ATOM 22 N ASP A 2 -7.689 7.972 6.509 1.00 -0.46 N ATOM 23 CA ASP A 2 -7.031 9.244 6.845 1.00 0.04 C ATOM 24 C ASP A 2 -5.622 8.921 7.303 1.00 0.62 C ATOM 25 O ASP A 2 -5.274 9.165 8.447 1.00 -0.50 O ATOM 26 CB ASP A 2 -7.761 10.203 7.828 1.00 -0.40 C ATOM 27 CG ASP A 2 -7.089 11.550 7.924 1.00 0.71 C ATOM 28 OD1 ASP A 2 -6.063 11.775 7.225 1.00 -0.72 O ATOM 29 OD2 ASP A 2 -7.591 12.402 8.705 1.00 -0.72 O ATOM 30 H ASP A 2 -7.339 7.469 5.718 1.00 0.25 H ATOM 31 HA ASP A 2 -6.947 9.821 5.910 1.00 0.05 H ATOM 32 HB2 ASP A 2 -8.795 10.366 7.484 1.00 0.07 H ATOM 33 HB3 ASP A 2 -7.781 9.779 8.843 1.00 0.07 H ATOM 34 N CYS A 3 -4.795 8.331 6.405 1.00 -0.46 N ATOM 35 CA CYS A 3 -3.465 7.861 6.792 1.00 0.04 C ATOM 36 C CYS A 3 -3.452 7.277 8.188 1.00 0.62 C ATOM 37 O CYS A 3 -2.548 7.581 8.949 1.00 -0.50 O ATOM 38 CB CYS A 3 -2.455 9.025 6.606 1.00 -0.10 C ATOM 39 SG CYS A 3 -0.704 8.495 6.547 1.00 0.82 S ATOM 40 H CYS A 3 -5.072 8.213 5.450 1.00 0.25 H ATOM 41 HA CYS A 3 -3.205 7.024 6.127 1.00 0.05 H ATOM 42 HB2 CYS A 3 -2.668 9.555 5.666 1.00 0.05 H ATOM 43 HB3 CYS A 3 -2.577 9.751 7.425 1.00 0.05 H ATOM 44 N GLY A 4 -4.465 6.438 8.508 1.00 -0.46 N ATOM 45 CA GLY A 4 -4.615 5.911 9.862 1.00 0.04 C ATOM 46 C GLY A 4 -4.960 4.444 9.803 1.00 0.62 C ATOM 47 O GLY A 4 -4.097 3.626 10.077 1.00 -0.50 O ATOM 48 H GLY A 4 -5.174 6.211 7.836 1.00 0.25 H ATOM 49 HA2 GLY A 4 -3.702 6.036 10.466 1.00 0.03 H ATOM 50 HA3 GLY A 4 -5.424 6.457 10.371 1.00 0.03 H ATOM 51 N HIS A 5 -6.206 4.070 9.432 1.00 -0.46 N ATOM 52 CA HIS A 5 -6.542 2.647 9.382 1.00 0.04 C ATOM 53 C HIS A 5 -5.691 1.951 8.341 1.00 0.62 C ATOM 54 O HIS A 5 -5.015 0.991 8.676 1.00 -0.50 O ATOM 55 CB HIS A 5 -8.049 2.411 9.107 1.00 -0.10 C ATOM 56 CG HIS A 5 -8.346 0.935 9.043 1.00 0.06 C ATOM 57 ND1 HIS A 5 -8.140 0.073 9.995 1.00 -0.06 N ATOM 58 CD2 HIS A 5 -8.866 0.254 8.019 1.00 -0.04 C ATOM 59 CE1 HIS A 5 -8.495 -1.126 9.643 1.00 0.11 C ATOM 60 NE2 HIS A 5 -8.937 -0.980 8.428 1.00 -0.06 N ATOM 61 H HIS A 5 -6.901 4.753 9.195 1.00 0.25 H ATOM 62 HA HIS A 5 -6.309 2.219 10.371 1.00 0.05 H ATOM 63 HB2 HIS A 5 -8.651 2.864 9.911 1.00 0.09 H ATOM 64 HB3 HIS A 5 -8.335 2.887 8.157 1.00 0.09 H ATOM 65 HD1 HIS A 5 -7.746 0.309 10.919 1.00 0.31 H ATOM 66 HD2 HIS A 5 -9.163 0.669 7.055 1.00 0.15 H ATOM 67 HE1 HIS A 5 -8.437 -2.043 10.233 1.00 0.16 H ATOM 68 HE2 HIS A 5 -9.307 -1.756 7.858 1.00 0.31 H ATOM 69 N VAL A 6 -5.688 2.423 7.074 1.00 -0.46 N ATOM 70 CA VAL A 6 -4.760 1.855 6.090 1.00 0.04 C ATOM 71 C VAL A 6 -3.375 1.883 6.696 1.00 0.62 C ATOM 72 O VAL A 6 -2.723 0.853 6.750 1.00 -0.50 O ATOM 73 CB VAL A 6 -4.768 2.644 4.740 1.00 -0.01 C ATOM 74 CG1 VAL A 6 -3.480 2.411 3.900 1.00 -0.09 C ATOM 75 CG2 VAL A 6 -6.012 2.268 3.890 1.00 -0.09 C ATOM 76 H VAL A 6 -6.274 3.193 6.817 1.00 0.25 H ATOM 77 HA VAL A 6 -5.032 0.803 5.895 1.00 0.05 H ATOM 78 HB VAL A 6 -4.814 3.725 4.962 1.00 0.02 H ATOM 79 HG11 VAL A 6 -3.579 2.904 2.921 1.00 0.03 H ATOM 80 HG12 VAL A 6 -2.593 2.834 4.396 1.00 0.03 H ATOM 81 HG13 VAL A 6 -3.314 1.336 3.739 1.00 0.03 H ATOM 82 HG21 VAL A 6 -6.924 2.311 4.501 1.00 0.03 H ATOM 83 HG22 VAL A 6 -6.129 2.958 3.040 1.00 0.03 H ATOM 84 HG23 VAL A 6 -5.905 1.249 3.490 1.00 0.03 H ATOM 85 N ASP A 7 -2.923 3.069 7.162 1.00 -0.46 N ATOM 86 CA ASP A 7 -1.546 3.204 7.640 1.00 0.04 C ATOM 87 C ASP A 7 -1.206 2.140 8.670 1.00 0.62 C ATOM 88 O ASP A 7 -0.148 1.533 8.599 1.00 -0.50 O ATOM 89 CB ASP A 7 -1.306 4.645 8.164 1.00 -0.40 C ATOM 90 CG ASP A 7 0.161 4.960 8.260 1.00 0.71 C ATOM 91 OD1 ASP A 7 0.863 4.227 9.001 1.00 -0.72 O ATOM 92 OD2 ASP A 7 0.606 5.935 7.589 1.00 -0.72 O ATOM 93 H ASP A 7 -3.520 3.871 7.143 1.00 0.25 H ATOM 94 HA ASP A 7 -0.890 3.081 6.764 1.00 0.05 H ATOM 95 HB2 ASP A 7 -1.743 5.363 7.456 1.00 0.07 H ATOM 96 HB3 ASP A 7 -1.784 4.785 9.144 1.00 0.07 H ATOM 97 N SER A 8 -2.093 1.860 9.648 1.00 -0.46 N ATOM 98 CA SER A 8 -1.817 0.783 10.602 1.00 0.04 C ATOM 99 C SER A 8 -1.500 -0.519 9.897 1.00 0.62 C ATOM 100 O SER A 8 -0.636 -1.249 10.357 1.00 -0.50 O ATOM 101 CB SER A 8 -3.044 0.536 11.521 1.00 0.02 C ATOM 102 OG SER A 8 -3.464 1.753 12.160 1.00 -0.55 O ATOM 103 H SER A 8 -2.952 2.369 9.723 1.00 0.25 H ATOM 104 HA SER A 8 -0.957 1.076 11.225 1.00 0.05 H ATOM 105 HB2 SER A 8 -3.893 0.179 10.917 1.00 0.12 H ATOM 106 HB3 SER A 8 -2.812 -0.235 12.275 1.00 0.12 H ATOM 107 HG SER A 8 -2.789 2.134 12.713 1.00 0.31 H ATOM 108 N LEU A 9 -2.199 -0.825 8.780 1.00 -0.46 N ATOM 109 CA LEU A 9 -1.982 -2.090 8.075 1.00 0.04 C ATOM 110 C LEU A 9 -0.837 -2.031 7.077 1.00 0.62 C ATOM 111 O LEU A 9 -0.533 -3.073 6.515 1.00 -0.50 O ATOM 112 CB LEU A 9 -3.301 -2.535 7.381 1.00 -0.06 C ATOM 113 CG LEU A 9 -4.553 -2.550 8.313 1.00 -0.01 C ATOM 114 CD1 LEU A 9 -5.808 -2.992 7.512 1.00 -0.11 C ATOM 115 CD2 LEU A 9 -4.360 -3.475 9.544 1.00 -0.11 C ATOM 116 H LEU A 9 -2.853 -0.171 8.394 1.00 0.25 H ATOM 117 HA LEU A 9 -1.702 -2.879 8.792 1.00 0.05 H ATOM 118 HB2 LEU A 9 -3.496 -1.825 6.565 1.00 0.03 H ATOM 119 HB3 LEU A 9 -3.161 -3.535 6.938 1.00 0.03 H ATOM 120 HG LEU A 9 -4.760 -1.535 8.687 1.00 0.03 H ATOM 121 HD11 LEU A 9 -6.717 -2.914 8.128 1.00 0.03 H ATOM 122 HD12 LEU A 9 -5.944 -2.365 6.617 1.00 0.03 H ATOM 123 HD13 LEU A 9 -5.691 -4.040 7.204 1.00 0.03 H ATOM 124 HD21 LEU A 9 -4.070 -4.485 9.217 1.00 0.03 H ATOM 125 HD22 LEU A 9 -3.586 -3.077 10.217 1.00 0.03 H ATOM 126 HD23 LEU A 9 -5.296 -3.547 10.119 1.00 0.03 H ATOM 127 N VAL A 10 -0.168 -0.874 6.837 1.00 -0.46 N ATOM 128 CA VAL A 10 1.030 -0.866 5.985 1.00 0.04 C ATOM 129 C VAL A 10 2.233 -1.218 6.835 1.00 0.62 C ATOM 130 O VAL A 10 3.082 -1.961 6.372 1.00 -0.50 O ATOM 131 CB VAL A 10 1.264 0.442 5.164 1.00 -0.01 C ATOM 132 CG1 VAL A 10 -0.076 0.940 4.563 1.00 -0.09 C ATOM 133 CG2 VAL A 10 1.978 1.582 5.943 1.00 -0.09 C ATOM 134 H VAL A 10 -0.434 -0.027 7.296 1.00 0.25 H ATOM 135 HA VAL A 10 0.913 -1.655 5.223 1.00 0.05 H ATOM 136 HB VAL A 10 1.936 0.196 4.321 1.00 0.02 H ATOM 137 HG11 VAL A 10 -0.520 0.171 3.914 1.00 0.03 H ATOM 138 HG12 VAL A 10 -0.798 1.177 5.345 1.00 0.03 H ATOM 139 HG13 VAL A 10 0.077 1.862 3.991 1.00 0.03 H ATOM 140 HG21 VAL A 10 2.968 1.263 6.300 1.00 0.03 H ATOM 141 HG22 VAL A 10 2.128 2.456 5.290 1.00 0.03 H ATOM 142 HG23 VAL A 10 1.386 1.908 6.804 1.00 0.03 H ATOM 143 N ARG A 11 2.331 -0.724 8.090 1.00 -0.46 N ATOM 144 CA ARG A 11 3.434 -1.123 8.971 1.00 0.04 C ATOM 145 C ARG A 11 3.843 -2.587 8.854 1.00 0.62 C ATOM 146 O ARG A 11 5.008 -2.816 8.565 1.00 -0.50 O ATOM 147 CB ARG A 11 3.167 -0.715 10.455 1.00 -0.08 C ATOM 148 CG ARG A 11 3.896 0.595 10.880 1.00 -0.10 C ATOM 149 CD ARG A 11 3.513 1.870 10.070 1.00 -0.23 C ATOM 150 NE ARG A 11 2.173 2.390 10.372 1.00 -0.32 N ATOM 151 CZ ARG A 11 1.868 3.094 11.442 1.00 0.76 C ATOM 152 NH1 ARG A 11 2.720 3.363 12.402 1.00 -0.62 N ATOM 153 NH2 ARG A 11 0.650 3.567 11.567 1.00 -0.62 N ATOM 154 H ARG A 11 1.656 -0.068 8.429 1.00 0.25 H ATOM 155 HA ARG A 11 4.314 -0.565 8.617 1.00 0.05 H ATOM 156 HB2 ARG A 11 2.088 -0.624 10.655 1.00 0.06 H ATOM 157 HB3 ARG A 11 3.545 -1.514 11.116 1.00 0.06 H ATOM 158 HG2 ARG A 11 3.696 0.755 11.951 1.00 0.07 H ATOM 159 HG3 ARG A 11 4.982 0.428 10.771 1.00 0.07 H ATOM 160 HD2 ARG A 11 4.263 2.665 10.215 1.00 0.13 H ATOM 161 HD3 ARG A 11 3.563 1.643 8.993 1.00 0.13 H ATOM 162 HE ARG A 11 1.440 2.239 9.656 1.00 0.27 H ATOM 163 HH11 ARG A 11 3.691 3.039 12.367 1.00 0.36 H ATOM 164 HH12 ARG A 11 2.439 3.919 13.221 1.00 0.36 H ATOM 165 HH21 ARG A 11 -0.046 3.429 10.822 1.00 0.36 H ATOM 166 HH22 ARG A 11 0.368 4.118 12.388 1.00 0.36 H ATOM 167 N PRO A 12 2.994 -3.630 9.038 1.00 -0.23 N ATOM 168 CA PRO A 12 3.488 -4.994 8.875 1.00 0.04 C ATOM 169 C PRO A 12 4.035 -5.227 7.481 1.00 0.53 C ATOM 170 O PRO A 12 4.927 -6.047 7.331 1.00 -0.50 O ATOM 171 CB PRO A 12 2.203 -5.805 9.182 1.00 -0.12 C ATOM 172 CG PRO A 12 1.052 -4.818 8.879 1.00 -0.12 C ATOM 173 CD PRO A 12 1.592 -3.461 9.387 1.00 -0.01 C ATOM 174 HA PRO A 12 4.277 -5.213 9.615 1.00 0.05 H ATOM 175 HB2 PRO A 12 2.135 -6.742 8.606 1.00 0.06 H ATOM 176 HB3 PRO A 12 2.168 -6.049 10.257 1.00 0.06 H ATOM 177 HG2 PRO A 12 0.896 -4.785 7.790 1.00 0.06 H ATOM 178 HG3 PRO A 12 0.101 -5.095 9.358 1.00 0.06 H ATOM 179 HD2 PRO A 12 1.075 -2.628 8.897 1.00 0.06 H ATOM 180 HD3 PRO A 12 1.488 -3.373 10.481 1.00 0.06 H ATOM 181 N CYS A 13 3.541 -4.515 6.442 1.00 -0.46 N ATOM 182 CA CYS A 13 4.157 -4.624 5.121 1.00 0.04 C ATOM 183 C CYS A 13 5.536 -3.990 5.132 1.00 0.62 C ATOM 184 O CYS A 13 6.443 -4.563 4.547 1.00 -0.50 O ATOM 185 CB CYS A 13 3.295 -3.944 4.024 1.00 -0.10 C ATOM 186 SG CYS A 13 1.547 -4.470 4.115 1.00 0.82 S ATOM 187 H CYS A 13 2.820 -3.837 6.579 1.00 0.25 H ATOM 188 HA CYS A 13 4.247 -5.690 4.858 1.00 0.05 H ATOM 189 