 7.693 1.654 2.549 1.00 42.23 C ATOM 167 CZ TYR A 11 8.142 2.846 3.080 1.00 72.24 C ATOM 168 OH TYR A 11 8.425 2.934 4.423 1.00 70.43 O ATOM 169 H TYR A 11 6.792 4.506 -2.730 1.00 62.02 H ATOM 170 HA TYR A 11 9.145 3.542 -1.392 1.00 3.34 H ATOM 171 HB2 TYR A 11 6.306 3.052 -1.283 1.00 63.41 H ATOM 172 HB3 TYR A 11 7.180 1.526 -1.369 1.00 61.43 H ATOM 173 HD1 TYR A 11 8.151 4.721 0.284 1.00 21.13 H ATOM 174 HD2 TYR A 11 7.060 0.639 0.780 1.00 24.02 H ATOM 175 HE1 TYR A 11 8.659 4.883 2.685 1.00 33.05 H ATOM 176 HE2 TYR A 11 7.563 0.790 3.183 1.00 12.01 H ATOM 177 HH TYR A 11 9.262 3.387 4.544 1.00 1.40 H ATOM 178 N PRO A 12 9.809 1.412 -2.638 1.00 41.52 N ATOM 179 CA PRO A 12 10.399 0.393 -3.512 1.00 42.25 C ATOM 180 C PRO A 12 9.439 -0.757 -3.793 1.00 23.53 C ATOM 181 O PRO A 12 8.748 -1.235 -2.894 1.00 14.11 O ATOM 182 CB PRO A 12 11.608 -0.101 -2.714 1.00 74.21 C ATOM 183 CG PRO A 12 11.261 0.174 -1.291 1.00 52.42 C ATOM 184 CD PRO A 12 10.429 1.427 -1.304 1.00 14.15 C ATOM 185 HA PRO A 12 10.733 0.819 -4.448 1.00 63.31 H ATOM 186 HB2 PRO A 12 11.750 -1.158 -2.890 1.00 2.32 H ATOM 187 HB3 PRO A 12 12.490 0.441 -3.017 1.00 3.42 H ATOM 188 HG2 PRO A 12 10.692 -0.650 -0.886 1.00 64.12 H ATOM 189 HG3 PRO A 12 12.162 0.329 -0.718 1.00 31.14 H ATOM 190 HD2 PRO A 12 9.677 1.388 -0.529 1.00 3.21 H ATOM 191 HD3 PRO A 12 11.056 2.297 -1.180 1.00 1.25 H ATOM 192 N VAL A 13 9.401 -1.199 -5.046 1.00 42.34 N ATOM 193 CA VAL A 13 8.527 -2.295 -5.445 1.00 11.50 C ATOM 194 C VAL A 13 8.978 -3.611 -4.824 1.00 64.41 C ATOM 195 O VAL A 13 8.180 -4.531 -4.644 1.00 64.42 O ATOM 196 CB VAL A 13 8.483 -2.450 -6.977 1.00 3.14 C ATOM 197 CG1 VAL A 13 7.540 -3.574 -7.374 1.00 15.04 C ATOM 198 CG2 VAL A 13 8.071 -1.140 -7.633 1.00 24.43 C ATOM 199 H VAL A 13 9.976 -0.777 -5.719 1.00 4.14 H ATOM 200 HA VAL A 13 7.529 -2.068 -5.098 1.00 73.34 H ATOM 201 HB VAL A 13 9.475 -2.704 -7.320 1.00 63.25 H ATOM 202 HG11 VAL A 13 7.985 -4.525 -7.119 1.00 14.30 H ATOM 203 HG12 VAL A 13 6.603 -3.461 -6.846 1.00 43.02 H ATOM 204 HG13 VAL A 13 7.360 -3.535 -8.438 1.00 65.21 H ATOM 205 HG21 VAL A 13 7.206 -1.306 -8.255 1.00 54.43 H ATOM 206 HG22 VAL A 13 7.833 -0.415 -6.869 1.00 22.31 H ATOM 207 HG23 VAL A 13 8.885 -0.770 -8.240 1.00 2.31 H ATOM 208 N SER A 14 10.265 -3.696 -4.499 1.00 11.05 N ATOM 209 CA SER A 14 10.824 -4.902 -3.900 1.00 1.54 C ATOM 210 C SER A 14 10.079 -5.270 -2.620 1.00 61.42 C ATOM 211 O SER A 14 9.978 -6.444 -2.262 1.00 62.34 O ATOM 212 CB SER A 14 12.312 -4.705 -3.599 1.00 54.53 C ATOM 213 OG SER A 14 13.094 -4.857 -4.770 1.00 40.22 O ATOM 214 H SER A 14 10.851 -2.928 -4.666 1.00 42.21 H ATOM 215 HA SER A 14 10.713 -5.707 -4.612 1.00 24.04 H ATOM 216 HB2 SER A 14 12.467 -3.713 -3.203 1.00 10.11 H ATOM 217 HB3 SER A 14 12.628 -5.437 -2.871 1.00 21.23 H ATOM 218 HG SER A 14 13.258 -3.995 -5.161 1.00 30.21 H ATOM 219 N LYS A 15 9.558 -4.258 -1.935 1.00 23.21 N ATOM 220 CA LYS A 15 8.821 -4.473 -0.696 1.00 3.34 C ATOM 221 C LYS A 15 7.464 -5.114 -0.973 1.00 45.33 C ATOM 222 O LYS A 15 6.900 -5.793 -0.115 1.00 72.15 O ATOM 223 CB LYS A 15 8.628 -3.147 0.044 1.00 43.10 C ATOM 224 CG LYS A 15 9.678 -2.888 1.111 1.00 73.10 C ATOM 225 CD LYS A 15 11.084 -2.970 0.543 1.00 53.42 C ATOM 226 CE LYS A 15 12.074 -2.184 1.389 1.00 22.42 C ATOM 227 NZ LYS A 15 12.462 -2.927 2.620 1.00 14.15 N ATOM 228 H LYS A 15 9.672 -3.345 -2.271 1.00 1.41 H ATOM 229 HA LYS A 15 9.400 -5.140 -0.076 1.00 3.30 H ATOM 230 HB2 LYS A 15 8.667 -2.339 -0.674 1.00 24.33 H ATOM 231 HB3 LYS A 15 7.656 -3.149 0.517 1.00 64.45 H ATOM 232 HG2 LYS A 15 9.524 -1.901 1.522 1.00 42.10 H ATOM 233 HG3 LYS A 15 9.571 -3.626 1.893 1.00 20.14 H ATOM 234 HD2 LYS A 15 11.392 -4.005 0.515 1.00 41.10 H ATOM 235 HD3 LYS A 15 11.082 -2.566 -0.460 1.00 14.22 H ATOM 236 HE2 LYS A 15 12.959 -1.994 0.802 1.00 52.14 H ATOM 237 HE3 LYS A 15 11.620 -1.247 1.673 1.00 0.10 H ATOM 238 HZ1 LYS A 15 11.636 -3.048 3.241 1.00 1.33 H ATOM 239 HZ2 LYS A 15 13.197 -2.403 3.138 1.00 73.14 H ATOM 240 HZ3 LYS A 15 12.833 -3.866 2.370 1.00 40.11 H ATOM 241 N CYS A 16 6.947 -4.894 -2.177 1.00 65.05 N ATOM 242 CA CYS A 16 5.658 -5.450 -2.570 1.00 25.45 C ATOM 243 C CYS A 16 5.615 -6.955 -2.316 1.00 63.22 C ATOM 244 O CYS A 16 4.566 -7.509 -1.991 1.00 41.25 O ATOM 245 CB CYS A 16 5.382 -5.163 -4.047 1.00 65.30 C ATOM 246 SG CYS A 16 3.786 -5.804 -4.643 1.00 74.25 S ATOM 247 H CYS A 16 7.445 -4.344 -2.819 1.00 40.31 H ATOM 248 HA CYS A 16 4.896 -4.976 -1.971 1.00 51.54 H ATOM 249 HB2 CYS A 16 5.387 -4.095 -4.204 1.00 52.42 H ATOM 250 HB3 CYS A 16 6.162 -5.612 -4.644 1.00 60.41 H ATOM 251 N GLN A 17 6.763 -7.608 -2.466 1.00 44.45 N ATOM 252 CA GLN A 17 6.856 -9.048 -2.255 1.00 5.52 C ATOM 253 C GLN A 17 6.340 -9.428 -0.871 1.00 41.02 C ATOM 254 O GLN A 17 5.887 -10.553 -0.653 1.00 75.04 O ATOM 255 CB GLN A 17 8.303 -9.515 -2.419 1.00 24.34 C ATOM 256 CG GLN A 17 8.938 -9.081 -3.729 1.00 71.54 C ATOM 257 CD GLN A 17 10.306 -9.697 -3.947 1.00 41.45 C ATOM 258 OE1 GLN A 17 11.312 -8.990 -4.026 1.00 22.12 O ATOM 259 NE2 GLN A 17 10.352 -11.020 -4.047 1.00 32.31 N ATOM 260 H GLN A 17 7.566 -7.109 -2.727 1.00 35.55 H ATOM 261 HA GLN A 17 6.244 -9.532 -2.999 1.00 52.12 H ATOM 262 HB2 GLN A 17 8.892 -9.116 -1.608 1.00 5.15 H ATOM 263 HB3 GLN A 17 8.327 -10.594 -2.372 1.00 73.52 H ATOM 264 HG2 GLN A 17 8.294 -9.379 -4.543 1.00 60.34 H ATOM 265 HG3 GLN A 17 9.039 -8.006 -3.727 1.00 24.41 H ATOM 266 HE21 GLN A 17 9.510 -11.518 -3.977 1.00 32.05 H ATOM 267 HE22 GLN A 17 11.222 -11.444 -4.188 1.00 65.42 H ATOM 268 N LEU A 18 6.412 -8.485 0.062 1.00 22.31 N ATOM 269 CA LEU A 18 5.952 -8.722 1.426 1.00 11.22 C ATOM 270 C LEU A 18 4.595 -8.066 1.664 1.00 2.44 C ATOM 271 O LEU A 18 4.400 -6.890 1.357 1.00 5.12 O ATOM 272 CB LEU A 18 6.974 -8.186 2.431 1.00 61.35 C ATOM 273 CG LEU A 18 8.382 -8.776 2.334 1.00 71.10 C ATOM 274 CD1 LEU A 18 9.381 -7.891 3.062 1.00 44.30 C ATOM 275 CD2 LEU A 18 8.408 -10.189 2.898 1.00 35.02 C ATOM 276 H LEU A 18 6.783 -7.609 -0.171 1.00 13.44 H ATOM 277 HA LEU A 18 5.851 -9.788 1.562 1.00 61.42 H ATOM 278 HB2 LEU A 18 7.052 -7.120 2.286 1.00 13.21 H ATOM 279 HB3 LEU A 18 6.597 -8.387 3.424 1.00 44.43 H ATOM 280 HG LEU A 18 8.675 -8.824 1.295 1.00 74.23 H ATOM 281 HD11 LEU A 18 8.937 -7.517 3.972 1.00 74.02 H ATOM 282 HD12 LEU A 18 9.656 -7.061 2.428 1.00 70.15 H ATOM 283 HD13 LEU A 18 10.264 -8.467 3.302 1.00 51.21 H ATOM 284 HD21 LEU A 18 8.918 -10.187 3.850 1.00 74.15 H ATOM 285 HD22 LEU A 18 8.928 -10.840 2.212 1.00 45.13 H ATOM 286 HD23 LEU A 18 7.395 -10.542 3.032 1.00 42.24 H ATOM 287 N ALA A 19 3.662 -8.832 2.218 1.00 72.52 N ATOM 288 CA ALA A 19 2.326 -8.325 2.502 1.00 15.01 C ATOM 289 C ALA A 19 2.296 -7.569 3.826 1.00 71.42 C ATOM 290 O ALA A 19 1.798 -6.446 3.899 1.00 34.41 O ATOM 291 CB ALA A 19 1.320 -9.467 2.521 1.00 40.20 C ATOM 292 H ALA A 19 3.877 -9.762 2.441 1.00 62.23 H ATOM 293 HA ALA A 19 2.050 -7.648 1.706 1.00 52.30 H ATOM 294 HB1 ALA A 19 0.925 -9.615 1.526 1.00 10.03 H ATOM 295 HB2 ALA A 19 1.809 -10.370 2.852 1.00 24.43 H ATOM 296 HB3 ALA A 19 0.513 -9.225 3.196 1.00 3.13 H ATOM 297 N ASN A 20 2.831 -8.192 4.870 1.00 63.42 N ATOM 298 CA ASN A 20 2.865 -7.579 6.192 1.00 14.45 C ATOM 299 C ASN A 20 3.614 -6.250 6.157 1.00 23.11 C ATOM 300 O ASN A 20 3.257 -5.306 6.860 1.00 72.41 O ATOM 301 CB ASN A 20 3.525 -8.523 7.199 1.00 13.22 C ATOM 302 CG ASN A 20 4.833 -9.092 6.687 1.00 50.43 C ATOM 303 OD1 ASN A 20 4.847 -10.071 5.940 1.00 13.33 O ATOM 304 ND2 ASN A 20 5.942 -8.480 7.087 1.00 64.24 N ATOM 305 H ASN A 20 3.214 -9.087 4.749 1.00 11.30 H ATOM 306 HA ASN A 20 1.846 -7.395 6.499 1.00 73.13 H ATOM 307 HB2 ASN A 20 3.724 -7.982 8.114 1.00 71.05 H ATOM 308 HB3 ASN A 20 2.854 -9.343 7.410 1.00 52.43 H ATOM 309 HD21 ASN A 20 5.855 -7.706 7.683 1.00 42.25 H ATOM 310 HD22 ASN A 20 6.802 -8.826 6.770 1.00 31.43 H ATOM 311 N GLN A 21 4.656 -6.186 5.332 1.00 33.31 N ATOM 312 CA GLN A 21 5.455 -4.974 5.205 1.00 53.21 C ATOM 313 C GLN A 21 4.607 -3.813 4.698 1.00 14.22 C ATOM 314 O GLN A 21 4.676 -2.703 5.225 1.00 10.23 O ATOM 315 CB GLN A 21 6.633 -5.212 4.260 1.00 42.54 C ATOM 316 CG GLN A 21 7.403 -3.947 3.916 1.00 52.12 C ATOM 317 CD GLN A 21 8.076 -3.327 5.124 1.00 51.32 C ATOM 318 OE1 GLN A 21 7.713 -2.233 5.559 1.00 31.52 O ATOM 319 NE2 GLN A 21 9.064 -4.024 5.675 1.00 55.35 N ATOM 320 H GLN A 21 4.890 -6.973 4.798 1.00 2.44 H ATOM 321 HA GLN A 21 5.836 -4.724 6.184 1.00 32.22 H ATOM 322 HB2 GLN A 21 7.316 -5.908 4.723 1.00 65.34 H ATOM 323 HB3 GLN A 21 6.262 -5.641 3.341 1.00 55.14 H ATOM 324 HG2 GLN A 21 8.161 -4.188 3.186 1.00 21.31 H ATOM 325 HG3 GLN A 21 6.717 -3.226 3.495 1.00 73.43 H ATOM 326 HE21 GLN A 21 9.300 -4.886 5.273 1.00 22.33 H ATOM 327 HE22 GLN A 21 9.516 -3.646 6.456 