HB2 CYS A 13 3.316 -2.849 4.118 1.00 0.05 H ATOM 190 HB3 CYS A 13 3.704 -4.196 3.036 1.00 0.05 H ATOM 191 N LEU A 14 5.711 -2.811 5.780 1.00 -0.46 N ATOM 192 CA LEU A 14 7.006 -2.123 5.753 1.00 0.04 C ATOM 193 C LEU A 14 8.162 -3.072 5.998 1.00 0.62 C ATOM 194 O LEU A 14 9.118 -3.036 5.240 1.00 -0.50 O ATOM 195 CB LEU A 14 7.114 -0.904 6.714 1.00 -0.06 C ATOM 196 CG LEU A 14 6.244 0.334 6.321 1.00 -0.01 C ATOM 197 CD1 LEU A 14 6.415 1.451 7.391 1.00 -0.11 C ATOM 198 CD2 LEU A 14 6.600 0.921 4.922 1.00 -0.11 C ATOM 199 H LEU A 14 4.946 -2.376 6.256 1.00 0.25 H ATOM 200 HA LEU A 14 7.145 -1.721 4.748 1.00 0.05 H ATOM 201 HB2 LEU A 14 6.852 -1.245 7.727 1.00 0.03 H ATOM 202 HB3 LEU A 14 8.165 -0.576 6.741 1.00 0.03 H ATOM 203 HG LEU A 14 5.182 0.039 6.307 1.00 0.03 H ATOM 204 HD11 LEU A 14 5.729 2.289 7.191 1.00 0.03 H ATOM 205 HD12 LEU A 14 6.201 1.070 8.400 1.00 0.03 H ATOM 206 HD13 LEU A 14 7.446 1.835 7.380 1.00 0.03 H ATOM 207 HD21 LEU A 14 6.116 1.899 4.782 1.00 0.03 H ATOM 208 HD22 LEU A 14 7.687 1.061 4.829 1.00 0.03 H ATOM 209 HD23 LEU A 14 6.253 0.276 4.102 1.00 0.03 H ATOM 210 N SER A 15 8.104 -3.931 7.038 1.00 -0.46 N ATOM 211 CA SER A 15 9.231 -4.827 7.314 1.00 0.04 C ATOM 212 C SER A 15 9.769 -5.500 6.064 1.00 0.62 C ATOM 213 O SER A 15 10.966 -5.471 5.823 1.00 -0.50 O ATOM 214 CB SER A 15 8.798 -5.914 8.333 1.00 0.02 C ATOM 215 OG SER A 15 8.293 -5.253 9.507 1.00 -0.55 O ATOM 216 H SER A 15 7.317 -3.931 7.660 1.00 0.25 H ATOM 217 HA SER A 15 10.034 -4.226 7.774 1.00 0.05 H ATOM 218 HB2 SER A 15 8.006 -6.547 7.897 1.00 0.12 H ATOM 219 HB3 SER A 15 9.663 -6.551 8.587 1.00 0.12 H ATOM 220 HG SER A 15 8.007 -5.860 10.183 1.00 0.31 H ATOM 221 N TYR A 16 8.883 -6.117 5.253 1.00 -0.46 N ATOM 222 CA TYR A 16 9.330 -6.799 4.032 1.00 0.04 C ATOM 223 C TYR A 16 9.571 -5.805 2.916 1.00 0.62 C ATOM 224 O TYR A 16 10.583 -5.886 2.238 1.00 -0.50 O ATOM 225 CB TYR A 16 8.223 -7.794 3.603 1.00 -0.10 C ATOM 226 CG TYR A 16 8.523 -8.615 2.341 1.00 -0.03 C ATOM 227 CD1 TYR A 16 8.314 -8.080 1.065 1.00 0.00 C ATOM 228 CD2 TYR A 16 8.965 -9.937 2.453 1.00 0.00 C ATOM 229 CE1 TYR A 16 8.326 -8.918 -0.053 1.00 -0.26 C ATOM 230 CE2 TYR A 16 8.992 -10.775 1.337 1.00 -0.26 C ATOM 231 CZ TYR A 16 8.636 -10.274 0.084 1.00 0.46 C ATOM 232 OH TYR A 16 8.596 -11.129 -1.014 1.00 -0.53 O ATOM 233 H TYR A 16 7.904 -6.079 5.468 1.00 0.25 H ATOM 234 HA TYR A 16 10.243 -7.377 4.240 1.00 0.05 H ATOM 235 HB2 TYR A 16 8.028 -8.477 4.444 1.00 0.04 H ATOM 236 HB3 TYR A 16 7.301 -7.231 3.410 1.00 0.04 H ATOM 237 HD1 TYR A 16 8.127 -7.020 0.935 1.00 0.06 H ATOM 238 HD2 TYR A 16 9.279 -10.324 3.411 1.00 0.06 H ATOM 239 HE1 TYR A 16 8.090 -8.514 -1.029 1.00 0.10 H ATOM 240 HE2 TYR A 16 9.286 -11.814 1.439 1.00 0.10 H ATOM 241 HH TYR A 16 9.145 -10.781 -1.711 1.00 0.33 H ATOM 242 N VAL A 17 8.621 -4.863 2.716 1.00 -0.46 N ATOM 243 CA VAL A 17 8.712 -3.907 1.607 1.00 0.04 C ATOM 244 C VAL A 17 10.023 -3.154 1.641 1.00 0.62 C ATOM 245 O VAL A 17 10.670 -3.023 0.614 1.00 -0.50 O ATOM 246 CB VAL A 17 7.530 -2.894 1.684 1.00 -0.01 C ATOM 247 CG1 VAL A 17 7.762 -1.627 0.823 1.00 -0.09 C ATOM 248 CG2 VAL A 17 6.190 -3.569 1.303 1.00 -0.09 C ATOM 249 H VAL A 17 7.835 -4.819 3.334 1.00 0.25 H ATOM 250 HA VAL A 17 8.656 -4.455 0.653 1.00 0.05 H ATOM 251 HB VAL A 17 7.449 -2.545 2.718 1.00 0.02 H ATOM 252 HG11 VAL A 17 8.628 -1.067 1.203 1.00 0.03 H ATOM 253 HG12 VAL A 17 7.948 -1.921 -0.216 1.00 0.03 H ATOM 254 HG13 VAL A 17 6.890 -0.957 0.851 1.00 0.03 H ATOM 255 HG21 VAL A 17 5.989 -4.465 1.906 1.00 0.03 H ATOM 256 HG22 VAL A 17 5.354 -2.867 1.440 1.00 0.03 H ATOM 257 HG23 VAL A 17 6.244 -3.869 0.250 1.00 0.03 H ATOM 258 N GLN A 18 10.420 -2.639 2.825 1.00 -0.46 N ATOM 259 CA GLN A 18 11.692 -1.924 2.921 1.00 0.04 C ATOM 260 C GLN A 18 12.779 -2.792 2.321 1.00 0.62 C ATOM 261 O GLN A 18 13.574 -2.304 1.533 1.00 -0.50 O ATOM 262 CB GLN A 18 12.037 -1.574 4.396 1.00 -0.10 C ATOM 263 CG GLN A 18 11.149 -0.419 4.938 1.00 -0.10 C ATOM 264 CD GLN A 18 11.340 -0.170 6.415 1.00 0.68 C ATOM 265 OE1 GLN A 18 12.168 -0.806 7.045 1.00 -0.47 O ATOM 266 NE2 GLN A 18 10.574 0.769 7.007 1.00 -0.87 N ATOM 267 H GLN A 18 9.859 -2.767 3.645 1.00 0.25 H ATOM 268 HA GLN A 18 11.617 -0.992 2.341 1.00 0.05 H ATOM 269 HB2 GLN A 18 11.911 -2.476 5.018 1.00 0.04 H ATOM 270 HB3 GLN A 18 13.092 -1.261 4.467 1.00 0.04 H ATOM 271 HG2 GLN A 18 11.401 0.509 4.403 1.00 0.06 H ATOM 272 HG3 GLN A 18 10.084 -0.635 4.766 1.00 0.06 H ATOM 273 HE21 GLN A 18 9.899 1.289 6.487 1.00 0.34 H ATOM 274 HE22 GLN A 18 10.687 0.945 7.985 1.00 0.34 H ATOM 275 N GLY A 19 12.795 -4.095 2.684 1.00 -0.46 N ATOM 276 CA GLY A 19 13.760 -5.030 2.108 1.00 0.04 C ATOM 277 C GLY A 19 14.064 -6.098 3.133 1.00 0.62 C ATOM 278 O GLY A 19 15.111 -6.037 3.758 1.00 -0.50 O ATOM 279 H GLY A 19 12.107 -4.455 3.319 1.00 0.25 H ATOM 280 HA2 GLY A 19 13.332 -5.485 1.201 1.00 0.03 H ATOM 281 HA3 GLY A 19 14.698 -4.526 1.826 1.00 0.03 H ATOM 282 N GLY A 20 13.144 -7.066 3.350 1.00 -0.46 N ATOM 283 CA GLY A 20 13.330 -8.002 4.458 1.00 0.04 C ATOM 284 C GLY A 20 12.422 -9.210 4.394 1.00 0.62 C ATOM 285 O GLY A 20 11.742 -9.354 3.390 1.00 -0.50 O ATOM 286 H GLY A 20 12.295 -7.107 2.817 1.00 0.25 H ATOM 287 HA2 GLY A 20 14.368 -8.369 4.471 1.00 0.03 H ATOM 288 HA3 GLY A 20 13.134 -7.440 5.383 1.00 0.03 H ATOM 289 N PRO A 21 12.391 -10.103 5.419 1.00 -0.23 N ATOM 290 CA PRO A 21 11.561 -11.298 5.334 1.00 0.04 C ATOM 291 C PRO A 21 10.135 -11.016 5.751 1.00 0.53 C ATOM 292 O PRO A 21 9.816 -9.881 6.069 1.00 -0.50 O ATOM 293 CB PRO A 21 12.292 -12.171 6.384 1.00 -0.12 C ATOM 294 CG PRO A 21 12.716 -11.141 7.456 1.00 -0.12 C ATOM 295 CD PRO A 21 13.209 -9.939 6.615 1.00 -0.01 C ATOM 296 HA PRO A 21 11.583 -11.767 4.336 1.00 0.05 H ATOM 297 HB2 PRO A 21 11.676 -12.986 6.796 1.00 0.06 H ATOM 298 HB3 PRO A 21 13.199 -12.607 5.932 1.00 0.06 H ATOM 299 HG2 PRO A 21 11.826 -10.849 8.039 1.00 0.06 H ATOM 300 HG3 PRO A 21 13.483 -11.526 8.148 1.00 0.06 H ATOM 301 HD2 PRO A 21 13.040 -8.992 7.153 1.00 0.06 H ATOM 302 HD3 PRO A 21 14.276 -10.052 6.365 1.00 0.06 H ATOM 303 N GLY A 22 9.260 -12.049 5.743 1.00 -0.46 N ATOM 304 CA GLY A 22 7.851 -11.840 6.078 1.00 0.04 C ATOM 305 C GLY A 22 7.094 -11.464 4.822 1.00 0.62 C ATOM 306 O GLY A 22 7.364 -12.111 3.822 1.00 -0.50 O ATOM 307 H GLY A 22 9.543 -12.963 5.444 1.00 0.25 H ATOM 308 HA2 GLY A 22 7.412 -12.783 6.444 1.00 0.03 H ATOM 309 HA3 GLY A 22 7.769 -11.119 6.901 1.00 0.03 H ATOM 310 N PRO A 23 6.150 -10.488 4.771 1.00 -0.23 N ATOM 311 CA PRO A 23 5.757 -9.703 5.937 1.00 0.04 C ATOM 312 C PRO A 23 4.895 -10.539 6.852 1.00 0.53 C ATOM 313 O PRO A 23 4.706 -11.712 6.574 1.00 -0.50 O ATOM 314 CB PRO A 23 4.884 -8.632 5.238 1.00 -0.12 C ATOM 315 CG PRO A 23 4.259 -9.397 4.051 1.00 -0.12 C ATOM 316 CD PRO A 23 5.443 -10.237 3.523 1.00 -0.01 C ATOM 317 HA PRO A 23 6.589 -9.217 6.471 1.00 0.05 H ATOM 318 HB2 PRO A 23 4.140 -8.178 5.906 1.00 0.06 H ATOM 319 HB3 PRO A 23 5.524 -7.828 4.848 1.00 0.06 H ATOM 320 HG2 PRO A 23 3.478 -10.079 4.429 1.00 0.06 H ATOM 321 HG3 PRO A 23 3.820 -8.735 3.289 1.00 0.06 H ATOM 322 HD2 PRO A 23 5.101 -11.154 3.016 1.00 0.06 H ATOM 323 HD3 PRO A 23 6.080 -9.653 2.843 1.00 0.06 H ATOM 324 N SER A 24 4.341 -9.956 7.939 1.00 -0.46 N ATOM 325 CA SER A 24 3.399 -10.722 8.755 1.00 0.04 C ATOM 326 C SER A 24 2.137 -10.970 7.955 1.00 0.62 C ATOM 327 O SER A 24 1.823 -10.165 7.091 1.00 -0.50 O ATOM 328 CB SER A 24 3.019 -9.997 10.075 1.00 0.02 C ATOM 329 OG SER A 24 4.151 -9.869 10.951 1.00 -0.55 O ATOM 330 H SER A 24 4.516 -8.995 8.158 1.00 0.25 H ATOM 331 HA SER A 24 3.865 -11.683 9.028 1.00 0.05 H ATOM 332 HB2 SER A 24 2.581 -9.008 9.858 1.00 0.12 H ATOM 333 HB3 SER A 24 2.267 -10.589 10.621 1.00 0.12 H ATOM 334 HG SER A 24 4.860 -9.352 10.584 1.00 0.31 H ATOM 335 N GLY A 25 1.383 -12.062 8.227 1.00 -0.46 N ATOM 336 CA GLY A 25 0.134 -12.289 7.496 1.00 0.04 C ATOM 337 C GLY A 25 -0.768 -11.077 7.548 1.00 0.62 C ATOM 338 O GLY A 25 -1.471 -10.816 6.584 1.00 -0.50 O ATOM 339 H GLY A 25 1.660 -12.724 8.927 1.00 0.25 H ATOM 340 HA2 GLY A 25 0.375 -12.529 6.448 1.00 0.03 H ATOM 341 HA3 GLY A 25 -0.423 -13.138 7.922 1.00 0.03 H ATOM 342 N GLN A 26 -0.749 -10.320 8.670 1.00 -0.46 N ATOM 343 CA GLN A 26 -1.537 -9.089 8.753 1.00 0.04 C ATOM 344 C GLN A 26 -1.369 -8.251 7.504 1.00 0.62 C ATOM 345 O GLN A 26 -2.344 -7.675 7.053 1.00 -0.50 O ATOM 346 CB GLN A 26 -1.109 -8.237 9.982 1.00 -0.10 C ATOM 347 CG GLN A 26 -2.057 -7.030 10.226 1.00 -0.10 C ATOM 348 CD GLN A 26 -1.612 -6.181 11.394 1.00 0.68 C ATOM 349 OE1 GLN A 26 -0.461 -6.253 11.791 1.00 -0.47 O ATOM 350 NE2 GLN A 26 -2.503 -5.349 11.970 1.00 -0.87 N ATOM 351 H GLN A 26 -0.209 -10.600 9.465 1.00 0.25 H ATOM 352 HA GLN A 26 -2.597 -9.378 8.861 1.00 0.05 H ATOM 353 HB2 GLN A 26 -1.129 -8.865 10.888 1.00 0.04 H ATOM 354 HB3 GLN A 26 -0.075 -7.889 9.827 1.00 0.04 H ATOM 355 HG2 GLN A 26 -2.088 -6.378 9.340 1.00 0.06 H ATOM 356 HG3 GLN A 26 -3.076 -7.406 10.413 1.00 0.06 H ATOM 357 HE21 GLN A 26 -3.449 -5.297 11.656 1.00 0.34 H ATOM 358 HE22 GLN A 26 -2.207 -4.778 12.737 1.00 0.34 H ATOM 359 N CYS A 27 -0.156 -8.162 6.911 1.00 -0.46 N ATOM 360 CA CYS A 27 -0.012 -7.403 5.667 1.00 0.04 C ATOM 361 C CYS A 27 -0.788 -8.049 4.538 1.00 0.62 C ATOM 362 O CYS A 27 -1.383 -7.314 3.765 1.00 -0.50 O ATOM 363 CB CYS A 27 1.470 -7.305 5.227 1.00 -0.10 C ATOM 364 SG CYS A 27 1.617 -6.440 3.627 1.00 0.82 S ATOM 365 H CYS A 27 0.640 -8.635 7.296 1.00 0.25 H ATOM 366 HA CYS A 27 -0.386 -6.379 5.834 1.00 0.05 H ATOM 367 HB2 CYS A 27 2.070 -6.794 5.994 1.00 0.05 H ATOM 368 HB3 CYS A 27 1.849 -8.325 5.086 1.00 0.05 H ATOM 369 N CYS A 28 -0.798 -9.395 4.389 1.00 -0.46 N ATOM 370 CA CYS A 28 -1.579 -9.980 3.299 1.00 0.04 C ATOM 371 C CYS A 28 -3.040 -9.658 3.513 1.00 0.62 C ATOM 372 O CYS A 28 -3.665 -9.161 2.589 1.00 -0.50 O ATOM 373 CB CYS A 28 -1.426 -11.508 3.085 1.00 -0.10 C ATOM 374 SG CYS A 28 -2.520 -11.926 1.676 1.00 0.82 S ATOM 375 H CYS A 28 -0.313 -9.997 5.025 1.00 0.25 H ATOM 376 HA CYS A 28 -1.232 -9.517 2.363 1.00 0.05 H ATOM 377 HB2 CYS A 28 -0.381 -11.757 2.842 1.00 0.05 H ATOM 378 HB3 CYS A 28 -1.736 -12.072 3.978 1.00 0.05 H ATOM 379 N ASP A 29 -3.607 -9.926 4.710 1.00 -0.46 N ATOM 380 CA ASP A 29 -4.997 -9.529 4.930 1.00 0.04 C ATOM 381 C ASP A 29 -5.088 -8.026 4.757 1.00 0.62 C ATOM 382 O ASP A 29 -6.093 -7.520 4.286 1.00 -0.50 O ATOM 383 CB ASP A 29 -5.543 -9.972 6.312 1.00 -0.40 C ATOM 384 CG ASP A 29 -7.041 -9.807 6.348 1.00 0.71 C ATOM 385 OD1 ASP A 29 -7.742 -10.436 5.507 1.00 -0.72 O ATOM 386 OD2 ASP A 29 -7.561 -9.043 7.203 1.00 -0.72 O ATOM 387 H ASP A 29 -3.082 -10.334 5.461 1.00 0.25 H ATOM 388 HA ASP A 29 -5.596 -10.025 4.149 1.00 0.05 H ATOM 389 HB2 ASP A 29 -5.320 -11.038 6.476 1.00 0.07 H ATOM 390 HB3 ASP A 29 -5.060 -9.388 7.112 1.00 0.07 H ATOM 391 N GLY A 30 -4.017 -7.281 5.104 1.00 -0.46 N ATOM 392 CA GLY A 30 -3.950 -5.869 4.751 1.00 0.04 C ATOM 393 C GLY A 30 -4.312 -5.699 3.297 1.00 0.62 C ATOM 394 O GLY A 30 -5.219 -4.933 3.029 1.00 -0.50 O ATOM 395 H GLY A 30 -3.240 -7.684 5.583 1.00 0.25 H ATOM 396 HA2 GLY A 30 -4.640 -5.300 5.389 1.00 0.03 H ATOM 397 HA3 GLY A 30 -2.939 -5.460 4.904 1.00 0.03 H ATOM 398 N VAL A 31 -3.655 -6.400 2.344 1.00 -0.46 N ATOM 399 CA VAL A 31 -4.007 -6.222 0.928 1.00 0.04 C ATOM 400 C VAL A 31 -5.517 -6.317 0.800 1.00 0.62 C ATOM 401 O VAL A 31 -6.134 -5.452 0.199 1.00 -0.50 O ATOM 402 CB VAL A 31 -3.404 -7.239 -0.092 1.00 -0.01 C ATOM 403 CG1 VAL A 31 -3.733 -6.795 -1.551 1.00 -0.09 C ATOM 404 CG2 VAL A 31 -1.864 -7.389 0.002 1.00 -0.09 C ATOM 405 H VAL A 31 -2.940 -7.040 2.622 1.00 0.25 H ATOM 406 HA VAL A 31 -3.654 -5.224 0.630 1.00 0.05 H ATOM 407 HB VAL A 31 -3.847 -8.226 0.109 1.00 0.02 H ATOM 408 HG11 VAL A 31 -3.222 -5.851 -1.791 1.00 0.03 H ATOM 409 HG12 VAL A 31 -3.389 -7.550 -2.272 1.00 0.03 H ATOM 410 HG13 VAL A 31 -4.809 -6.636 -1.704 1.00 0.03 H ATOM 411 HG21 VAL A 31 -1.506 -8.165 -0.691 1.00 0.03 H ATOM 412 HG22 VAL A 31 -1.428 -6.436 -0.293 1.00 0.03 H ATOM 413 HG23 VAL A 31 -1.492 -7.635 1.001 1.00 0.03 H ATOM 414 N LYS A 32 -6.124 -7.379 1.377 1.00 -0.46 N ATOM 415 CA LYS A 32 -7.582 -7.527 1.324 1.00 0.04 C ATOM 416 C LYS A 32 -8.268 -6.305 1.901 1.00 0.62 C ATOM 417 O LYS A 32 -9.157 -5.774 1.254 1.00 -0.50 O ATOM 418 CB LYS A 32 -8.008 -8.859 2.018 1.00 -0.10 C ATOM 419 CG LYS A 32 -9.522 -9.013 2.337 1.00 -0.16 C ATOM 420 CD LYS A 32 -10.003 -8.119 3.526 1.00 -0.18 C ATOM 421 CE LYS A 32 -10.949 -8.855 4.517 1.00 -0.04 C ATOM 422 NZ LYS A 32 -10.191 -9.706 5.468 1.00 -0.14 N ATOM 423 H LYS A 32 -5.578 -8.066 1.862 1.00 0.25 H ATOM 424 HA LYS A 32 -7.878 -7.599 0.263 1.00 0.05 H ATOM 425 HB2 LYS A 32 -7.689 -9.688 1.363 1.00 0.04 H ATOM 426 HB3 LYS A 32 -7.479 -8.992 2.969 1.00 0.04 H ATOM 427 HG2 LYS A 32 -10.115 -8.814 1.429 1.00 0.12 H ATOM 428 HG3 LYS A 32 -9.681 -10.073 2.596 1.00 0.12 H ATOM 429 HD2 LYS A 32 -9.155 -7.759 4.126 1.00 0.12 H ATOM 430 HD3 LYS A 32 -10.526 -7.237 3.118 1.00 0.12 H ATOM 431 HE2 LYS A 32 -11.512 -8.106 5.103 1.00 0.10 H ATOM 432 HE3 LYS A 32 -11.685 -9.450 3.949 1.00 0.10 H ATOM 433 HZ1 LYS A 32 -9.468 -10.367 5.005 1.00 0.29 H ATOM 434 HZ2 LYS A 32 -9.602 -9.122 6.163 1.00 0.29 H ATOM 435 HZ3 LYS A 32 -10.838 -10.324 6.076 1.00 0.29 H ATOM 436 N ASN A 33 -7.893 -5.827 3.109 1.00 -0.46 N ATOM 437 CA ASN A 33 -8.598 -4.683 3.694 1.00 0.04 C ATOM 438 C ASN A 33 -8.304 -3.434 2.889 1.00 0.62 C ATOM 439 O ASN A 33 -9.229 -2.783 2.433 1.00 -0.50 O ATOM 440 CB ASN A 33 -8.242 -4.490 5.190 1.00 -0.09 C ATOM 441 CG ASN A 33 -8.624 -5.711 5.991 1.00 0.68 C ATOM 442 OD1 ASN A 33 -9.808 -5.951 6.163 1.00 -0.47 O ATOM 443 ND2 ASN A 33 -7.665 -6.511 6.496 1.00 -0.87 N ATOM 444 H ASN A 33 -7.130 -6.248 3.604 1.00 0.25 H ATOM 445 HA ASN A 33 -9.680 -4.884 3.656 1.00 0.05 H ATOM 446 HB2 ASN A 33 -7.171 -4.271 5.282 1.00 0.04 H ATOM 447 HB3 ASN A 33 -8.800 -3.635 5.597 1.00 0.04 H ATOM 448 HD21 ASN A 33 -6.695 -6.342 6.346 1.00 0.34 H ATOM 449 HD22 ASN A 33 -7.927 -7.317 7.031 1.00 0.34 H ATOM 450 N LEU A 34 -7.011 -3.102 2.686 1.00 -0.46 N ATOM 451 CA LEU A 34 -6.624 -2.026 1.771 1.00 0.04 C ATOM 452 C LEU A 34 -7.532 -2.021 0.555 1.00 0.62 C ATOM 453 O LEU A 34 -8.214 -1.038 0.313 1.00 -0.50 O ATOM 454 CB LEU A 34 -5.147 -2.229 1.314 1.00 -0.06 C ATOM 455 CG LEU A 34 -4.076 -1.526 2.198 1.00 -0.01 C ATOM 456 CD1 LEU A 34 -4.139 -1.879 3.708 1.00 -0.11 C ATOM 457 CD2 LEU A 34 -2.655 -1.862 1.662 1.00 -0.11 C ATOM 458 H LEU A 34 -6.296 -3.632 3.135 1.00 0.25 H ATOM 459 HA LEU A 34 -6.723 -1.051 2.270 1.00 0.05 H ATOM 460 HB2 LEU A 34 -4.919 -3.296 1.230 1.00 0.03 H ATOM 461 HB3 LEU A 34 -5.036 -1.826 0.303 1.00 0.03 H ATOM 462 HG LEU A 34 -4.258 -0.442 2.116 1.00 0.03 H ATOM 463 HD11 LEU A 34 -5.124 -1.656 4.138 1.00 0.03 H ATOM 464 HD12 LEU A 34 -3.905 -2.938 3.878 1.00 0.03 H ATOM 465 HD13 LEU A 34 -3.393 -1.274 4.244 1.00 0.03 H ATOM 466 HD21 LEU A 34 -2.467 -2.945 1.720 1.00 0.03 H ATOM 467 HD22 LEU A 34 -2.533 -1.545 0.615 1.00 0.03 H ATOM 468 HD23 LEU A 34 -1.896 -1.351 2.270 1.00 0.03 H ATOM 469 N HIS A 35 -7.564 -3.126 -0.221 1.00 -0.46 N ATOM 470 CA HIS A 35 -8.443 -3.177 -1.389 1.00 0.04 C ATOM 471 C HIS A 35 -9.879 -2.917 -0.989 1.00 0.62 C ATOM 472 O HIS A 35 -10.551 -2.131 -1.640 1.00 -0.50 O ATOM 473 CB HIS A 35 -8.332 -4.558 -2.094 1.00 -0.10 C ATOM 474 CG HIS A 35 -9.327 -4.704 -3.217 1.00 0.06 C ATOM 475 ND1 HIS A 35 -10.597 -4.945 -3.066 1.00 -0.06 N ATOM 476 CD2 HIS A 35 -9.113 -4.627 -4.534 1.00 -0.04 C ATOM 477 CE1 HIS A 35 -11.215 -5.019 -4.207 1.00 0.11 C ATOM 478 NE2 HIS A 35 -10.277 -4.819 -5.085 1.00 -0.06 N ATOM 479 H HIS A 35 -6.997 -3.921 0.005 1.00 0.25 H ATOM 480 HA HIS A 35 -8.126 -2.393 -2.096 1.00 0.05 H ATOM 481 HB2 HIS A 35 -7.310 -4.678 -2.482 1.00 0.09 H ATOM 482 HB3 HIS A 35 -8.511 -5.371 -1.374 1.00 0.09 H ATOM 483 HD1 HIS A 35 -11.059 -5.072 -2.153 1.00 0.31 H ATOM 484 HD2 HIS A 35 -8.172 -4.443 -5.049 1.00 0.15 H ATOM 485 HE1 HIS A 35 -12.275 -5.208 -4.383 1.00 0.16 H ATOM 486 HE2 HIS A 35 -10.435 -4.817 -6.105 1.00 0.31 H ATOM 487 N ASN A 36 -10.374 -3.587 0.075 1.00 -0.46 N ATOM 488 CA ASN A 36 -11.775 -3.426 0.470 1.00 0.04 C ATOM 489 C ASN A 36 -12.121 -1.977 0.738 1.00 0.62 C ATOM 490 O ASN A 36 -13.210 -1.572 0.365 1.00 -0.50 O ATOM 491 CB ASN A 36 -12.103 -4.248 1.747 1.00 -0.09 C ATOM 492 CG ASN A 36 -13.574 -4.312 2.078 1.00 0.68 C ATOM 493 OD1 ASN A 36 -14.402 -3.910 1.279 1.00 -0.47 O ATOM 494 ND2 ASN A 36 -13.936 -4.833 3.268 1.00 -0.87 N ATOM 495 H ASN A 36 -9.790 -4.213 0.596 1.00 0.25 H ATOM 496 HA ASN A 36 -12.398 -3.804 -0.358 1.00 0.05 H ATOM 497 HB2 ASN A 36 -11.760 -5.285 1.617 1.00 0.04 H ATOM 498 HB3 ASN A 36 -11.576 -3.805 2.604 1.00 0.04 H ATOM 499 HD21 ASN A 36 -13.255 -5.168 3.920 1.00 0.34 H ATOM 500 HD22 ASN A 36 -14.907 -4.883 3.501 1.00 0.34 H ATOM 501 N GLN A 37 -11.219 -1.194 1.379 1.00 -0.46 N ATOM 502 CA GLN A 37 -11.521 0.201 1.712 1.00 0.04 C ATOM 503 C GLN A 37 -10.667 1.181 0.932 1.00 0.62 C ATOM 504 O GLN A 37 -10.299 2.218 1.459 1.00 -0.50 O ATOM 505 CB GLN A 37 -11.605 0.417 3.255 1.00 -0.10 C ATOM 506 CG GLN A 37 -10.581 -0.368 4.125 1.00 -0.10 C ATOM 507 CD GLN A 37 -9.119 -0.085 3.878 1.00 0.68 C ATOM 508 OE1 GLN A 37 -8.763 0.622 2.952 1.00 -0.47 O ATOM 509 NE2 GLN A 37 -8.226 -0.640 4.724 1.00 -0.87 N ATOM 510 H GLN A 37 -10.316 -1.550 1.630 1.00 0.25 H ATOM 511 HA GLN A 37 -12.517 0.492 1.338 1.00 0.05 H ATOM 512 HB2 