1.00 65.22 H ATOM 328 N CYS A 22 3.806 -4.076 3.670 1.00 43.11 N ATOM 329 CA CYS A 22 2.944 -3.053 3.089 1.00 23.45 C ATOM 330 C CYS A 22 2.006 -2.472 4.143 1.00 12.30 C ATOM 331 O CYS A 22 2.006 -1.267 4.391 1.00 5.14 O ATOM 332 CB CYS A 22 2.131 -3.639 1.934 1.00 43.34 C ATOM 333 SG CYS A 22 2.654 -3.057 0.288 1.00 43.52 S ATOM 334 H CYS A 22 3.795 -4.982 3.292 1.00 51.33 H ATOM 335 HA CYS A 22 3.575 -2.263 2.712 1.00 72.22 H ATOM 336 HB2 CYS A 22 2.225 -4.715 1.946 1.00 43.24 H ATOM 337 HB3 CYS A 22 1.093 -3.372 2.062 1.00 13.23 H ATOM 338 N ASN A 23 1.207 -3.337 4.758 1.00 72.11 N ATOM 339 CA ASN A 23 0.262 -2.909 5.785 1.00 63.14 C ATOM 340 C ASN A 23 0.995 -2.337 6.994 1.00 63.33 C ATOM 341 O ASN A 23 0.460 -1.497 7.717 1.00 22.20 O ATOM 342 CB ASN A 23 -0.618 -4.083 6.217 1.00 15.31 C ATOM 343 CG ASN A 23 -1.380 -3.794 7.496 1.00 4.14 C ATOM 344 OD1 ASN A 23 -0.801 -3.761 8.582 1.00 23.20 O ATOM 345 ND2 ASN A 23 -2.686 -3.582 7.372 1.00 24.34 N ATOM 346 H ASN A 23 1.252 -4.286 4.516 1.00 12.25 H ATOM 347 HA ASN A 23 -0.363 -2.139 5.359 1.00 64.11 H ATOM 348 HB2 ASN A 23 -1.334 -4.296 5.436 1.00 54.52 H ATOM 349 HB3 ASN A 23 0.002 -4.952 6.377 1.00 74.53 H ATOM 350 HD21 ASN A 23 -3.079 -3.624 6.476 1.00 64.03 H ATOM 351 HD22 ASN A 23 -3.202 -3.392 8.184 1.00 24.23 H ATOM 352 N TYR A 24 2.223 -2.796 7.206 1.00 63.54 N ATOM 353 CA TYR A 24 3.030 -2.332 8.328 1.00 51.11 C ATOM 354 C TYR A 24 3.351 -0.847 8.190 1.00 23.24 C ATOM 355 O TYR A 24 3.153 -0.068 9.124 1.00 73.44 O ATOM 356 CB TYR A 24 4.327 -3.140 8.421 1.00 55.44 C ATOM 357 CG TYR A 24 5.297 -2.609 9.451 1.00 45.42 C ATOM 358 CD1 TYR A 24 4.977 -2.607 10.802 1.00 74.31 C ATOM 359 CD2 TYR A 24 6.538 -2.110 9.072 1.00 4.42 C ATOM 360 CE1 TYR A 24 5.861 -2.122 11.746 1.00 33.35 C ATOM 361 CE2 TYR A 24 7.429 -1.625 10.009 1.00 64.01 C ATOM 362 CZ TYR A 24 7.086 -1.633 11.345 1.00 42.53 C ATOM 363 OH TYR A 24 7.970 -1.151 12.283 1.00 42.12 O ATOM 364 H TYR A 24 2.596 -3.466 6.595 1.00 12.12 H ATOM 365 HA TYR A 24 2.459 -2.483 9.232 1.00 30.42 H ATOM 366 HB2 TYR A 24 4.090 -4.158 8.683 1.00 35.43 H ATOM 367 HB3 TYR A 24 4.820 -3.125 7.460 1.00 33.40 H ATOM 368 HD1 TYR A 24 4.015 -2.992 11.113 1.00 3.41 H ATOM 369 HD2 TYR A 24 6.805 -2.105 8.024 1.00 34.34 H ATOM 370 HE1 TYR A 24 5.591 -2.129 12.792 1.00 22.23 H ATOM 371 HE2 TYR A 24 8.390 -1.241 9.696 1.00 54.31 H ATOM 372 HH TYR A 24 8.529 -1.867 12.593 1.00 34.14 H ATOM 373 N ASP A 25 3.848 -0.462 7.020 1.00 2.14 N ATOM 374 CA ASP A 25 4.196 0.930 6.758 1.00 73.22 C ATOM 375 C ASP A 25 2.942 1.771 6.541 1.00 23.33 C ATOM 376 O ASP A 25 2.905 2.950 6.896 1.00 54.15 O ATOM 377 CB ASP A 25 5.107 1.028 5.533 1.00 23.23 C ATOM 378 CG ASP A 25 5.467 2.461 5.192 1.00 33.42 C ATOM 379 OD1 ASP A 25 6.247 3.072 5.951 1.00 43.23 O ATOM 380 OD2 ASP A 25 4.966 2.970 4.168 1.00 71.25 O ATOM 381 H ASP A 25 3.984 -1.130 6.316 1.00 1.00 H ATOM 382 HA ASP A 25 4.724 1.307 7.620 1.00 1.22 H ATOM 383 HB2 ASP A 25 6.021 0.484 5.729 1.00 63.34 H ATOM 384 HB3 ASP A 25 4.607 0.588 4.684 1.00 4.42 H ATOM 385 N CYS A 26 1.917 1.158 5.958 1.00 4.34 N ATOM 386 CA CYS A 26 0.662 1.851 5.693 1.00 43.04 C ATOM 387 C CYS A 26 -0.069 2.169 6.994 1.00 41.41 C ATOM 388 O CYS A 26 -0.453 3.313 7.240 1.00 22.30 O ATOM 389 CB CYS A 26 -0.232 1.001 4.788 1.00 34.13 C ATOM 390 SG CYS A 26 0.306 0.947 3.049 1.00 2.41 S ATOM 391 H CYS A 26 2.008 0.217 5.698 1.00 13.24 H ATOM 392 HA CYS A 26 0.894 2.777 5.188 1.00 34.13 H ATOM 393 HB2 CYS A 26 -0.245 -0.014 5.159 1.00 62.12 H ATOM 394 HB3 CYS A 26 -1.236 1.399 4.810 1.00 21.14 H ATOM 395 N LYS A 27 -0.258 1.150 7.825 1.00 23.11 N ATOM 396 CA LYS A 27 -0.940 1.320 9.102 1.00 23.33 C ATOM 397 C LYS A 27 -0.128 2.207 10.040 1.00 31.14 C ATOM 398 O LYS A 27 -0.627 2.661 11.070 1.00 31.54 O ATOM 399 CB LYS A 27 -1.186 -0.042 9.758 1.00 55.42 C ATOM 400 CG LYS A 27 -2.316 -0.830 9.117 1.00 3.31 C ATOM 401 CD LYS A 27 -3.074 -1.653 10.145 1.00 64.43 C ATOM 402 CE LYS A 27 -3.778 -0.767 11.160 1.00 73.14 C ATOM 403 NZ LYS A 27 -5.221 -1.112 11.290 1.00 22.44 N ATOM 404 H LYS A 27 0.072 0.261 7.574 1.00 55.43 H ATOM 405 HA LYS A 27 -1.891 1.794 8.910 1.00 3.35 H ATOM 406 HB2 LYS A 27 -0.283 -0.629 9.690 1.00 3.03 H ATOM 407 HB3 LYS A 27 -1.428 0.113 10.799 1.00 74.22 H ATOM 408 HG2 LYS A 27 -3.002 -0.141 8.647 1.00 14.22 H ATOM 409 HG3 LYS A 27 -1.901 -1.493 8.371 1.00 33.42 H ATOM 410 HD2 LYS A 27 -3.812 -2.257 9.636 1.00 4.41 H ATOM 411 HD3 LYS A 27 -2.376 -2.296 10.663 1.00 55.55 H ATOM 412 HE2 LYS A 27 -3.299 -0.889 12.119 1.00 22.22 H ATOM 413 HE3 LYS A 27 -3.690 0.262 10.842 1.00 2.25 H ATOM 414 HZ1 LYS A 27 -5.437 -1.964 10.735 1.00 63.31 H ATOM 415 HZ2 LYS A 27 -5.809 -0.327 10.944 1.00 42.04 H ATOM 416 HZ3 LYS A 27 -5.456 -1.292 12.288 1.00 61.35 H ATOM 417 N LEU A 28 1.126 2.454 9.676 1.00 32.51 N ATOM 418 CA LEU A 28 2.007 3.289 10.484 1.00 21.23 C ATOM 419 C LEU A 28 1.705 4.768 10.267 1.00 22.31 C ATOM 420 O LEU A 28 1.311 5.474 11.196 1.00 45.24 O ATOM 421 CB LEU A 28 3.470 3.000 10.143 1.00 2.23 C ATOM 422 CG LEU A 28 4.510 3.859 10.864 1.00 71.22 C ATOM 423 CD1 LEU A 28 4.375 3.708 12.371 1.00 32.41 C ATOM 424 CD2 LEU A 28 5.915 3.488 10.412 1.00 73.51 C ATOM 425 H LEU A 28 1.468 2.065 8.844 1.00 32.03 H ATOM 426 HA LEU A 28 1.833 3.047 11.522 1.00 10.22 H ATOM 427 HB2 LEU A 28 3.669 1.968 10.386 1.00 33.32 H ATOM 428 HB3 LEU A 28 3.596 3.148 9.080 1.00 22.42 H ATOM 429 HG LEU A 28 4.342 4.898 10.617 1.00 10.31 H ATOM 430 HD11 LEU A 28 5.006 4.432 12.863 1.00 13.15 H ATOM 431 HD12 LEU A 28 4.676 2.712 12.661 1.00 53.00 H ATOM 432 HD13 LEU A 28 3.347 3.871 12.658 1.00 21.44 H ATOM 433 HD21 LEU A 28 5.978 3.564 9.337 1.00 42.21 H ATOM 434 HD22 LEU A 28 6.134 2.474 10.715 1.00 72.11 H ATOM 435 HD23 LEU A 28 6.628 4.160 10.865 1.00 3.41 H ATOM 436 N ASP A 29 1.890 5.229 9.035 1.00 3.44 N ATOM 437 CA ASP A 29 1.635 6.624 8.695 1.00 3.22 C ATOM 438 C ASP A 29 0.226 6.798 8.136 1.00 33.20 C ATOM 439 O ASP A 29 -0.541 7.640 8.605 1.00 62.12 O ATOM 440 CB ASP A 29 2.665 7.121 7.679 1.00 0.13 C ATOM 441 CG ASP A 29 3.253 8.465 8.061 1.00 23.12 C ATOM 442 OD1 ASP A 29 2.477 9.431 8.215 1.00 51.24 O ATOM 443 OD2 ASP A 29 4.490 8.550 8.207 1.00 11.35 O ATOM 444 H ASP A 29 2.206 4.618 8.338 1.00 23.10 H ATOM 445 HA ASP A 29 1.724 7.208 9.599 1.00 40.13 H ATOM 446 HB2 ASP A 29 3.469 6.403 7.611 1.00 2.10 H ATOM 447 HB3 ASP A 29 2.191 7.217 6.713 1.00 14.33 H ATOM 448 N LYS A 30 -0.109 5.997 7.130 1.00 4.21 N ATOM 449 CA LYS A 30 -1.425 6.061 6.507 1.00 70.14 C ATOM 450 C LYS A 30 -2.500 5.524 7.447 1.00 22.03 C ATOM 451 O LYS A 30 -3.694 5.662 7.184 1.00 52.54 O ATOM 452 CB LYS A 30 -1.432 5.264 5.200 1.00 62.24 C ATOM 453 CG LYS A 30 -0.235 5.546 4.309 1.00 1.52 C ATOM 454 CD LYS A 30 -0.665 6.025 2.933 1.00 64.13 C ATOM 455 CE LYS A 30 -0.652 7.543 2.840 1.00 33.24 C ATOM 456 NZ LYS A 30 -1.945 8.137 3.282 1.00 62.34 N ATOM 457 H LYS A 30 0.546 5.346 6.800 1.00 32.44 H ATOM 458 HA LYS A 30 -1.639 7.096 6.288 1.00 24.41 H ATOM 459 HB2 LYS A 30 -1.438 4.210 5.435 1.00 33.31 H ATOM 460 HB3 LYS A 30 -2.329 5.507 4.649 1.00 21.23 H ATOM 461 HG2 LYS A 30 0.373 6.311 4.770 1.00 24.41 H ATOM 462 HG3 LYS A 30 0.344 4.640 4.201 1.00 74.11 H ATOM 463 HD2 LYS A 30 0.014 5.625 2.194 1.00 73.14 H ATOM 464 HD3 LYS A 30 -1.666 5.669 2.734 1.00 1.43 H ATOM 465 HE2 LYS A 30 0.141 7.922 3.468 1.00 42.23 H ATOM 466 HE3 LYS A 30 -0.466 7.827 1.815 1.00 15.21 H ATOM 467 HZ1 LYS A 30 -2.651 7.387 3.429 1.00 2.41 H ATOM 468 HZ2 LYS A 30 -2.299 8.795 2.560 1.00 51.40 H ATOM 469 HZ3 LYS A 30 -1.814 8.655 4.173 1.00 10.23 H ATOM 470 N HIS A 31 -2.067 4.912 8.545 1.00 42.14 N ATOM 471 CA HIS A 31 -2.993 4.356 9.525 1.00 11.52 C ATOM 472 C HIS A 31 -4.061 3.508 8.844 1.00 35.31 C ATOM 473 O HIS A 31 -5.197 3.427 9.313 1.00 43.33 O ATOM 474 CB HIS A 31 -3.651 5.478 10.329 1.00 14.43 C ATOM 475 CG HIS A 31 -4.121 5.048 11.684 1.00 0.04 C ATOM 476 ND1 HIS A 31 -5.061 5.747 12.412 1.00 34.42 N ATOM 477 CD2 HIS A 31 -3.777 3.981 12.444 1.00 60.24 C ATOM 478 CE1 HIS A 31 -5.273 5.130 13.561 1.00 70.25 C ATOM 479 NE2 HIS A 31 -4.506 4.055 13.605 1.00 61.32 N ATOM 480 H HIS A 31 -1.103 4.832 8.699 1.00 60.01 H ATOM 481 HA HIS A 31 -2.427 3.729 10.197 1.00 21.43 H ATOM 482 HB2 HIS A 31 -2.940 6.280 10.464 1.00 34.01 H ATOM 483 HB3 HIS A 31 -4.506 5.849 9.783 1.00 30.11 H ATOM 484 HD1 HIS A 31 -5.506 6.573 12.129 1.00 25.31 H ATOM 485 HD2 HIS A 31 -3.060 3.214 12.185 1.00 55.22 H ATOM 486 HE1 HIS A 31 -5.957 5.449 14.333 1.00 73.50 H ATOM 487 N ALA A 32 -3.691 2.876 7.734 1.00 1.13 N ATOM 488 CA ALA A 32 -4.617 2.033 6.989 1.00 20.21 C ATOM 489 C ALA A 32 -5.096 0.861 7.838 1.00 23.44 C ATOM 490 O ALA A 32 -4.983 0.882 9.064 1.00 21.45 O ATOM 