GLN A 37 -11.544 1.492 3.486 1.00 0.04 H ATOM 513 HB3 GLN A 37 -12.600 0.070 3.589 1.00 0.04 H ATOM 514 HG2 GLN A 37 -10.781 -0.111 5.178 1.00 0.06 H ATOM 515 HG3 GLN A 37 -10.753 -1.449 4.018 1.00 0.06 H ATOM 516 HE21 GLN A 37 -8.517 -1.237 5.465 1.00 0.34 H ATOM 517 HE22 GLN A 37 -7.254 -0.453 4.609 1.00 0.34 H ATOM 518 N ALA A 38 -10.390 0.880 -0.360 1.00 -0.46 N ATOM 519 CA ALA A 38 -9.776 1.859 -1.261 1.00 0.04 C ATOM 520 C ALA A 38 -10.781 2.150 -2.354 1.00 0.62 C ATOM 521 O ALA A 38 -10.482 1.926 -3.517 1.00 -0.50 O ATOM 522 CB ALA A 38 -8.453 1.272 -1.807 1.00 -0.10 C ATOM 523 H ALA A 38 -10.658 -0.002 -0.753 1.00 0.25 H ATOM 524 HA ALA A 38 -9.534 2.812 -0.771 1.00 0.05 H ATOM 525 HB1 ALA A 38 -8.008 1.958 -2.541 1.00 0.04 H ATOM 526 HB2 ALA A 38 -7.747 1.139 -0.975 1.00 0.04 H ATOM 527 HB3 ALA A 38 -8.631 0.300 -2.291 1.00 0.04 H ATOM 528 N ARG A 39 -11.996 2.620 -1.976 1.00 -0.46 N ATOM 529 CA ARG A 39 -13.109 2.701 -2.927 1.00 0.04 C ATOM 530 C ARG A 39 -13.566 4.128 -3.162 1.00 0.62 C ATOM 531 O ARG A 39 -13.585 4.554 -4.305 1.00 -0.50 O ATOM 532 CB ARG A 39 -14.298 1.837 -2.418 1.00 -0.08 C ATOM 533 CG ARG A 39 -13.886 0.412 -1.943 1.00 -0.10 C ATOM 534 CD ARG A 39 -13.172 -0.473 -3.005 1.00 -0.23 C ATOM 535 NE ARG A 39 -13.999 -0.753 -4.183 1.00 -0.32 N ATOM 536 CZ ARG A 39 -13.569 -1.412 -5.237 1.00 0.76 C ATOM 537 NH1 ARG A 39 -12.358 -1.907 -5.321 1.00 -0.62 N ATOM 538 NH2 ARG A 39 -14.380 -1.588 -6.252 1.00 -0.62 N ATOM 539 H ARG A 39 -12.173 2.860 -1.017 1.00 0.25 H ATOM 540 HA ARG A 39 -12.823 2.293 -3.911 1.00 0.05 H ATOM 541 HB2 ARG A 39 -14.759 2.338 -1.551 1.00 0.06 H ATOM 542 HB3 ARG A 39 -15.067 1.781 -3.205 1.00 0.06 H ATOM 543 HG2 ARG A 39 -13.213 0.525 -1.079 1.00 0.07 H ATOM 544 HG3 ARG A 39 -14.786 -0.120 -1.592 1.00 0.07 H ATOM 545 HD2 ARG A 39 -12.236 0.028 -3.291 1.00 0.13 H ATOM 546 HD3 ARG A 39 -12.923 -1.431 -2.516 1.00 0.13 H ATOM 547 HE ARG A 39 -14.970 -0.407 -4.173 1.00 0.27 H ATOM 548 HH11 ARG A 39 -11.687 -1.813 -4.550 1.00 0.36 H ATOM 549 HH12 ARG A 39 -12.048 -2.406 -6.165 1.00 0.36 H ATOM 550 HH21 ARG A 39 -15.342 -1.219 -6.235 1.00 0.36 H ATOM 551 HH22 ARG A 39 -14.079 -2.099 -7.094 1.00 0.36 H ATOM 552 N SER A 40 -13.953 4.911 -2.131 1.00 -0.46 N ATOM 553 CA SER A 40 -14.392 6.283 -2.398 1.00 0.04 C ATOM 554 C SER A 40 -13.233 7.102 -2.923 1.00 0.62 C ATOM 555 O SER A 40 -12.094 6.743 -2.666 1.00 -0.50 O ATOM 556 CB SER A 40 -14.976 6.967 -1.133 1.00 0.02 C ATOM 557 OG SER A 40 -15.291 8.349 -1.381 1.00 -0.55 O ATOM 558 H SER A 40 -13.914 4.584 -1.184 1.00 0.25 H ATOM 559 HA SER A 40 -15.186 6.257 -3.162 1.00 0.05 H ATOM 560 HB2 SER A 40 -15.866 6.417 -0.781 1.00 0.12 H ATOM 561 HB3 SER A 40 -14.233 6.941 -0.324 1.00 0.12 H ATOM 562 HG SER A 40 -16.007 8.459 -1.999 1.00 0.31 H ATOM 563 N GLN A 41 -13.469 8.206 -3.670 1.00 -0.46 N ATOM 564 CA GLN A 41 -12.342 9.044 -4.088 1.00 0.04 C ATOM 565 C GLN A 41 -11.601 9.483 -2.842 1.00 0.62 C ATOM 566 O GLN A 41 -10.381 9.473 -2.832 1.00 -0.50 O ATOM 567 CB GLN A 41 -12.800 10.293 -4.891 1.00 -0.10 C ATOM 568 CG GLN A 41 -11.591 11.072 -5.483 1.00 -0.10 C ATOM 569 CD GLN A 41 -11.967 12.426 -6.037 1.00 0.68 C ATOM 570 OE1 GLN A 41 -11.412 13.420 -5.598 1.00 -0.47 O ATOM 571 NE2 GLN A 41 -12.899 12.517 -7.007 1.00 -0.87 N ATOM 572 H GLN A 41 -14.401 8.482 -3.908 1.00 0.25 H ATOM 573 HA GLN A 41 -11.683 8.438 -4.732 1.00 0.05 H ATOM 574 HB2 GLN A 41 -13.457 9.961 -5.711 1.00 0.04 H ATOM 575 HB3 GLN A 41 -13.381 10.957 -4.231 1.00 0.04 H ATOM 576 HG2 GLN A 41 -10.841 11.233 -4.695 1.00 0.06 H ATOM 577 HG3 GLN A 41 -11.114 10.483 -6.280 1.00 0.06 H ATOM 578 HE21 GLN A 41 -13.358 11.711 -7.375 1.00 0.34 H ATOM 579 HE22 GLN A 41 -13.137 13.420 -7.365 1.00 0.34 H ATOM 580 N SER A 42 -12.333 9.860 -1.770 1.00 -0.46 N ATOM 581 CA SER A 42 -11.666 10.235 -0.524 1.00 0.04 C ATOM 582 C SER A 42 -10.671 9.176 -0.104 1.00 0.62 C ATOM 583 O SER A 42 -9.553 9.518 0.244 1.00 -0.50 O ATOM 584 CB SER A 42 -12.679 10.420 0.636 1.00 0.02 C ATOM 585 OG SER A 42 -11.999 10.671 1.877 1.00 -0.55 O ATOM 586 H SER A 42 -13.334 9.885 -1.808 1.00 0.25 H ATOM 587 HA SER A 42 -11.138 11.189 -0.687 1.00 0.05 H ATOM 588 HB2 SER A 42 -13.376 11.243 0.405 1.00 0.12 H ATOM 589 HB3 SER A 42 -13.269 9.499 0.766 1.00 0.12 H ATOM 590 HG SER A 42 -11.462 11.457 1.859 1.00 0.31 H ATOM 591 N ASP A 43 -11.048 7.879 -0.140 1.00 -0.46 N ATOM 592 CA ASP A 43 -10.109 6.835 0.269 1.00 0.04 C ATOM 593 C ASP A 43 -8.865 6.929 -0.589 1.00 0.62 C ATOM 594 O ASP A 43 -7.759 6.881 -0.074 1.00 -0.50 O ATOM 595 CB ASP A 43 -10.700 5.408 0.113 1.00 -0.40 C ATOM 596 CG ASP A 43 -12.071 5.228 0.703 1.00 0.71 C ATOM 597 OD1 ASP A 43 -12.447 6.012 1.613 1.00 -0.72 O ATOM 598 OD2 ASP A 43 -12.790 4.300 0.235 1.00 -0.72 O ATOM 599 H ASP A 43 -11.959 7.617 -0.450 1.00 0.25 H ATOM 600 HA ASP A 43 -9.856 7.005 1.330 1.00 0.05 H ATOM 601 HB2 ASP A 43 -10.762 5.144 -0.954 1.00 0.07 H ATOM 602 HB3 ASP A 43 -10.026 4.699 0.613 1.00 0.07 H ATOM 603 N ARG A 44 -9.045 7.073 -1.921 1.00 -0.46 N ATOM 604 CA ARG A 44 -7.889 7.182 -2.810 1.00 0.04 C ATOM 605 C ARG A 44 -7.059 8.382 -2.411 1.00 0.62 C ATOM 606 O ARG A 44 -5.851 8.247 -2.294 1.00 -0.50 O ATOM 607 CB ARG A 44 -8.305 7.311 -4.306 1.00 -0.08 C ATOM 608 CG ARG A 44 -8.424 5.953 -5.044 1.00 -0.10 C ATOM 609 CD ARG A 44 -9.416 4.940 -4.424 1.00 -0.23 C ATOM 610 NE ARG A 44 -10.768 5.292 -4.857 1.00 -0.32 N ATOM 611 CZ ARG A 44 -11.248 5.048 -6.058 1.00 0.76 C ATOM 612 NH1 ARG A 44 -10.574 4.433 -7.003 1.00 -0.62 N ATOM 613 NH2 ARG A 44 -12.466 5.438 -6.348 1.00 -0.62 N ATOM 614 H ARG A 44 -9.971 7.126 -2.303 1.00 0.25 H ATOM 615 HA ARG A 44 -7.257 6.287 -2.692 1.00 0.05 H ATOM 616 HB2 ARG A 44 -9.229 7.896 -4.417 1.00 0.06 H ATOM 617 HB3 ARG A 44 -7.509 7.856 -4.835 1.00 0.06 H ATOM 618 HG2 ARG A 44 -8.708 6.175 -6.078 1.00 0.07 H ATOM 619 HG3 ARG A 44 -7.422 5.510 -5.061 1.00 0.07 H ATOM 620 HD2 ARG A 44 -9.175 3.899 -4.684 1.00 0.13 H ATOM 621 HD3 ARG A 44 -9.324 4.968 -3.330 1.00 0.13 H ATOM 622 HE ARG A 44 -11.370 5.762 -4.164 1.00 0.27 H ATOM 623 HH11 ARG A 44 -9.614 4.105 -6.854 1.00 0.36 H ATOM 624 HH12 ARG A 44 -10.991 4.258 -7.929 1.00 0.36 H ATOM 625 HH21 ARG A 44 -13.054 5.905 -5.640 1.00 0.36 H ATOM 626 HH22 ARG A 44 -12.883 5.273 -7.278 1.00 0.36 H ATOM 627 N GLN A 45 -7.669 9.570 -2.208 1.00 -0.46 N ATOM 628 CA GLN A 45 -6.871 10.728 -1.808 1.00 0.04 C ATOM 629 C GLN A 45 -6.157 10.428 -0.509 1.00 0.62 C ATOM 630 O GLN A 45 -4.942 10.539 -0.449 1.00 -0.50 O ATOM 631 CB GLN A 45 -7.712 12.027 -1.646 1.00 -0.10 C ATOM 632 CG GLN A 45 -8.163 12.616 -3.011 1.00 -0.10 C ATOM 633 CD GLN A 45 -7.037 13.206 -3.829 1.00 0.68 C ATOM 634 OE1 GLN A 45 -5.901 13.255 -3.384 1.00 -0.47 O ATOM 635 NE2 GLN A 45 -7.325 13.664 -5.063 1.00 -0.87 N ATOM 636 H GLN A 45 -8.663 9.655 -2.304 1.00 0.25 H ATOM 637 HA GLN A 45 -6.102 10.891 -2.575 1.00 0.05 H ATOM 638 HB2 GLN A 45 -8.600 11.806 -1.033 1.00 0.04 H ATOM 639 HB3 GLN A 45 -7.125 12.793 -1.113 1.00 0.04 H ATOM 640 HG2 GLN A 45 -8.662 11.830 -3.596 1.00 0.06 H ATOM 641 HG3 GLN A 45 -8.891 13.422 -2.830 1.00 0.06 H ATOM 642 HE21 GLN A 45 -8.255 13.623 -5.426 1.00 0.34 H ATOM 643 HE22 GLN A 45 -6.597 14.060 -5.621 1.00 0.34 H ATOM 644 N SER A 46 -6.903 10.041 0.545 1.00 -0.46 N ATOM 645 CA SER A 46 -6.275 9.760 1.831 1.00 0.04 C ATOM 646 C SER A 46 -5.122 8.796 1.682 1.00 0.62 C ATOM 647 O SER A 46 -4.031 9.094 2.141 1.00 -0.50 O ATOM 648 CB SER A 46 -7.318 9.159 2.808 1.00 0.02 C ATOM 649 OG SER A 46 -8.382 10.088 3.070 1.00 -0.55 O ATOM 650 H SER A 46 -7.899 9.960 0.468 1.00 0.25 H ATOM 651 HA SER A 46 -5.899 10.709 2.252 1.00 0.05 H ATOM 652 HB2 SER A 46 -7.776 8.258 2.372 1.00 0.12 H ATOM 653 HB3 SER A 46 -6.819 8.864 3.739 1.00 0.12 H ATOM 654 HG SER A 46 -8.087 10.890 3.489 1.00 0.31 H ATOM 655 N ALA A 47 -5.335 7.625 1.045 1.00 -0.46 N ATOM 656 CA ALA A 47 -4.244 6.663 0.924 1.00 0.04 C ATOM 657 C ALA A 47 -3.133 7.223 0.066 1.00 0.62 C ATOM 658 O ALA A 47 -1.991 7.237 0.498 1.00 -0.50 O ATOM 659 CB ALA A 47 -4.724 5.329 0.307 1.00 -0.10 C ATOM 660 H ALA A 47 -6.229 7.406 0.650 1.00 0.25 H ATOM 661 HA ALA A 47 -3.853 6.442 1.932 1.00 0.05 H ATOM 662 HB1 ALA A 47 -5.468 4.847 0.961 1.00 0.04 H ATOM 663 HB2 ALA A 47 -5.171 5.473 -0.689 1.00 0.04 H ATOM 664 HB3 ALA A 47 -3.843 4.681 0.212 1.00 0.04 H ATOM 665 N CYS A 48 -3.442 7.696 -1.162 1.00 -0.46 N ATOM 666 CA CYS A 48 -2.394 8.252 -2.016 1.00 0.04 C ATOM 667 C CYS A 48 -1.556 9.232 -1.228 1.00 0.62 C ATOM 668 O CYS A 48 -0.339 9.149 -1.254 1.00 -0.50 O ATOM 669 CB CYS A 48 -3.004 9.029 -3.214 1.00 -0.10 C ATOM 670 SG CYS A 48 -1.668 9.831 -4.155 1.00 0.82 S ATOM 671 H CYS A 48 -4.386 7.673 -1.496 1.00 0.25 H ATOM 672 HA CYS A 48 -1.764 7.427 -2.387 1.00 0.05 H ATOM 673 HB2 CYS A 48 -3.571 8.353 -3.873 1.00 0.05 H ATOM 674 HB3 CYS A 48 -3.683 9.819 -2.863 1.00 0.05 H ATOM 675 N ASN A 49 -2.216 10.180 -0.535 1.00 -0.46 N ATOM 676 CA ASN A 49 -1.479 11.214 0.184 1.00 0.04 C ATOM 677 C ASN A 49 -0.721 10.580 1.330 1.00 0.62 C ATOM 678 O ASN A 49 0.426 10.937 1.554 1.00 -0.50 O ATOM 679 CB ASN A 49 -2.467 12.322 0.635 1.00 -0.09 C ATOM 680 CG ASN A 49 -3.235 12.871 -0.549 1.00 0.68 C ATOM 681 OD1 ASN A 49 -2.888 12.591 -1.688 1.00 -0.47 O ATOM 682 ND2 ASN A 49 -4.299 13.666 -0.327 1.00 -0.87 N ATOM 683 H ASN A 49 -3.218 10.176 -0.493 1.00 0.25 H ATOM 684 HA ASN A 49 -0.752 11.672 -0.507 1.00 0.05 H ATOM 685 HB2 ASN A 49 -3.175 11.901 1.367 1.00 0.04 H ATOM 686 HB3 ASN A 49 -1.914 13.143 1.117 1.00 0.04 H ATOM 687 HD21 ASN A 49 -4.588 13.896 0.603 1.00 0.34 H ATOM 688 HD22 ASN A 49 -4.812 14.027 -1.106 1.00 0.34 H ATOM 689 N CYS A 50 -1.330 9.610 2.051 1.00 -0.46 N ATOM 690 CA CYS A 50 -0.585 8.895 3.087 1.00 0.04 C ATOM 691 C CYS A 50 0.702 8.382 2.485 1.00 0.62 C ATOM 692 O CYS A 50 1.745 8.573 3.088 1.00 -0.50 O ATOM 693 CB CYS A 50 -1.382 7.693 3.667 1.00 -0.10 C ATOM 694 SG CYS A 50 -0.662 6.978 5.189 1.00 0.82 S ATOM 695 H CYS A 50 -2.281 9.355 1.867 1.00 0.25 H ATOM 696 HA CYS A 50 -0.370 9.612 3.896 1.00 0.05 H ATOM 697 HB2 CYS A 50 -2.413 7.993 3.896 1.00 0.05 H ATOM 698 HB3 CYS A 50 -1.435 6.876 2.934 1.00 0.05 H ATOM 699 N LEU A 51 0.661 7.739 1.296 1.00 -0.46 N ATOM 700 CA LEU A 51 1.900 7.225 0.712 1.00 0.04 C ATOM 701 C LEU A 51 2.834 8.343 0.323 1.00 0.62 C ATOM 702 O LEU A 51 4.029 8.206 0.539 1.00 -0.50 O ATOM 703 CB LEU A 51 1.714 6.367 -0.568 1.00 -0.06 C ATOM 704 CG LEU A 51 1.431 4.873 -0.260 1.00 -0.01 C ATOM 705 CD1 LEU A 51 0.024 4.693 0.362 1.00 -0.11 C ATOM 706 CD2 LEU A 51 1.567 4.036 -1.558 1.00 -0.11 C ATOM 707 H LEU A 51 -0.203 7.624 0.800 1.00 0.25 H ATOM 708 HA LEU A 51 2.400 6.621 1.481 1.00 0.05 H ATOM 709 HB2 LEU A 51 0.936 6.797 -1.217 1.00 0.03 H ATOM 710 HB3 LEU A 51 2.656 6.395 -1.133 1.00 0.03 H ATOM 711 HG LEU A 51 2.182 4.490 0.449 1.00 0.03 H ATOM 712 HD11 LEU A 51 -0.141 3.628 0.544 1.00 0.03 H ATOM 713 HD12 LEU A 51 -0.057 5.213 1.328 1.00 0.03 H ATOM 714 HD13 LEU A 51 -0.758 5.059 -0.320 1.00 0.03 H ATOM 715 HD21 LEU A 51 1.283 2.991 -1.377 1.00 0.03 H ATOM 716 HD22 LEU A 51 0.909 4.471 -2.320 1.00 0.03 H ATOM 717 HD23 LEU A 51 2.597 4.041 -1.944 1.00 0.03 H ATOM 718 N LYS A 52 2.321 9.445 -0.270 1.00 -0.46 N ATOM 719 CA LYS A 52 3.223 10.542 -0.616 1.00 0.04 C ATOM 720 C LYS A 52 4.010 10.898 0.631 1.00 0.62 C ATOM 721 O LYS A 52 5.176 11.242 0.517 1.00 -0.50 O ATOM 722 CB LYS A 52 2.513 11.759 -1.272 1.00 -0.10 C ATOM 723 CG LYS A 52 1.925 11.394 -2.669 1.00 -0.16 C ATOM 724 CD LYS A 52 1.142 12.555 -3.346 1.00 -0.18 C ATOM 725 CE LYS A 52 2.007 13.791 -3.727 1.00 -0.04 C ATOM 726 NZ LYS A 52 3.134 13.457 -4.633 1.00 -0.14 N ATOM 727 H LYS A 52 1.337 9.528 -0.435 1.00 0.25 H ATOM 728 HA LYS A 52 3.936 10.154 -1.357 1.00 0.05 H ATOM 729 HB2 LYS A 52 1.725 12.124 -0.597 1.00 0.04 H ATOM 730 HB3 LYS A 52 3.262 12.557 -1.390 1.00 0.04 H ATOM 731 HG2 LYS A 52 2.724 11.039 -3.338 1.00 0.12 H ATOM 732 HG3 LYS A 52 1.222 10.557 -2.557 1.00 0.12 H ATOM 733 HD2 LYS A 52 0.677 12.168 -4.270 1.00 0.12 H ATOM 734 HD3 LYS A 52 0.328 12.877 -2.673 1.00 0.12 H ATOM 735 HE2 LYS A 52 1.346 14.516 -4.235 1.00 0.10 H ATOM 736 HE3 LYS A 52 2.387 14.285 -2.817 1.00 0.10 H ATOM 737 HZ1 LYS A 52 3.597 14.345 -5.044 1.00 0.29 H ATOM 738 HZ2 LYS A 52 3.932 12.926 -4.135 1.00 0.29 H ATOM 739 HZ3 LYS A 52 2.824 12.849 -5.473 1.00 0.29 H ATOM 740 N GLY A 53 3.406 10.773 1.837 1.00 -0.46 N ATOM 741 CA GLY A 53 4.201 10.845 3.062 1.00 0.04 C ATOM 742 C GLY A 53 5.043 9.600 3.274 1.00 0.62 C ATOM 743 O GLY A 53 6.251 9.727 3.393 1.00 -0.50 O ATOM 744 H GLY A 53 2.428 10.564 1.917 1.00 0.25 H ATOM 745 HA2 GLY A 53 4.844 11.740 3.037 1.00 0.03 H ATOM 746 HA3 GLY A 53 3.540 10.946 3.938 1.00 0.03 H ATOM 747 N ILE A 54 4.437 8.388 3.352 1.00 -0.46 N ATOM 748 CA ILE A 54 5.196 7.183 3.708 1.00 0.04 C ATOM 749 C ILE A 54 5.900 6.630 2.479 1.00 0.62 C ATOM 750 O ILE A 54 7.035 7.024 2.267 1.00 -0.50 O ATOM 751 CB ILE A 54 4.371 6.128 4.522 1.00 -0.01 C ATOM 752 CG1 ILE A 54 3.964 6.625 5.948 1.00 -0.05 C ATOM 753 CG2 ILE A 54 5.180 4.808 4.714 1.00 -0.09 C ATOM 754 CD1 ILE A 54 3.011 7.846 5.986 1.00 -0.09 C ATOM 755 H ILE A 54 3.459 8.303 3.171 1.00 0.25 H ATOM 756 HA ILE A 54 5.997 7.467 4.412 1.00 0.05 H ATOM 757 HB ILE A 54 3.449 5.889 3.966 1.00 0.02 H ATOM 758 HG12 ILE A 54 3.441 5.803 6.466 1.00 0.03 H ATOM 759 HG13 ILE A 54 4.865 6.867 6.535 1.00 0.03 H ATOM 760 HG21 ILE A 54 5.517 4.369 3.767 1.00 0.03 H ATOM 761 HG22 ILE A 54 6.068 5.002 5.332 1.00 0.03 H ATOM 762 HG23 ILE A 54 4.565 4.049 5.223 1.00 0.03 H ATOM 763 HD11 ILE A 54 2.675 8.028 7.020 1.00 0.03 H ATOM 764 HD12 ILE A 54 3.509 8.760 5.633 1.00 0.03 H ATOM 765 HD13 ILE A 54 2.126 7.646 5.370 1.00 0.03 H ATOM 766 N ALA A 55 5.311 5.722 1.659 1.00 -0.46 N ATOM 767 CA ALA A 55 6.086 5.037 0.616 1.00 0.04 C ATOM 768 C ALA A 55 7.029 5.954 -0.126 1.00 0.62 C ATOM 769 O ALA A 55 8.195 5.627 -0.275 1.00 -0.50 O ATOM 770 CB ALA A 55 5.193 4.387 -0.474 1.00 -0.10 C ATOM 771 H ALA A 55 4.375 5.420 1.813 1.00 0.25 H ATOM 772 HA ALA A 55 6.666 4.237 1.107 1.00 0.05 H ATOM 773 HB1 ALA A 55 5.806 3.845 -1.209 1.00 0.04 H ATOM 774 HB2 ALA A 55 4.476 3.679 -0.039 1.00 0.04 H ATOM 775 HB3 ALA A 55 4.637 5.163 -1.014 1.00 0.04 H ATOM 776 N ARG A 56 6.540 7.116 -0.607 1.00 -0.46 N ATOM 777 CA ARG A 56 7.418 7.982 -1.394 1.00 0.04 C ATOM 778 C ARG A 56 8.530 8.499 -0.504 1.00 0.62 C ATOM 779 O ARG A 56 9.668 8.560 -0.943 1.00 -0.50 O ATOM 780 CB ARG A 56 6.603 9.123 -2.062 1.00 -0.08 C ATOM 781 CG ARG A 56 7.307 9.729 -3.305 1.00 -0.10 C ATOM 782 CD ARG A 56 6.421 10.819 -3.979 1.00 -0.23 C ATOM 783 NE ARG A 56 6.702 10.887 -5.419 1.00 -0.32 N ATOM 784 CZ ARG A 56 6.292 9.987 -6.291 1.00 0.76 C ATOM 785 NH1 ARG A 56 5.588 8.935 -5.958 1.00 -0.62 N ATOM 786 NH2 ARG A 56 6.599 10.136 -7.556 1.00 -0.62 N ATOM 787 H ARG A 56 5.596 7.396 -0.410 1.00 0.25 H ATOM 788 HA ARG A 56 7.855 7.361 -2.194 1.00 0.05 H ATOM 789 HB2 ARG A 56 5.647 8.696 -2.407 1.00 0.06 H ATOM 790 HB3 ARG A 56 6.395 9.908 -1.320 1.00 0.06 H ATOM 791 HG2 ARG A 56 8.284 10.152 -3.018 1.00 0.07 H ATOM 792 HG3 ARG A 56 7.506 8.918 -4.023 1.00 0.07 H ATOM 793 HD2 ARG A 56 5.343 10.666 -3.813 1.00 0.13 H ATOM 794 HD3 ARG A 56 6.652 11.786 -3.497 1.00 0.13 H ATOM 795 HE ARG A 56 7.251 11.695 -5.754 1.00 0.27 H ATOM 796 HH11 ARG A 56 5.293 8.757 -4.994 1.00 0.36 H ATOM 797 HH12 ARG A 56 5.308 8.242 -6.666 1.00 0.36 H ATOM 798 HH21 ARG A 56 7.155 10.940 -7.881 1.00 0.36 H ATOM 799 HH22 ARG A 56 6.288 9.450 -8.263 1.00 0.36 H ATOM 800 N GLY A 57 8.223 8.858 0.765 1.00 -0.46 N ATOM 801 CA GLY A 57 9.278 9.251 1.700 1.00 0.04 C ATOM 802 C GLY A 57 10.166 8.099 2.125 1.00 0.62 C ATOM 803 O GLY A 57 11.294 8.360 2.516 1.00 -0.50 O ATOM 804 H GLY A 57 7.281 8.810 1.108 1.00 0.25 H ATOM 805 HA2 GLY A 57 9.896 10.037 1.237 1.00 0.03 H ATOM 806 HA3 GLY A 57 8.840 9.675 2.617 1.00 0.03 H ATOM 807 N ILE A 58 9.709 6.824 2.081 1.00 -0.46 N ATOM 808 CA ILE A 58 10.591 5.706 2.431 1.00 0.04 C ATOM 809 C ILE A 58 11.693 5.683 1.390 1.00 0.62 C ATOM 810 O ILE A 58 11.567 4.973 0.405 1.00 -0.50 O ATOM 811 CB ILE A 58 9.851 4.329 2.529 1.00 -0.01 C ATOM 812 CG1 ILE A 58 8.740 4.290 3.628 1.00 -0.05 C ATOM 813 CG2 ILE A 58 10.839 3.142 2.733 1.00 -0.09 C ATOM 814 CD1 ILE A 58 9.249 4.307 5.095 1.00 -0.09 C ATOM 815 H ILE A 58 8.781 6.631 1.765 1.00 0.25 H ATOM 816 HA ILE A 58 11.046 5.893 3.415 1.00 0.05 H ATOM 817 HB ILE A 58 9.348 4.163 1.562 1.00 0.02 H ATOM 818 HG12 ILE A 58 8.059 5.141 3.503 1.00 0.03 H ATOM 819 HG13 ILE A 58 8.143 3.373 3.489 1.00 0.03 H ATOM 820 HG21 ILE A 58 11.456 2.967 1.845 1.00 0.03 H ATOM 821 HG22 ILE A 58 11.520 3.329 3.576 1.00 0.03 H ATOM 822 HG23 ILE A 58 10.281 2.211 2.920 1.00 0.03 H ATOM 823 HD11 ILE A 58 9.908 3.454 5.301 1.00 0.03 H ATOM 824 HD12 ILE A 58 9.791 5.237 5.320 1.00 0.03 H ATOM 825 HD13 ILE A 58 8.396 4.237 5.787 1.00 0.03 H ATOM 826 N HIS A 59 12.801 6.442 1.568 1.00 -0.46 N ATOM 827 CA HIS A 59 13.918 6.390 0.612 1.00 0.04 C ATOM 828 C HIS A 59 14.726 5.110 0.750 1.00 0.62 C ATOM 829 O HIS A 59 15.929 5.176 0.942 1.00 -0.50 O ATOM 830 CB HIS A 59 14.809 7.655 0.766 1.00 -0.10 C ATOM 831 CG HIS A 59 15.512 7.785 2.098 1.00 0.06 C ATOM 832 ND1 HIS A 59 16.290 8.781 2.407 1.00 -0.06 N ATOM 833 CD2 HIS A 59 15.496 6.977 3.164 1.00 -0.04 C ATOM 834 CE1 HIS A 59 16.777 8.663 3.606 1.00 0.11 C ATOM 835 NE2 HIS A 59 16.270 7.547 4.041 1.00 -0.06 N ATOM 836 