491 CB ALA A 32 -3.962 1.529 5.712 1.00 3.13 C ATOM 492 H ALA A 32 -2.772 2.980 7.410 1.00 30.41 H ATOM 493 HA ALA A 32 -5.470 2.636 6.713 1.00 1.22 H ATOM 494 HB1 ALA A 32 -4.649 1.642 4.886 1.00 4.44 H ATOM 495 HB2 ALA A 32 -3.067 2.103 5.517 1.00 72.11 H ATOM 496 HB3 ALA A 32 -3.704 0.487 5.826 1.00 11.14 H ATOM 497 N ARG A 33 -5.632 -0.162 7.179 1.00 41.30 N ATOM 498 CA ARG A 33 -6.130 -1.343 7.874 1.00 44.01 C ATOM 499 C ARG A 33 -5.690 -2.618 7.161 1.00 33.35 C ATOM 500 O ARG A 33 -5.385 -3.625 7.800 1.00 1.10 O ATOM 501 CB ARG A 33 -7.656 -1.298 7.969 1.00 63.41 C ATOM 502 CG ARG A 33 -8.349 -1.209 6.620 1.00 63.03 C ATOM 503 CD ARG A 33 -9.623 -0.383 6.701 1.00 73.23 C ATOM 504 NE ARG A 33 -10.790 -1.133 6.246 1.00 53.33 N ATOM 505 CZ ARG A 33 -11.431 -2.023 6.996 1.00 41.22 C ATOM 506 NH1 ARG A 33 -11.019 -2.272 8.231 1.00 24.43 N ATOM 507 NH2 ARG A 33 -12.487 -2.664 6.510 1.00 23.15 N ATOM 508 H ARG A 33 -5.695 -0.121 6.202 1.00 44.34 H ATOM 509 HA ARG A 33 -5.716 -1.341 8.871 1.00 41.21 H ATOM 510 HB2 ARG A 33 -8.000 -2.193 8.467 1.00 63.40 H ATOM 511 HB3 ARG A 33 -7.943 -0.438 8.554 1.00 21.13 H ATOM 512 HG2 ARG A 33 -7.677 -0.746 5.911 1.00 32.22 H ATOM 513 HG3 ARG A 33 -8.596 -2.205 6.285 1.00 23.54 H ATOM 514 HD2 ARG A 33 -9.777 -0.083 7.726 1.00 31.23 H ATOM 515 HD3 ARG A 33 -9.506 0.495 6.083 1.00 72.42 H ATOM 516 HE ARG A 33 -11.112 -0.964 5.336 1.00 52.21 H ATOM 517 HH11 ARG A 33 -10.225 -1.789 8.599 1.00 71.21 H ATOM 518 HH12 ARG A 33 -11.504 -2.942 8.794 1.00 63.11 H ATOM 519 HH21 ARG A 33 -12.800 -2.479 5.580 1.00 12.34 H ATOM 520 HH22 ARG A 33 -12.967 -3.334 7.076 1.00 52.41 H ATOM 521 N SER A 34 -5.663 -2.568 5.833 1.00 61.53 N ATOM 522 CA SER A 34 -5.266 -3.722 5.033 1.00 1.23 C ATOM 523 C SER A 34 -4.275 -3.313 3.946 1.00 15.15 C ATOM 524 O SER A 34 -4.363 -3.771 2.808 1.00 60.14 O ATOM 525 CB SER A 34 -6.495 -4.376 4.400 1.00 62.43 C ATOM 526 OG SER A 34 -6.196 -5.685 3.943 1.00 42.43 O ATOM 527 H SER A 34 -5.918 -1.738 5.381 1.00 54.54 H ATOM 528 HA SER A 34 -4.788 -4.432 5.691 1.00 41.02 H ATOM 529 HB2 SER A 34 -7.285 -4.436 5.132 1.00 54.44 H ATOM 530 HB3 SER A 34 -6.824 -3.781 3.560 1.00 63.41 H ATOM 531 HG SER A 34 -5.647 -6.133 4.591 1.00 54.01 H ATOM 532 N GLY A 35 -3.334 -2.447 4.307 1.00 3.14 N ATOM 533 CA GLY A 35 -2.340 -1.991 3.353 1.00 34.22 C ATOM 534 C GLY A 35 -1.715 -3.133 2.576 1.00 12.55 C ATOM 535 O GLY A 35 -1.174 -4.069 3.164 1.00 0.32 O ATOM 536 H GLY A 35 -3.313 -2.116 5.230 1.00 43.33 H ATOM 537 HA2 GLY A 35 -2.810 -1.310 2.659 1.00 71.44 H ATOM 538 HA3 GLY A 35 -1.561 -1.464 3.885 1.00 34.35 H ATOM 539 N GLU A 36 -1.791 -3.056 1.251 1.00 12.32 N ATOM 540 CA GLU A 36 -1.230 -4.093 0.394 1.00 52.44 C ATOM 541 C GLU A 36 -0.854 -3.525 -0.972 1.00 10.21 C ATOM 542 O GLU A 36 -1.176 -2.380 -1.291 1.00 63.33 O ATOM 543 CB GLU A 36 -2.227 -5.241 0.224 1.00 13.21 C ATOM 544 CG GLU A 36 -1.568 -6.594 0.018 1.00 53.12 C ATOM 545 CD GLU A 36 -2.417 -7.740 0.534 1.00 73.35 C ATOM 546 OE1 GLU A 36 -2.281 -8.091 1.724 1.00 52.30 O ATOM 547 OE2 GLU A 36 -3.217 -8.288 -0.255 1.00 14.52 O ATOM 548 H GLU A 36 -2.235 -2.285 0.842 1.00 45.15 H ATOM 549 HA GLU A 36 -0.338 -4.471 0.871 1.00 55.13 H ATOM 550 HB2 GLU A 36 -2.848 -5.296 1.106 1.00 4.33 H ATOM 551 HB3 GLU A 36 -2.853 -5.034 -0.632 1.00 21.21 H ATOM 552 HG2 GLU A 36 -1.398 -6.740 -1.038 1.00 72.43 H ATOM 553 HG3 GLU A 36 -0.623 -6.604 0.538 1.00 3.43 H ATOM 554 N CYS A 37 -0.171 -4.334 -1.775 1.00 22.02 N ATOM 555 CA CYS A 37 0.251 -3.915 -3.107 1.00 14.25 C ATOM 556 C CYS A 37 -0.447 -4.741 -4.183 1.00 40.20 C ATOM 557 O CYS A 37 -0.715 -5.928 -3.994 1.00 12.51 O ATOM 558 CB CYS A 37 1.768 -4.047 -3.248 1.00 41.23 C ATOM 559 SG CYS A 37 2.368 -5.767 -3.246 1.00 42.55 S ATOM 560 H CYS A 37 0.056 -5.237 -1.465 1.00 53.21 H ATOM 561 HA CYS A 37 -0.025 -2.878 -3.230 1.00 10.02 H ATOM 562 HB2 CYS A 37 2.075 -3.593 -4.180 1.00 35.01 H ATOM 563 HB3 CYS A 37 2.245 -3.530 -2.429 1.00 51.11 H ATOM 564 N PHE A 38 -0.737 -4.105 -5.314 1.00 31.11 N ATOM 565 CA PHE A 38 -1.403 -4.780 -6.421 1.00 74.53 C ATOM 566 C PHE A 38 -1.358 -3.927 -7.685 1.00 20.13 C ATOM 567 O PHE A 38 -1.027 -2.742 -7.635 1.00 64.13 O ATOM 568 CB PHE A 38 -2.855 -5.094 -6.055 1.00 52.14 C ATOM 569 CG PHE A 38 -3.735 -3.878 -5.997 1.00 44.41 C ATOM 570 CD1 PHE A 38 -3.822 -3.125 -4.837 1.00 63.14 C ATOM 571 