H HIS A 59 12.854 7.057 2.357 1.00 0.25 H ATOM 837 HA HIS A 59 13.514 6.409 -0.416 1.00 0.05 H ATOM 838 HB2 HIS A 59 15.579 7.655 -0.022 1.00 0.09 H ATOM 839 HB3 HIS A 59 14.177 8.548 0.627 1.00 0.09 H ATOM 840 HD1 HIS A 59 16.497 9.570 1.776 1.00 0.31 H ATOM 841 HD2 HIS A 59 14.960 6.036 3.296 1.00 0.15 H ATOM 842 HE1 HIS A 59 17.454 9.343 4.127 1.00 0.16 H ATOM 843 HE2 HIS A 59 16.462 7.157 4.978 1.00 0.31 H ATOM 844 N ASN A 60 14.064 3.935 0.653 1.00 -0.46 N ATOM 845 CA ASN A 60 14.700 2.638 0.920 1.00 0.04 C ATOM 846 C ASN A 60 13.627 1.584 0.706 1.00 0.62 C ATOM 847 O ASN A 60 13.245 0.910 1.649 1.00 -0.50 O ATOM 848 CB ASN A 60 15.268 2.562 2.369 1.00 -0.09 C ATOM 849 CG ASN A 60 16.073 1.301 2.593 1.00 0.68 C ATOM 850 OD1 ASN A 60 17.291 1.374 2.626 1.00 -0.47 O ATOM 851 ND2 ASN A 60 15.444 0.119 2.751 1.00 -0.87 N ATOM 852 H ASN A 60 13.105 3.950 0.371 1.00 0.25 H ATOM 853 HA ASN A 60 15.519 2.477 0.199 1.00 0.05 H ATOM 854 HB2 ASN A 60 15.934 3.412 2.572 1.00 0.04 H ATOM 855 HB3 ASN A 60 14.445 2.621 3.099 1.00 0.04 H ATOM 856 HD21 ASN A 60 14.446 0.056 2.715 1.00 0.34 H ATOM 857 HD22 ASN A 60 15.982 -0.711 2.894 1.00 0.34 H ATOM 858 N LEU A 61 13.095 1.479 -0.532 1.00 -0.46 N ATOM 859 CA LEU A 61 11.885 0.690 -0.770 1.00 0.04 C ATOM 860 C LEU A 61 12.205 -0.363 -1.809 1.00 0.62 C ATOM 861 O LEU A 61 12.370 -0.002 -2.963 1.00 -0.50 O ATOM 862 CB LEU A 61 10.778 1.691 -1.215 1.00 -0.06 C ATOM 863 CG LEU A 61 9.331 1.126 -1.117 1.00 -0.01 C ATOM 864 CD1 LEU A 61 8.283 2.233 -1.413 1.00 -0.11 C ATOM 865 CD2 LEU A 61 9.111 -0.072 -2.077 1.00 -0.11 C ATOM 866 H LEU A 61 13.469 2.003 -1.301 1.00 0.25 H ATOM 867 HA LEU A 61 11.522 0.207 0.150 1.00 0.05 H ATOM 868 HB2 LEU A 61 10.833 2.560 -0.541 1.00 0.03 H ATOM 869 HB3 LEU A 61 10.979 2.056 -2.235 1.00 0.03 H ATOM 870 HG LEU A 61 9.157 0.804 -0.079 1.00 0.03 H ATOM 871 HD11 LEU A 61 7.267 1.835 -1.271 1.00 0.03 H ATOM 872 HD12 LEU A 61 8.416 3.080 -0.724 1.00 0.03 H ATOM 873 HD13 LEU A 61 8.382 2.599 -2.446 1.00 0.03 H ATOM 874 HD21 LEU A 61 9.402 0.226 -3.092 1.00 0.03 H ATOM 875 HD22 LEU A 61 9.702 -0.948 -1.775 1.00 0.03 H ATOM 876 HD23 LEU A 61 8.055 -0.374 -2.094 1.00 0.03 H ATOM 877 N ASN A 62 12.301 -1.664 -1.444 1.00 -0.46 N ATOM 878 CA ASN A 62 12.596 -2.686 -2.451 1.00 0.04 C ATOM 879 C ASN A 62 11.355 -2.910 -3.292 1.00 0.62 C ATOM 880 O ASN A 62 10.678 -3.912 -3.123 1.00 -0.50 O ATOM 881 CB ASN A 62 13.120 -3.975 -1.758 1.00 -0.09 C ATOM 882 CG ASN A 62 13.599 -5.008 -2.749 1.00 0.68 C ATOM 883 OD1 ASN A 62 13.241 -4.949 -3.914 1.00 -0.47 O ATOM 884 ND2 ASN A 62 14.417 -5.987 -2.312 1.00 -0.87 N ATOM 885 H ASN A 62 12.136 -1.955 -0.498 1.00 0.25 H ATOM 886 HA ASN A 62 13.412 -2.335 -3.106 1.00 0.05 H ATOM 887 HB2 ASN A 62 13.961 -3.695 -1.104 1.00 0.04 H ATOM 888 HB3 ASN A 62 12.330 -4.415 -1.132 1.00 0.04 H ATOM 889 HD21 ASN A 62 14.697 -6.045 -1.354 1.00 0.34 H ATOM 890 HD22 ASN A 62 14.758 -6.665 -2.965 1.00 0.34 H ATOM 891 N GLU A 63 11.032 -1.966 -4.207 1.00 -0.46 N ATOM 892 CA GLU A 63 9.793 -2.070 -4.978 1.00 0.04 C ATOM 893 C GLU A 63 9.643 -3.396 -5.694 1.00 0.62 C ATOM 894 O GLU A 63 8.536 -3.909 -5.770 1.00 -0.50 O ATOM 895 CB GLU A 63 9.624 -0.902 -5.992 1.00 -0.18 C ATOM 896 CG GLU A 63 10.652 -0.928 -7.156 1.00 -0.40 C ATOM 897 CD GLU A 63 10.375 0.193 -8.124 1.00 0.71 C ATOM 898 OE1 GLU A 63 9.361 0.088 -8.870 1.00 -0.72 O ATOM 899 OE2 GLU A 63 11.159 1.178 -8.161 1.00 -0.72 O ATOM 900 H GLU A 63 11.605 -1.151 -4.320 1.00 0.25 H ATOM 901 HA GLU A 63 8.972 -1.983 -4.251 1.00 0.05 H ATOM 902 HB2 GLU A 63 8.608 -0.966 -6.409 1.00 0.09 H ATOM 903 HB3 GLU A 63 9.710 0.067 -5.477 1.00 0.09 H ATOM 904 HG2 GLU A 63 11.677 -0.832 -6.767 1.00 0.07 H ATOM 905 HG3 GLU A 63 10.588 -1.871 -7.717 1.00 0.07 H ATOM 906 N ASP A 64 10.736 -3.976 -6.238 1.00 -0.46 N ATOM 907 CA ASP A 64 10.594 -5.235 -6.965 1.00 0.04 C ATOM 908 C ASP A 64 10.167 -6.321 -6.001 1.00 0.62 C ATOM 909 O ASP A 64 9.163 -6.976 -6.237 1.00 -0.50 O ATOM 910 CB ASP A 64 11.906 -5.612 -7.700 1.00 -0.40 C ATOM 911 CG ASP A 64 11.698 -6.891 -8.464 1.00 0.71 C ATOM 912 OD1 ASP A 64 11.181 -6.816 -9.611 1.00 -0.72 O ATOM 913 OD2 ASP A 64 12.040 -7.973 -7.917 1.00 -0.72 O ATOM 914 H ASP A 64 11.643 -3.560 -6.147 1.00 0.25 H ATOM 915 HA ASP A 64 9.812 -5.109 -7.734 1.00 0.05 H ATOM 916 HB2 ASP A 64 12.183 -4.810 -8.402 1.00 0.07 H ATOM 917 HB3 ASP A 64 12.733 -5.739 -6.984 1.00 0.07 H ATOM 918 N ASN A 65 10.909 -6.517 -4.887 1.00 -0.46 N ATOM 919 CA ASN A 65 10.492 -7.524 -3.912 1.00 0.04 C ATOM 920 C ASN A 65 9.071 -7.225 -3.486 1.00 0.62 C ATOM 921 O ASN A 65 8.240 -8.118 -3.485 1.00 -0.50 O ATOM 922 CB ASN A 65 11.417 -7.517 -2.664 1.00 -0.09 C ATOM 923 CG ASN A 65 11.082 -8.583 -1.652 1.00 0.68 C ATOM 924 OD1 ASN A 65 10.487 -9.584 -2.016 1.00 -0.47 O ATOM 925 ND2 ASN A 65 11.461 -8.410 -0.368 1.00 -0.87 N ATOM 926 H ASN A 65 11.727 -5.964 -4.712 1.00 0.25 H ATOM 927 HA ASN A 65 10.540 -8.515 -4.394 1.00 0.05 H ATOM 928 HB2 ASN A 65 12.449 -7.704 -2.991 1.00 0.04 H ATOM 929 HB3 ASN A 65 11.369 -6.529 -2.185 1.00 0.04 H ATOM 930 HD21 ASN A 65 11.948 -7.588 -0.075 1.00 0.34 H ATOM 931 HD22 ASN A 65 11.256 -9.118 0.308 1.00 0.34 H ATOM 932 N ALA A 66 8.777 -5.955 -3.129 1.00 -0.46 N ATOM 933 CA ALA A 66 7.435 -5.604 -2.666 1.00 0.04 C ATOM 934 C ALA A 66 6.360 -6.096 -3.612 1.00 0.62 C ATOM 935 O ALA A 66 5.381 -6.653 -3.138 1.00 -0.50 O ATOM 936 CB ALA A 66 7.292 -4.070 -2.533 1.00 -0.10 C ATOM 937 H ALA A 66 9.482 -5.242 -3.156 1.00 0.25 H ATOM 938 HA ALA A 66 7.288 -6.056 -1.670 1.00 0.05 H ATOM 939 HB1 ALA A 66 6.308 -3.819 -2.122 1.00 0.04 H ATOM 940 HB2 ALA A 66 8.074 -3.667 -1.873 1.00 0.04 H ATOM 941 HB3 ALA A 66 7.381 -3.599 -3.518 1.00 0.04 H ATOM 942 N ARG A 67 6.519 -5.909 -4.945 1.00 -0.46 N ATOM 943 CA ARG A 67 5.502 -6.409 -5.877 1.00 0.04 C ATOM 944 C ARG A 67 5.144 -7.855 -5.591 1.00 0.62 C ATOM 945 O ARG A 67 4.017 -8.226 -5.873 1.00 -0.50 O ATOM 946 CB ARG A 67 5.889 -6.303 -7.390 1.00 -0.08 C ATOM 947 CG ARG A 67 5.192 -5.129 -8.143 1.00 -0.10 C ATOM 948 CD ARG A 67 5.804 -3.726 -7.865 1.00 -0.23 C ATOM 949 NE ARG A 67 7.077 -3.551 -8.578 1.00 -0.32 N ATOM 950 CZ ARG A 67 7.622 -2.385 -8.852 1.00 0.76 C ATOM 951 NH1 ARG A 67 7.124 -1.243 -8.447 1.00 -0.62 N ATOM 952 NH2 ARG A 67 8.719 -2.356 -9.570 1.00 -0.62 N ATOM 953 H ARG A 67 7.325 -5.430 -5.303 1.00 0.25 H ATOM 954 HA ARG A 67 4.587 -5.826 -5.683 1.00 0.05 H ATOM 955 HB2 ARG A 67 6.981 -6.268 -7.511 1.00 0.06 H ATOM 956 HB3 ARG A 67 5.550 -7.215 -7.912 1.00 0.06 H ATOM 957 HG2 ARG A 67 5.257 -5.301 -9.232 1.00 0.07 H ATOM 958 HG3 ARG A 67 4.118 -5.137 -7.888 1.00 0.07 H ATOM 959 HD2 ARG A 67 5.052 -3.017 -8.251 1.00 0.13 H ATOM 960 HD3 ARG A 67 5.932 -3.567 -6.782 1.00 0.13 H ATOM 961 HE ARG A 67 7.542 -4.403 -8.926 1.00 0.27 H ATOM 962 HH11 ARG A 67 6.285 -1.198 -7.862 1.00 0.36 H ATOM 963 HH12 ARG A 67 7.590 -0.349 -8.684 1.00 0.36 H ATOM 964 HH21 ARG A 67 9.164 -3.220 -9.910 1.00 0.36 H ATOM 965 HH22 ARG A 67 9.167 -1.458 -9.811 1.00 0.36 H ATOM 966 N SER A 68 6.054 -8.699 -5.058 1.00 -0.46 N ATOM 967 CA SER A 68 5.692 -10.094 -4.790 1.00 0.04 C ATOM 968 C SER A 68 4.585 -10.248 -3.763 1.00 0.62 C ATOM 969 O SER A 68 3.897 -11.255 -3.797 1.00 -0.50 O ATOM 970 CB SER A 68 6.926 -10.895 -4.304 1.00 0.02 C ATOM 971 OG SER A 68 6.597 -12.294 -4.237 1.00 -0.55 O ATOM 972 H SER A 68 6.985 -8.387 -4.859 1.00 0.25 H ATOM 973 HA SER A 68 5.360 -10.547 -5.740 1.00 0.05 H ATOM 974 HB2 SER A 68 7.760 -10.745 -5.012 1.00 0.12 H ATOM 975 HB3 SER A 68 7.226 -10.520 -3.313 1.00 0.12 H ATOM 976 HG SER A 68 7.332 -12.834 -3.962 1.00 0.31 H ATOM 977 N ILE A 69 4.377 -9.298 -2.822 1.00 -0.46 N ATOM 978 CA ILE A 69 3.346 -9.496 -1.793 1.00 0.04 C ATOM 979 C ILE A 69 1.964 -9.776 -2.370 1.00 0.62 C ATOM 980 O ILE A 69 1.431 -10.815 -2.011 1.00 -0.50 O ATOM 981 CB ILE A 69 3.328 -8.371 -0.709 1.00 -0.01 C ATOM 982 CG1 ILE A 69 4.611 -8.446 0.173 1.00 -0.05 C ATOM 983 CG2 ILE A 69 2.044 -8.470 0.170 1.00 -0.09 C ATOM 984 CD1 ILE A 69 4.903 -7.123 0.929 1.00 -0.09 C ATOM 985 H ILE A 69 4.943 -8.471 -2.803 1.00 0.25 H ATOM 986 HA ILE A 69 3.638 -10.410 -1.249 1.00 0.05 H ATOM 987 HB ILE A 69 3.333 -7.396 -1.217 1.00 0.02 H ATOM 988 HG12 ILE A 69 4.507 -9.278 0.886 1.00 0.03 H ATOM 989 HG13 ILE A 69 5.492 -8.661 -0.451 1.00 0.03 H ATOM 990 HG21 ILE A 69 1.992 -9.456 0.656 1.00 0.03 H ATOM 991 HG22 ILE A 69 2.025 -7.700 0.952 1.00 0.03 H ATOM 992 HG23 ILE A 69 1.135 -8.333 -0.432 1.00 0.03 H ATOM 993 HD11 ILE A 69 5.166 -6.339 0.204 1.00 0.03 H ATOM 994 HD12 ILE A 69 4.058 -6.776 1.537 1.00 0.03 H ATOM 995 HD13 ILE A 69 5.754 -7.265 1.605 1.00 0.03 H ATOM 996 N PRO A 70 1.306 -8.931 -3.208 1.00 -0.23 N ATOM 997 