CD2 PHE A 38 -4.474 -3.487 -7.102 1.00 62.10 C ATOM 572 CE1 PHE A 38 -4.630 -2.005 -4.780 1.00 21.15 C ATOM 573 CE2 PHE A 38 -5.283 -2.368 -7.050 1.00 53.12 C ATOM 574 CZ PHE A 38 -5.362 -1.627 -5.888 1.00 1.23 C ATOM 575 H PHE A 38 -0.498 -3.159 -5.404 1.00 65.34 H ATOM 576 HA PHE A 38 -0.880 -5.706 -6.607 1.00 1.22 H ATOM 577 HB2 PHE A 38 -3.268 -5.765 -6.794 1.00 31.10 H ATOM 578 HB3 PHE A 38 -2.880 -5.571 -5.088 1.00 11.13 H ATOM 579 HD1 PHE A 38 -3.250 -3.421 -3.969 1.00 45.53 H ATOM 580 HD2 PHE A 38 -4.415 -4.067 -8.011 1.00 44.12 H ATOM 581 HE1 PHE A 38 -4.689 -1.427 -3.869 1.00 64.32 H ATOM 582 HE2 PHE A 38 -5.855 -2.075 -7.918 1.00 3.51 H ATOM 583 HZ PHE A 38 -5.993 -0.751 -5.845 1.00 31.31 H ATOM 584 N TYR A 39 -1.692 -4.538 -8.817 1.00 4.33 N ATOM 585 CA TYR A 39 -1.687 -3.836 -10.094 1.00 62.14 C ATOM 586 C TYR A 39 -2.627 -2.635 -10.060 1.00 65.22 C ATOM 587 O TYR A 39 -3.825 -2.777 -9.818 1.00 24.40 O ATOM 588 CB TYR A 39 -2.094 -4.784 -11.223 1.00 74.50 C ATOM 589 CG TYR A 39 -0.927 -5.500 -11.864 1.00 22.43 C ATOM 590 CD1 TYR A 39 0.165 -4.794 -12.354 1.00 14.45 C ATOM 591 CD2 TYR A 39 -0.914 -6.886 -11.978 1.00 1.53 C ATOM 592 CE1 TYR A 39 1.232 -5.443 -12.939 1.00 41.14 C ATOM 593 CE2 TYR A 39 0.151 -7.544 -12.562 1.00 21.35 C ATOM 594 CZ TYR A 39 1.221 -6.819 -13.041 1.00 44.53 C ATOM 595 OH TYR A 39 2.285 -7.470 -13.624 1.00 33.02 O ATOM 596 H TYR A 39 -1.946 -5.484 -8.792 1.00 11.23 H ATOM 597 HA TYR A 39 -0.680 -3.487 -10.277 1.00 12.43 H ATOM 598 HB2 TYR A 39 -2.766 -5.532 -10.830 1.00 22.12 H ATOM 599 HB3 TYR A 39 -2.600 -4.221 -11.992 1.00 53.34 H ATOM 600 HD1 TYR A 39 0.170 -3.715 -12.272 1.00 20.33 H ATOM 601 HD2 TYR A 39 -1.754 -7.451 -11.600 1.00 65.03 H ATOM 602 HE1 TYR A 39 2.071 -4.875 -13.315 1.00 63.13 H ATOM 603 HE2 TYR A 39 0.143 -8.621 -12.642 1.00 20.33 H ATOM 604 HH TYR A 39 1.984 -8.302 -13.998 1.00 2.24 H ATOM 605 N ASP A 40 -2.074 -1.453 -10.306 1.00 5.43 N ATOM 606 CA ASP A 40 -2.861 -0.225 -10.304 1.00 75.23 C ATOM 607 C ASP A 40 -3.463 0.035 -11.683 1.00 15.04 C ATOM 608 O ASP A 40 -3.318 -0.776 -12.595 1.00 54.04 O ATOM 609 CB ASP A 40 -1.995 0.962 -9.881 1.00 20.13 C ATOM 610 CG ASP A 40 -0.711 1.056 -10.682 1.00 4.24 C ATOM 611 OD1 ASP A 40 -0.761 0.847 -11.912 1.00 21.20 O ATOM 612 OD2 ASP A 40 0.345 1.341 -10.078 1.00 71.10 O ATOM 613 H ASP A 40 -1.112 -1.404 -10.492 1.00 1.34 H ATOM 614 HA ASP A 40 -3.663 -0.346 -9.593 1.00 13.22 H ATOM 615 HB2 ASP A 40 -2.553 1.876 -10.023 1.00 22.30 H ATOM 616 HB3 ASP A 40 -1.741 0.859 -8.837 1.00 24.42 H ATOM 617 N GLU A 41 -4.140 1.171 -11.823 1.00 30.05 N ATOM 618 CA GLU A 41 -4.765 1.536 -13.088 1.00 73.40 C ATOM 619 C GLU A 41 -3.729 1.612 -14.205 1.00 12.51 C ATOM 620 O GLU A 41 -4.059 1.484 -15.384 1.00 70.31 O ATOM 621 CB GLU A 41 -5.489 2.877 -12.956 1.00 73.43 C ATOM 622 CG GLU A 41 -4.571 4.032 -12.595 1.00 24.33 C ATOM 623 CD GLU A 41 -5.325 5.227 -12.047 1.00 1.53 C ATOM 624 OE1 GLU A 41 -6.565 5.264 -12.190 1.00 12.54 O ATOM 625 OE2 GLU A 41 -4.675 6.127 -11.473 1.00 63.33 O ATOM 626 H GLU A 41 -4.221 1.777 -11.056 1.00 42.03 H ATOM 627 HA GLU A 41 -5.486 0.771 -13.334 1.00 74.32 H ATOM 628 HB2 GLU A 41 -5.971 3.106 -13.896 1.00 33.24 H ATOM 629 HB3 GLU A 41 -6.244 2.790 -12.188 1.00 54.43 H ATOM 630 HG2 GLU A 41 -3.868 3.696 -11.847 1.00 53.02 H ATOM 631 HG3 GLU A 41 -4.034 4.338 -13.481 1.00 4.42 H ATOM 632 N LYS A 42 -2.473 1.823 -13.825 1.00 14.20 N ATOM 633 CA LYS A 42 -1.386 1.917 -14.792 1.00 74.13 C ATOM 634 C LYS A 42 -0.736 0.554 -15.014 1.00 1.31 C ATOM 635 O LYS A 42 0.362 0.462 -15.564 1.00 41.40 O ATOM 636 CB LYS A 42 -0.337 2.923 -14.316 1.00 31.04 C ATOM 637 CG LYS A 42 -0.833 4.358 -14.303 1.00 11.33 C ATOM 638 CD LYS A 42 0.312 5.343 -14.136 1.00 25.01 C ATOM 639 CE LYS A 42 -0.186 6.780 -14.116 1.00 64.23 C ATOM 640 NZ LYS A 42 -0.903 7.101 -12.852 1.00 35.33 N ATOM 641 H LYS A 42 -2.272 1.917 -12.870 1.00 1.21 H ATOM 642 HA LYS A 42 -1.803 2.259 -15.728 1.00 4.23 H ATOM 643 HB2 LYS A 42 -0.033 2.660 -13.314 1.00 3.32 H ATOM 644 HB3 LYS A 42 0.522 2.867 -14.970 1.00 0.35 H ATOM 645 HG2 LYS A 42 -1.337 4.565 -15.235 1.00 73.12 H ATOM 646 HG3 LYS A 42 -1.525 4.483 -13.482 1.00 3.31 H ATOM 647 HD2 LYS A 42 0.820 5.137 -13.206 1.00 41.52 H ATOM 648 HD3 LYS A 42 1.002 5.222 -14.960 1.00 0.10 H ATOM 649 HE2 LYS A 42 0.660 7.442 -14.218 1.00 3.33 H ATOM 650 HE3 LYS A 42 -0.858 6.925 -14.949 1.00 51.41 H ATOM 651 HZ1 LYS A 42 -0.610 8.034 -12.501 1.00 4.11 H ATOM 652 HZ2 LYS A 42 -0.687 6.386 -12.128 1.00 35.33 H ATOM 653 HZ3 LYS A 42 -1.930 7.112 -13.017 1.00 0.34 H ATOM 654 N ARG A 43 -1.420 -0.500 -14.583 1.00 3.40 N ATOM 655 CA ARG A 43 -0.909 -1.857 -14.734 1.00 63.05 C ATOM 656 C ARG A 43 0.456 -2.001 -14.068 1.00 3.54 C ATOM 657 O ARG A 43 1.244 -2.874 -14.427 1.00 22.10 O ATOM 658 CB ARG A 43 -0.806 -2.224 -16.216 1.00 1.30 C ATOM 659 CG ARG A 43 -2.155 -2.361 -16.903 1.00 63.24 C ATOM 660 CD ARG A 43 -2.200 -1.572 -18.202 1.00 74.32 C ATOM 661 NE ARG A 43 -1.223 -2.058 -19.173 1.00 61.23 N ATOM 662 CZ ARG A 43 -1.181 -1.656 -20.438 1.00 72.32 C ATOM 663 NH1 ARG A 43 -2.058 -0.765 -20.884 1.00 21.44 N ATOM 664 NH2 ARG A 43 -0.263 -2.145 -21.261 1.00 42.45 N ATOM 665 H ARG A 43 -2.290 -0.362 -14.152 1.00 21.31 H ATOM 666 HA ARG A 43 -1.603 -2.529 -14.253 1.00 74.05 H ATOM 667 HB2 ARG A 43 -0.243 -1.456 -16.727 1.00 12.12 H ATOM 668 HB3 ARG A 43 -0.282 -3.163 -16.306 1.00 33.42 H ATOM 669 HG2 ARG A 43 -2.331 -3.404 -17.123 1.00 32.31 H ATOM 670 HG3 ARG A 43 -2.924 -1.995 -16.242 1.00 53.23 H ATOM 671 HD2 ARG A 43 -3.189 -1.660 -18.627 1.00 70.13 H ATOM 672 HD3 ARG A 43 -1.993 -0.535 -17.985 1.00 2.12 H ATOM 673 HE ARG A 43 -0.567 -2.717 -18.865 1.00 43.32 H ATOM 674 HH11 ARG A 43 -2.750 -0.395 -20.266 1.00 10.03 H ATOM 675 HH12 ARG A 43 -2.023 -0.464 -21.837 1.00 2.42 H ATOM 676 HH21 ARG A 43 0.399 -2.815 -20.929 1.00 63.50 H ATOM 677 HH22 ARG A 43 -0.232 -1.842 -22.214 1.00 4.24 H ATOM 678 N ASN A 44 0.729 -1.136 -13.096 1.00 34.02 N ATOM 679 CA ASN A 44 2.000 -1.166 -12.380 1.00 52.11 C ATOM 680 C ASN A 44 1.804 -1.644 -10.944 1.00 72.12 C ATOM 681 O ASN A 44 0.874 -1.218 -10.258 1.00 70.54 O ATOM 682 CB ASN A 44 2.644 0.222 -12.384 1.00 32.43 C ATOM 683 CG ASN A 44 3.280 0.560 -13.719 1.00 32.32 C ATOM 684 OD1 ASN A 44 3.919 -0.285 -14.346 1.00 72.01 O ATOM 685 ND2 ASN A 44 3.108 1.800 -14.158 1.00 43.41 N ATOM 686 H ASN A 44 0.060 -0.462 -12.855 1.00 3.54 H ATOM 687 HA ASN A 44 2.652 -1.858 -12.892 1.00 14.13 H ATOM 688 HB2 ASN A 44 1.888 0.963 -12.170 1.00 2.23 H ATOM 689 HB3 ASN A 44 3.407 0.261 -11.622 1.00 20.31 H ATOM 690 HD21 ASN A 44 2.587 2.421 -13.605 1.00 72.24 H ATOM 691 HD22 ASN A 44 3.508 2.046 -15.019 1.00 12.33 H ATOM 692 N LEU A 45 2.686 -2.530 -10.496 1.00 42.30 N ATOM 693 CA LEU A 45 2.612 -3.065 -9.141 1.00 70.34 C ATOM 694 C LEU A 45 3.153 -2.062 -8.128 1.00 42.22 C ATOM 695 O LEU A 45 4.339 -1.734 -8.139 1.00 23.23 O ATOM 696 CB LEU A 45 3.395 -4.376 -9.046 1.00 40.23 C ATOM 697 CG LEU A 45 3.125 -5.401 -10.150 1.00 12.41 C ATOM 698 CD1 LEU A 45 4.309 -6.343 -10.304 1.00 2.32 C ATOM 699 CD2 LEU A 45 1.854 -6.183 -9.852 1.00 43.42 C ATOM 700 H LEU A 45 3.405 -2.831 -11.089 1.00 52.23 H ATOM 701 HA LEU A 45 1.573 -3.260 -8.918 1.00 4.40 H ATOM 702 HB2 LEU A 45 4.446 -4.136 -9.069 1.00 44.25 H ATOM 703 HB3 LEU A 45 3.153 -4.837 -8.099 1.00 23.21 H ATOM 704 HG LEU A 45 2.988 -4.882 -11.088 1.00 50.55 H ATOM 705 HD11 LEU A 45 4.647 -6.658 -9.328 1.00 30.30 H ATOM 706 HD12 LEU A 45 5.112 -5.832 -10.816 1.00 13.24 H ATOM 707 HD13 LEU A 45 4.008 -7.207 -10.878 1.00 21.52 H ATOM 708 HD21 LEU A 45 1.871 -6.521 -8.826 1.00 52.03 H ATOM 709 HD22 LEU A 45 1.794 -7.036 -10.512 1.00 53.52 H ATOM 710 HD23 LEU A 45 0.996 -5.545 -10.007 1.00 75.41 H ATOM 711 N GLN A 46 2.276 -1.580 -7.254 1.00 72.40 N ATOM 712 CA GLN A 46 2.667 -0.615 -6.233 1.00 32.20 C ATOM 713 C GLN A 46 1.990 -0.926 -4.902 1.00 55.33 C ATOM 714 O GLN A 46 1.032 -1.698 -4.846 1.00 3.21 O ATOM 715 CB GLN A 46 2.312 0.804 -6.681 1.00 22.22 C ATOM 716 CG GLN A 46 2.875 1.170 -8.044 1.00 61.23 C ATOM 717 CD GLN A 46 3.060 2.665 -8.217 1.00 61.14 C ATOM 718 OE1 GLN A 46 2.217 3.459 -7.800 1.00 42.52 O ATOM 719 NE2 GLN A 46 4.169 3.057 -8.834 1.00 14.33 N ATOM 720 H GLN A 46 1.344 -1.880 -7.297 1.00 24.33 H ATOM 721 HA GLN A 46 3.736 -0.685 -6.103 1.00 22.31 H ATOM 722 HB2 GLN A 46 1.238 0.898 -6.721 1.00 11.14 H ATOM 723 HB3 GLN A 46 2.700 1.505 -5.955 1.00 62.21 H ATOM 724 HG2 GLN A 46 3.834 0.688 -8.166 1.00 32.10 H ATOM 725 HG3 GLN A 46 2.196 0.816 -8.806 1.00 21.31 H ATOM 726 HE21 GLN A 46 4.796 2.368 -9.141 1.00 31.52 H ATOM 727 HE22 GLN A 46 4.313 4.017 -8.960 1.00 45.44 H ATOM 728 N CYS A 47 2.493 -0.320 -3.832 1.00 51.44 N