CA PRO A 70 -0.019 -9.284 -3.706 1.00 0.04 C ATOM 998 C PRO A 70 -0.153 -10.659 -4.351 1.00 0.53 C ATOM 999 O PRO A 70 -0.994 -11.404 -3.868 1.00 -0.50 O ATOM 1000 CB PRO A 70 -0.370 -8.047 -4.581 1.00 -0.12 C ATOM 1001 CG PRO A 70 0.934 -7.220 -4.739 1.00 -0.12 C ATOM 1002 CD PRO A 70 1.786 -7.591 -3.503 1.00 -0.01 C ATOM 1003 HA PRO A 70 -0.687 -9.284 -2.827 1.00 0.05 H ATOM 1004 HB2 PRO A 70 -0.817 -8.321 -5.550 1.00 0.06 H ATOM 1005 HB3 PRO A 70 -1.090 -7.413 -4.037 1.00 0.06 H ATOM 1006 HG2 PRO A 70 1.466 -7.512 -5.655 1.00 0.06 H ATOM 1007 HG3 PRO A 70 0.747 -6.136 -4.809 1.00 0.06 H ATOM 1008 HD2 PRO A 70 2.859 -7.505 -3.713 1.00 0.06 H ATOM 1009 HD3 PRO A 70 1.514 -6.934 -2.665 1.00 0.06 H ATOM 1010 N PRO A 71 0.607 -11.104 -5.389 1.00 -0.23 N ATOM 1011 CA PRO A 71 0.521 -12.498 -5.817 1.00 0.04 C ATOM 1012 C PRO A 71 1.202 -13.309 -4.739 1.00 0.53 C ATOM 1013 O PRO A 71 1.368 -12.755 -3.667 1.00 -0.50 O ATOM 1014 CB PRO A 71 1.315 -12.408 -7.145 1.00 -0.12 C ATOM 1015 CG PRO A 71 2.395 -11.352 -6.829 1.00 -0.12 C ATOM 1016 CD PRO A 71 1.609 -10.282 -6.036 1.00 -0.01 C ATOM 1017 HA PRO A 71 -0.511 -12.846 -5.978 1.00 0.05 H ATOM 1018 HB2 PRO A 71 1.738 -13.365 -7.487 1.00 0.06 H ATOM 1019 HB3 PRO A 71 0.655 -12.014 -7.936 1.00 0.06 H ATOM 1020 HG2 PRO A 71 3.159 -11.823 -6.188 1.00 0.06 H ATOM 1021 HG3 PRO A 71 2.888 -10.947 -7.728 1.00 0.06 H ATOM 1022 HD2 PRO A 71 2.264 -9.770 -5.323 1.00 0.06 H ATOM 1023 HD3 PRO A 71 1.126 -9.577 -6.729 1.00 0.06 H ATOM 1024 N LYS A 72 1.594 -14.589 -4.922 1.00 -0.46 N ATOM 1025 CA LYS A 72 2.186 -15.342 -3.806 1.00 0.04 C ATOM 1026 C LYS A 72 1.132 -15.514 -2.726 1.00 0.62 C ATOM 1027 O LYS A 72 0.634 -16.618 -2.570 1.00 -0.50 O ATOM 1028 CB LYS A 72 3.535 -14.729 -3.317 1.00 -0.10 C ATOM 1029 CG LYS A 72 4.157 -15.515 -2.131 1.00 -0.16 C ATOM 1030 CD LYS A 72 5.567 -14.986 -1.728 1.00 -0.18 C ATOM 1031 CE LYS A 72 5.629 -13.502 -1.254 1.00 -0.04 C ATOM 1032 NZ LYS A 72 4.750 -13.214 -0.096 1.00 -0.14 N ATOM 1033 H LYS A 72 1.441 -15.051 -5.797 1.00 0.25 H ATOM 1034 HA LYS A 72 2.438 -16.355 -4.169 1.00 0.05 H ATOM 1035 HB2 LYS A 72 4.238 -14.720 -4.166 1.00 0.04 H ATOM 1036 HB3 LYS A 72 3.401 -13.692 -2.993 1.00 0.04 H ATOM 1037 HG2 LYS A 72 3.479 -15.488 -1.263 1.00 0.12 H ATOM 1038 HG3 LYS A 72 4.261 -16.571 -2.433 1.00 0.12 H ATOM 1039 HD2 LYS A 72 5.956 -15.626 -0.918 1.00 0.12 H ATOM 1040 HD3 LYS A 72 6.244 -15.102 -2.592 1.00 0.12 H ATOM 1041 HE2 LYS A 72 6.675 -13.284 -0.972 1.00 0.10 H ATOM 1042 HE3 LYS A 72 5.376 -12.819 -2.080 1.00 0.10 H ATOM 1043 HZ1 LYS A 72 3.701 -13.239 -0.359 1.00 0.29 H ATOM 1044 HZ2 LYS A 72 4.914 -13.908 0.717 1.00 0.29 H ATOM 1045 HZ3 LYS A 72 4.933 -12.223 0.298 1.00 0.29 H ATOM 1046 N CYS A 73 0.736 -14.459 -1.975 1.00 -0.46 N ATOM 1047 CA CYS A 73 -0.426 -14.588 -1.097 1.00 0.04 C ATOM 1048 C CYS A 73 -1.669 -14.768 -1.949 1.00 0.62 C ATOM 1049 O CYS A 73 -2.493 -15.597 -1.596 1.00 -0.50 O ATOM 1050 CB CYS A 73 -0.606 -13.353 -0.177 1.00 -0.10 C ATOM 1051 SG CYS A 73 -1.890 -13.751 1.057 1.00 0.82 S ATOM 1052 H CYS A 73 1.159 -13.557 -2.086 1.00 0.25 H ATOM 1053 HA CYS A 73 -0.275 -15.473 -0.454 1.00 0.05 H ATOM 1054 HB2 CYS A 73 0.330 -13.126 0.357 1.00 0.05 H ATOM 1055 HB3 CYS A 73 -0.898 -12.472 -0.770 1.00 0.05 H ATOM 1056 N GLY A 74 -1.817 -14.005 -3.060 1.00 -0.46 N ATOM 1057 CA GLY A 74 -2.930 -14.219 -3.993 1.00 0.04 C ATOM 1058 C GLY A 74 -4.041 -13.201 -3.848 1.00 0.62 C ATOM 1059 O GLY A 74 -5.175 -13.593 -3.628 1.00 -0.50 O ATOM 1060 H GLY A 74 -1.155 -13.283 -3.278 1.00 0.25 H ATOM 1061 HA2 GLY A 74 -2.554 -14.141 -5.025 1.00 0.03 H ATOM 1062 HA3 GLY A 74 -3.347 -15.235 -3.891 1.00 0.03 H ATOM 1063 N VAL A 75 -3.735 -11.888 -3.978 1.00 -0.46 N ATOM 1064 CA VAL A 75 -4.752 -10.840 -3.816 1.00 0.04 C ATOM 1065 C VAL A 75 -4.174 -9.514 -4.288 1.00 0.62 C ATOM 1066 O VAL A 75 -2.957 -9.434 -4.310 1.00 -0.50 O ATOM 1067 CB VAL A 75 -5.218 -10.821 -2.328 1.00 -0.01 C ATOM 1068 CG1 VAL A 75 -3.998 -10.763 -1.368 1.00 -0.09 C ATOM 1069 CG2 VAL A 75 -6.236 -9.686 -2.036 1.00 -0.09 C ATOM 1070 H VAL A 75 -2.789 -11.608 -4.161 1.00 0.25 H ATOM 1071 HA VAL A 75 -5.611 -11.069 -4.467 1.00 0.05 H ATOM 1072 HB VAL A 75 -5.751 -11.761 -2.106 1.00 0.02 H ATOM 1073 HG11 VAL A 75 -4.337 -10.668 -0.326 1.00 0.03 H ATOM 1074 HG12 VAL A 75 -3.394 -11.681 -1.447 1.00 0.03 H ATOM 1075 HG13 VAL A 75 -3.352 -9.911 -1.615 1.00 0.03 H ATOM 1076 HG21 VAL A 75 -5.775 -8.704 -2.181 1.00 0.03 H ATOM 1077 HG22 VAL A 75 -7.107 -9.770 -2.704 1.00 0.03 H ATOM 1078 HG23 VAL A 75 -6.592 -9.745 -0.996 1.00 0.03 H ATOM 1079 N ASN A 76 -4.956 -8.479 -4.690 1.00 -0.46 N ATOM 1080 CA ASN A 76 -4.347 -7.274 -5.274 1.00 0.04 C ATOM 1081 C ASN A 76 -5.115 -5.998 -4.990 1.00 0.62 C ATOM 1082 O ASN A 76 -6.204 -6.084 -4.447 1.00 -0.50 O ATOM 1083 CB ASN A 76 -4.226 -7.526 -6.800 1.00 -0.09 C ATOM 1084 CG ASN A 76 -5.605 -7.597 -7.408 1.00 0.68 C ATOM 1085 OD1 ASN A 76 -6.151 -8.684 -7.510 1.00 -0.47 O ATOM 1086 ND2 ASN A 76 -6.210 -6.461 -7.811 1.00 -0.87 N ATOM 1087 H ASN A 76 -5.955 -8.547 -4.688 1.00 0.25 H ATOM 1088 HA ASN A 76 -3.344 -7.104 -4.856 1.00 0.05 H ATOM 1089 HB2 ASN A 76 -3.641 -6.735 -7.293 1.00 0.04 H ATOM 1090 HB3 ASN A 76 -3.696 -8.478 -6.969 1.00 0.04 H ATOM 1091 HD21 ASN A 76 -5.767 -5.566 -7.739 1.00 0.34 H ATOM 1092 HD22 ASN A 76 -7.126 -6.518 -8.207 1.00 0.34 H ATOM 1093 N LEU A 77 -4.554 -4.816 -5.358 1.00 -0.46 N ATOM 1094 CA LEU A 77 -5.236 -3.533 -5.145 1.00 0.04 C ATOM 1095 C LEU A 77 -5.922 -3.070 -6.416 1.00 0.62 C ATOM 1096 O LEU A 77 -5.611 -3.669 -7.435 1.00 -0.50 O ATOM 1097 CB LEU A 77 -4.207 -2.444 -4.735 1.00 -0.06 C ATOM 1098 CG LEU A 77 -3.388 -2.801 -3.462 1.00 -0.01 C ATOM 1099 CD1 LEU A 77 -2.407 -1.630 -3.167 1.00 -0.11 C ATOM 1100 CD2 LEU A 77 -4.294 -3.097 -2.236 1.00 -0.11 C ATOM 1101 H LEU A 77 -3.668 -4.795 -5.824 1.00 0.25 H ATOM 1102 HA LEU A 77 -5.981 -3.649 -4.352 1.00 0.05 H ATOM 1103 HB2 LEU A 77 -3.511 -2.290 -5.577 1.00 0.03 H ATOM 1104 HB3 LEU A 77 -4.724 -1.490 -4.561 1.00 0.03 H ATOM 1105 HG LEU A 77 -2.808 -3.716 -3.662 1.00 0.03 H ATOM 1106 HD11 LEU A 77 -1.656 -1.545 -3.968 1.00 0.03 H ATOM 1107 HD12 LEU A 77 -2.949 -0.677 -3.119 1.00 0.03 H ATOM 1108 HD13 LEU A 77 -1.883 -1.773 -2.212 1.00 0.03 H ATOM 1109 HD21 LEU A 77 -3.687 -3.196 -1.325 1.00 0.03 H ATOM 1110 HD22 LEU A 77 -5.020 -2.288 -2.091 1.00 0.03 H ATOM 1111 HD23 LEU A 77 -4.847 -4.037 -2.360 1.00 0.03 H ATOM 1112 N PRO A 78 -6.834 -2.056 -6.458 1.00 -0.23 N ATOM 1113 CA PRO A 78 -7.432 -1.681 -7.731 1.00 0.04 C ATOM 1114 C PRO A 78 -6.534 -0.809 -8.604 1.00 0.53 C ATOM 1115 O PRO A 78 -6.899 -0.653 -9.758 1.00 -0.50 O ATOM 1116 CB PRO A 78 -8.751 -1.010 -7.238 1.00 -0.12 C ATOM 1117 CG PRO A 78 -8.786 -1.191 -5.700 1.00 -0.12 C ATOM 1118 CD PRO A 78 -7.306 -1.326 -5.288 1.00 -0.01 C ATOM 1119 HA PRO A 78 -7.695 -2.590 -8.298 1.00 0.05 H ATOM 1120 HB2 PRO A 78 -8.766 0.064 -7.441 1.00 0.06 H ATOM 1121 HB3 PRO A 78 -9.650 -1.443 -7.709 1.00 0.06 H ATOM 1122 HG2 PRO A 78 -9.297 -0.374 -5.167 1.00 0.06 H ATOM 1123 HG3 PRO A 78 -9.306 -2.132 -5.474 1.00 0.06 H ATOM 1124 HD2 PRO A 78 -6.819 -0.340 -5.242 1.00 0.06 H ATOM 1125 HD3 PRO A 78 -7.240 -1.819 -4.311 1.00 0.06 H ATOM 1126 N TYR A 79 -5.384 -0.233 -8.151 1.00 -0.46 N ATOM 1127 CA TYR A 79 -4.517 0.558 -9.052 1.00 0.04 C ATOM 1128 C TYR A 79 -3.038 0.484 -8.688 1.00 0.62 C ATOM 1129 O TYR A 79 -2.710 -0.023 -7.627 1.00 -0.50 O ATOM 1130 CB TYR A 79 -5.003 2.032 -9.210 1.00 -0.10 C ATOM 1131 CG TYR A 79 -5.475 2.617 -7.876 1.00 -0.03 C ATOM 1132 CD1 TYR A 79 -6.711 2.204 -7.378 1.00 0.00 C ATOM 1133 CD2 TYR A 79 -4.728 3.545 -7.146 1.00 0.00 C ATOM 1134 CE1 TYR A 79 -7.050 2.434 -6.046 1.00 -0.26 C ATOM 1135 CE2 TYR A 79 -5.138 3.897 -5.855 1.00 -0.26 C ATOM 1136 CZ TYR A 79 -6.247 3.272 -5.271 1.00 0.46 C ATOM 1137 OH TYR A 79 -6.577 3.500 -3.938 1.00 -0.53 O ATOM 1138 H TYR A 79 -5.098 -0.325 -7.195 1.00 0.25 H ATOM 1139 HA TYR A 79 -4.539 0.089 -10.050 1.00 0.05 H ATOM 1140 HB2 TYR A 79 -4.230 2.686 -9.643 1.00 0.04 H ATOM 1141 HB3 TYR A 79 -5.861 2.055 -9.901 1.00 0.04 H ATOM 1142 HD1 TYR A 79 -7.402 1.712 -8.046 1.00 0.06 H ATOM 1143 HD2 TYR A 79 -3.841 3.997 -7.578 1.00 0.06 H ATOM 1144 HE1 TYR A 79 -7.931 1.968 -5.613 1.00 0.10 H ATOM 1145 HE2 TYR A 79 -4.597 4.658 -5.304 1.00 0.10 H ATOM 1146 HH TYR A 79 -5.820 3.406 -3.365 1.00 0.33 H ATOM 1147 N THR A 80 -2.130 0.969 -9.578 1.00 -0.46 N ATOM 1148 CA THR A 80 -0.683 0.770 -9.403 1.00 0.04 C ATOM 1149 C THR A 80 -0.115 1.429 -8.165 1.00 0.62 C ATOM 1150 O THR A 80 0.800 0.865 -7.587 1.00 -0.50 O ATOM 1151 CB THR A 80 0.147 1.262 -10.627 1.00 0.17 C ATOM 1152 OG1 THR A 80 -0.136 2.639 -10.932 1.00 -0.55 