ATOM 729 CA CYS A 47 1.937 -0.530 -2.501 1.00 31.44 C ATOM 730 C CYS A 47 0.887 0.527 -2.175 1.00 72.13 C ATOM 731 O CYS A 47 1.208 1.702 -2.001 1.00 1.32 O ATOM 732 CB CYS A 47 3.049 -0.501 -1.451 1.00 4.34 C ATOM 733 SG CYS A 47 2.532 -1.076 0.198 1.00 74.23 S ATOM 734 H CYS A 47 3.257 0.286 -3.940 1.00 60.02 H ATOM 735 HA CYS A 47 1.468 -1.502 -2.487 1.00 74.34 H ATOM 736 HB2 CYS A 47 3.861 -1.135 -1.779 1.00 53.34 H ATOM 737 HB3 CYS A 47 3.410 0.512 -1.348 1.00 72.24 H ATOM 738 N ILE A 48 -0.369 0.100 -2.095 1.00 42.24 N ATOM 739 CA ILE A 48 -1.466 1.009 -1.789 1.00 50.21 C ATOM 740 C ILE A 48 -2.003 0.770 -0.382 1.00 50.34 C ATOM 741 O ILE A 48 -2.028 -0.363 0.100 1.00 34.34 O ATOM 742 CB ILE A 48 -2.620 0.860 -2.798 1.00 60.53 C ATOM 743 CG1 ILE A 48 -2.085 0.927 -4.231 1.00 4.14 C ATOM 744 CG2 ILE A 48 -3.669 1.937 -2.568 1.00 13.31 C ATOM 745 CD1 ILE A 48 -1.867 -0.431 -4.859 1.00 44.34 C ATOM 746 H ILE A 48 -0.562 -0.849 -2.244 1.00 22.11 H ATOM 747 HA ILE A 48 -1.088 2.020 -1.851 1.00 51.24 H ATOM 748 HB ILE A 48 -3.084 -0.101 -2.640 1.00 51.34 H ATOM 749 HG12 ILE A 48 -2.788 1.467 -4.845 1.00 44.33 H ATOM 750 HG13 ILE A 48 -1.139 1.449 -4.229 1.00 41.52 H ATOM 751 HG21 ILE A 48 -4.055 1.854 -1.563 1.00 13.11 H ATOM 752 HG22 ILE A 48 -3.220 2.910 -2.700 1.00 23.13 H ATOM 753 HG23 ILE A 48 -4.475 1.813 -3.275 1.00 13.14 H ATOM 754 HD11 ILE A 48 -0.883 -0.468 -5.303 1.00 44.44 H ATOM 755 HD12 ILE A 48 -1.946 -1.196 -4.101 1.00 54.31 H ATOM 756 HD13 ILE A 48 -2.612 -0.600 -5.622 1.00 43.21 H ATOM 757 N CYS A 49 -2.432 1.844 0.272 1.00 73.02 N ATOM 758 CA CYS A 49 -2.971 1.752 1.624 1.00 3.03 C ATOM 759 C CYS A 49 -4.462 2.074 1.638 1.00 32.14 C ATOM 760 O CYS A 49 -4.932 2.923 0.881 1.00 64.15 O ATOM 761 CB CYS A 49 -2.222 2.704 2.559 1.00 32.24 C ATOM 762 SG CYS A 49 -0.414 2.689 2.345 1.00 64.43 S ATOM 763 H CYS A 49 -2.386 2.720 -0.165 1.00 51.23 H ATOM 764 HA CYS A 49 -2.831 0.739 1.968 1.00 4.14 H ATOM 765 HB2 CYS A 49 -2.564 3.713 2.381 1.00 14.24 H ATOM 766 HB3 CYS A 49 -2.435 2.432 3.583 1.00 53.32 H ATOM 767 N ASP A 50 -5.200 1.391 2.506 1.00 55.00 N ATOM 768 CA ASP A 50 -6.639 1.605 2.622 1.00 62.31 C ATOM 769 C ASP A 50 -7.016 2.014 4.042 1.00 65.20 C ATOM 770 O ASP A 50 -6.902 1.221 4.978 1.00 5.11 O ATOM 771 CB ASP A 50 -7.398 0.338 2.224 1.00 2.22 C ATOM 772 CG ASP A 50 -6.730 -0.402 1.081 1.00 14.34 C ATOM 773 OD1 ASP A 50 -7.051 -0.103 -0.088 1.00 14.13 O ATOM 774 OD2 ASP A 50 -5.887 -1.280 1.357 1.00 24.44 O ATOM 775 H ASP A 50 -4.768 0.727 3.084 1.00 53.02 H ATOM 776 HA ASP A 50 -6.911 2.403 1.948 1.00 43.55 H ATOM 777 HB2 ASP A 50 -7.451 -0.325 3.075 1.00 42.30 H ATOM 778 HB3 ASP A 50 -8.399 0.608 1.920 1.00 64.53 H ATOM 779 N TYR A 51 -7.463 3.254 4.196 1.00 5.55 N ATOM 780 CA TYR A 51 -7.853 3.770 5.504 1.00 64.31 C ATOM 781 C TYR A 51 -9.340 4.105 5.536 1.00 73.23 C ATOM 782 O TYR A 51 -9.795 5.030 4.862 1.00 72.34 O ATOM 783 CB TYR A 51 -7.031 5.012 5.852 1.00 41.24 C ATOM 784 CG TYR A 51 -7.371 5.607 7.199 1.00 75.31 C ATOM 785 CD1 TYR A 51 -7.552 4.794 8.312 1.00 11.24 C ATOM 786 CD2 TYR A 51 -7.515 6.978 7.359 1.00 0.45 C ATOM 787 CE1 TYR A 51 -7.864 5.332 9.546 1.00 51.35 C ATOM 788 CE2 TYR A 51 -7.825 7.525 8.590 1.00 54.32 C ATOM 789 CZ TYR A 51 -7.999 6.698 9.679 1.00 13.22 C ATOM 790 OH TYR A 51 -8.311 7.239 10.906 1.00 31.03 O ATOM 791 H TYR A 51 -7.531 3.839 3.413 1.00 4.20 H ATOM 792 HA TYR A 51 -7.652 3.001 6.236 1.00 11.53 H ATOM 793 HB2 TYR A 51 -5.983 4.753 5.860 1.00 31.41 H ATOM 794 HB3 TYR A 51 -7.202 5.770 5.101 1.00 14.12 H ATOM 795 HD1 TYR A 51 -7.445 3.724 8.204 1.00 3.04 H ATOM 796 HD2 TYR A 51 -7.378 7.623 6.504 1.00 54.40 H ATOM 797 HE1 TYR A 51 -8.000 4.685 10.400 1.00 53.11 H ATOM 798 HE2 TYR A 51 -7.933 8.595 8.694 1.00 43.31 H ATOM 799 HH TYR A 51 -8.921 7.970 10.788 1.00 52.43 H ATOM 800 N CYS A 52 -10.095 3.347 6.324 1.00 64.53 N ATOM 801 CA CYS A 52 -11.531 3.561 6.446 1.00 23.23 C ATOM 802 C CYS A 52 -11.865 4.276 7.752 1.00 20.31 C ATOM 803 O CYS A 52 -10.993 4.494 8.592 1.00 11.21 O ATOM 804 CB CYS A 52 -12.275 2.226 6.378 1.00 73.12 C ATOM 805 SG CYS A 52 -12.263 1.452 4.729 1.00 63.41 S ATOM 806 H CYS A 52 -9.674 2.624 6.837 1.00 62.30 H ATOM 807 HA CYS A 52 -11.845 4.181 5.621 1.00 54.55 H ATOM 808 HB2 CYS A 52 -11.817 1.533 7.069 1.00 75.40 H ATOM 809 HB3 CYS A 52 -13.305 2.382 6.661 1.00 71.21 H