O ATOM 1153 CG2 THR A 80 -0.146 0.430 -11.904 1.00 -0.19 C ATOM 1154 H THR A 80 -2.434 1.424 -10.416 1.00 0.25 H ATOM 1155 HA THR A 80 -0.512 -0.315 -9.301 1.00 0.05 H ATOM 1156 HB THR A 80 1.225 1.143 -10.412 1.00 0.08 H ATOM 1157 HG1 THR A 80 0.139 3.241 -10.249 1.00 0.31 H ATOM 1158 HG21 THR A 80 0.482 0.796 -12.731 1.00 0.07 H ATOM 1159 HG22 THR A 80 0.084 -0.634 -11.737 1.00 0.07 H ATOM 1160 HG23 THR A 80 -1.197 0.517 -12.212 1.00 0.07 H ATOM 1161 N ILE A 81 -0.633 2.599 -7.723 1.00 -0.46 N ATOM 1162 CA ILE A 81 -0.211 3.156 -6.428 1.00 0.04 C ATOM 1163 C ILE A 81 1.238 3.637 -6.402 1.00 0.62 C ATOM 1164 O ILE A 81 2.019 3.261 -7.262 1.00 -0.50 O ATOM 1165 CB ILE A 81 -0.647 2.138 -5.314 1.00 -0.01 C ATOM 1166 CG1 ILE A 81 -1.954 2.555 -4.570 1.00 -0.05 C ATOM 1167 CG2 ILE A 81 0.511 1.704 -4.377 1.00 -0.09 C ATOM 1168 CD1 ILE A 81 -1.813 3.738 -3.575 1.00 -0.09 C ATOM 1169 H ILE A 81 -1.369 3.049 -8.234 1.00 0.25 H ATOM 1170 HA ILE A 81 -0.777 4.091 -6.288 1.00 0.05 H ATOM 1171 HB ILE A 81 -0.944 1.193 -5.802 1.00 0.02 H ATOM 1172 HG12 ILE A 81 -2.703 2.819 -5.331 1.00 0.03 H ATOM 1173 HG13 ILE A 81 -2.353 1.690 -4.017 1.00 0.03 H ATOM 1174 HG21 ILE A 81 1.328 1.271 -4.976 1.00 0.03 H ATOM 1175 HG22 ILE A 81 0.915 2.550 -3.814 1.00 0.03 H ATOM 1176 HG23 ILE A 81 0.166 0.941 -3.662 1.00 0.03 H ATOM 1177 HD11 ILE A 81 -1.166 3.453 -2.736 1.00 0.03 H ATOM 1178 HD12 ILE A 81 -1.404 4.638 -4.053 1.00 0.03 H ATOM 1179 HD13 ILE A 81 -2.802 3.995 -3.165 1.00 0.03 H ATOM 1180 N SER A 82 1.629 4.506 -5.433 1.00 -0.46 N ATOM 1181 CA SER A 82 2.966 5.124 -5.436 1.00 0.04 C ATOM 1182 C SER A 82 4.119 4.209 -5.063 1.00 0.62 C ATOM 1183 O SER A 82 4.801 4.510 -4.095 1.00 -0.50 O ATOM 1184 CB SER A 82 3.002 6.373 -4.501 1.00 0.02 C ATOM 1185 OG SER A 82 4.279 7.041 -4.515 1.00 -0.55 O ATOM 1186 H SER A 82 0.977 4.798 -4.736 1.00 0.25 H ATOM 1187 HA SER A 82 3.182 5.494 -6.451 1.00 0.05 H ATOM 1188 HB2 SER A 82 2.248 7.115 -4.800 1.00 0.12 H ATOM 1189 HB3 SER A 82 2.759 6.062 -3.476 1.00 0.12 H ATOM 1190 HG SER A 82 4.976 6.482 -4.177 1.00 0.31 H ATOM 1191 N LEU A 83 4.405 3.128 -5.823 1.00 -0.46 N ATOM 1192 CA LEU A 83 5.691 2.432 -5.683 1.00 0.04 C ATOM 1193 C LEU A 83 6.507 2.802 -6.907 1.00 0.62 C ATOM 1194 O LEU A 83 6.657 1.987 -7.803 1.00 -0.50 O ATOM 1195 CB LEU A 83 5.536 0.896 -5.484 1.00 -0.06 C ATOM 1196 CG LEU A 83 5.480 0.473 -3.985 1.00 -0.01 C ATOM 1197 CD1 LEU A 83 4.207 0.988 -3.260 1.00 -0.11 C ATOM 1198 CD2 LEU A 83 5.586 -1.069 -3.854 1.00 -0.11 C ATOM 1199 H LEU A 83 3.800 2.860 -6.576 1.00 0.25 H ATOM 1200 HA LEU A 83 6.287 2.799 -4.831 1.00 0.05 H ATOM 1201 HB2 LEU A 83 4.662 0.518 -6.038 1.00 0.03 H ATOM 1202 HB3 LEU A 83 6.436 0.417 -5.900 1.00 0.03 H ATOM 1203 HG LEU A 83 6.362 0.895 -3.474 1.00 0.03 H ATOM 1204 HD11 LEU A 83 4.129 2.082 -3.320 1.00 0.03 H ATOM 1205 HD12 LEU A 83 3.309 0.542 -3.710 1.00 0.03 H ATOM 1206 HD13 LEU A 83 4.236 0.711 -2.195 1.00 0.03 H ATOM 1207 HD21 LEU A 83 6.461 -1.451 -4.400 1.00 0.03 H ATOM 1208 HD22 LEU A 83 5.707 -1.335 -2.795 1.00 0.03 H ATOM 1209 HD23 LEU A 83 4.685 -1.558 -4.255 1.00 0.03 H ATOM 1210 N ASN A 84 7.025 4.055 -6.933 1.00 -0.46 N ATOM 1211 CA ASN A 84 7.804 4.563 -8.070 1.00 0.04 C ATOM 1212 C ASN A 84 6.939 5.085 -9.204 1.00 0.62 C ATOM 1213 O ASN A 84 7.421 5.164 -10.322 1.00 -0.50 O ATOM 1214 CB ASN A 84 8.924 3.584 -8.525 1.00 -0.09 C ATOM 1215 CG ASN A 84 10.063 4.239 -9.275 1.00 0.68 C ATOM 1216 OD1 ASN A 84 10.011 5.421 -9.572 1.00 -0.47 O ATOM 1217 ND2 ASN A 84 11.134 3.486 -9.597 1.00 -0.87 N ATOM 1218 H ASN A 84 6.858 4.679 -6.164 1.00 0.25 H ATOM 1219 HA ASN A 84 8.331 5.462 -7.705 1.00 0.05 H ATOM 1220 HB2 ASN A 84 9.347 3.110 -7.626 1.00 0.04 H ATOM 1221 HB3 ASN A 84 8.507 2.800 -9.174 1.00 0.04 H ATOM 1222 HD21 ASN A 84 11.182 2.521 -9.326 1.00 0.34 H ATOM 1223 HD22 ASN A 84 11.896 3.897 -10.096 1.00 0.34 H ATOM 1224 N ILE A 85 5.670 5.480 -8.932 1.00 -0.46 N ATOM 1225 CA ILE A 85 4.855 6.209 -9.915 1.00 0.04 C ATOM 1226 C ILE A 85 4.222 7.318 -9.083 1.00 0.62 C ATOM 1227 O ILE A 85 4.990 7.943 -8.365 1.00 -0.50 O ATOM 1228 CB ILE A 85 3.864 5.287 -10.706 1.00 -0.01 C ATOM 1229 CG1 ILE A 85 4.431 3.873 -11.054 1.00 -0.05 C ATOM 1230 CG2 ILE A 85 3.447 5.994 -12.032 1.00 -0.09 C ATOM 1231 CD1 ILE A 85 4.284 2.840 -9.904 1.00 -0.09 C ATOM 1232 H ILE A 85 5.279 5.340 -8.021 1.00 0.25 H ATOM 1233 HA ILE A 85 5.518 6.713 -10.636 1.00 0.05 H ATOM 1234 HB ILE A 85 2.969 5.098 -10.092 1.00 0.02 H ATOM 1235 HG12 ILE A 85 3.870 3.447 -11.903 1.00 0.03 H ATOM 1236 HG13 ILE A 85 5.481 3.957 -11.371 1.00 0.03 H ATOM 1237 HG21 ILE A 85 4.294 5.996 -12.737 1.00 0.03 H ATOM 1238 HG22 ILE A 85 2.605 5.465 -12.504 1.00 0.03 H ATOM 1239 HG23 ILE A 85 3.145 7.039 -11.874 1.00 0.03 H ATOM 1240 HD11 ILE A 85 3.221 2.661 -9.680 1.00 0.03 H ATOM 1241 HD12 ILE A 85 4.742 1.881 -10.193 1.00 0.03 H ATOM 1242 HD13 ILE A 85 4.767 3.186 -8.987 1.00 0.03 H ATOM 1243 N ASP A 86 2.893 7.584 -9.060 1.00 -0.46 N ATOM 1244 CA ASP A 86 2.313 8.313 -7.930 1.00 0.04 C ATOM 1245 C ASP A 86 0.945 7.722 -7.643 1.00 0.62 C ATOM 1246 O ASP A 86 0.854 6.880 -6.763 1.00 -0.50 O ATOM 1247 CB ASP A 86 2.363 9.859 -8.070 1.00 -0.40 C ATOM 1248 CG ASP A 86 1.812 10.533 -6.835 1.00 0.71 C ATOM 1249 OD1 ASP A 86 0.618 10.297 -6.499 1.00 -0.72 O ATOM 1250 OD2 ASP A 86 2.560 11.307 -6.174 1.00 -0.72 O ATOM 1251 H ASP A 86 2.254 7.221 -9.733 1.00 0.25 H ATOM 1252 HA ASP A 86 2.902 8.095 -7.024 1.00 0.05 H ATOM 1253 HB2 ASP A 86 3.411 10.167 -8.213 1.00 0.07 H ATOM 1254 HB3 ASP A 86 1.800 10.196 -8.951 1.00 0.07 H ATOM 1255 N CYS A 87 -0.144 8.105 -8.350 1.00 -0.46 N ATOM 1256 CA CYS A 87 -1.467 7.608 -7.966 1.00 0.04 C ATOM 1257 C CYS A 87 -2.489 7.609 -9.086 1.00 0.62 C ATOM 1258 O CYS A 87 -3.029 6.548 -9.353 1.00 -0.50 O ATOM 1259 CB CYS A 87 -2.006 8.486 -6.809 1.00 -0.10 C ATOM 1260 SG CYS A 87 -0.984 8.318 -5.313 1.00 0.82 S ATOM 1261 H CYS A 87 -0.067 8.762 -9.098 1.00 0.25 H ATOM 1262 HA CYS A 87 -1.398 6.568 -7.602 1.00 0.05 H ATOM 1263 HB2 CYS A 87 -1.989 9.544 -7.106 1.00 0.05 H ATOM 1264 HB3 CYS A 87 -3.037 8.197 -6.550 1.00 0.05 H ATOM 1265 N SER A 88 -2.807 8.766 -9.718 1.00 -0.46 N ATOM 1266 CA SER A 88 -3.970 8.816 -10.611 1.00 0.04 C ATOM 1267 C SER A 88 -5.150 8.344 -9.791 1.00 0.62 C ATOM 1268 O SER A 88 -5.610 7.228 -9.974 1.00 -0.50 O ATOM 1269 CB SER A 88 -3.760 8.000 -11.914 1.00 0.02 C ATOM 1270 OG SER A 88 -4.885 8.167 -12.795 1.00 -0.55 O ATOM 1271 H SER A 88 -2.317 9.619 -9.530 1.00 0.25 H ATOM 1272 HA SER A 88 -4.165 9.856 -10.927 1.00 0.05 H ATOM 1273 HB2 SER A 88 -2.869 8.390 -12.432 1.00 0.12 H ATOM 1274 HB3 SER A 88 -3.595 6.930 -11.714 1.00 0.12 H ATOM 1275 HG SER A 88 -5.696 7.826 -12.429 1.00 0.31 H ATOM 1276 N ARG A 89 -5.626 9.191 -8.848 1.00 -0.46 N ATOM 1277 CA ARG A 89 -6.603 8.728 -7.862 1.00 0.04 C ATOM 1278 C ARG A 89 -7.756 8.065 -8.586 1.00 0.62 C ATOM 1279 O ARG A 89 -8.064 6.918 -8.302 1.00 -0.50 O ATOM 1280 CB ARG A 89 -7.144 9.868 -6.947 1.00 -0.08 C ATOM 1281 CG ARG A 89 -6.175 10.334 -5.814 1.00 -0.10 C ATOM 1282 CD ARG A 89 -4.961 11.174 -6.302 1.00 -0.23 C ATOM 1283 NE ARG A 89 -4.264 11.871 -5.215 1.00 -0.32 N ATOM 1284 CZ ARG A 89 -3.191 12.611 -5.389 1.00 0.76 C ATOM 1285 NH1 ARG A 89 -2.636 12.791 -6.562 1.00 -0.62 N ATOM 1286 NH2 ARG A 89 -2.643 13.193 -4.350 1.00 -0.62 N ATOM 1287 H ARG A 89 -5.294 10.130 -8.810 1.00 0.25 H ATOM 1288 HA ARG A 89 -6.118 7.972 -7.221 1.00 0.05 H ATOM 1289 HB2 ARG A 89 -7.442 10.732 -7.562 1.00 0.06 H ATOM 1290 HB3 ARG A 89 -8.062 9.499 -6.461 1.00 0.06 H ATOM 1291 HG2 ARG A 89 -6.773 10.961 -5.139 1.00 0.07 H ATOM 1292 HG3 ARG A 89 -5.803 9.481 -5.225 1.00 0.07 H ATOM 1293 HD2 ARG A 89 -4.260 10.483 -6.791 1.00 0.13 H ATOM 1294 HD3 ARG A 89 -5.329 11.925 -7.021 1.00 0.13 H ATOM 1295 HE ARG A 89 -4.653 11.782 -4.267 1.00 0.27 H ATOM 1296 HH11 ARG A 89 -3.024 12.368 -7.412 1.00 0.36 H ATOM 1297 HH12 ARG A 89 -1.794 13.375 -6.667 1.00 0.36 H ATOM 1298 HH21 ARG A 89 -3.044 13.085 -3.404 1.00 0.36 H ATOM 1299 HH22 ARG A 89 -1.807 13.785 -4.448 1.00 0.36 H ATOM 1300 N VAL A 90 -8.401 8.780 -9.534 1.00 -0.46 N ATOM 1301 CA VAL A 90 -9.543 8.217 -10.254 1.00 0.04 C ATOM 1302 C VAL A 90 -9.531 8.704 -11.684 1.00 0.62 C ATOM 1303 O VAL A 90 -8.734 9.555 -12.053 1.00 -0.50 O ATOM 1304 CB VAL A 90 -10.876 8.599 -9.547 1.00 -0.01 C ATOM 1305 CG1 VAL A 90 -10.975 7.964 -8.132 1.00 -0.09 C ATOM 1306 CG2 VAL A 90 -11.048 10.140 -9.454 1.00 -0.09 C ATOM 1307 OXT VAL A 90 -10.437 8.148 -12.495 1.00 0.00 O ATOM 1308 H VAL A 90 -8.117 9.714 -9.758 1.00 0.25 H ATOM 1309 HA VAL A 90 -9.464 7.119 -10.319 1.00 0.05 H ATOM 1310 HB VAL A 90 -11.708 8.196 -10.151 1.00 0.02 H ATOM 1311 HG11 VAL A 90 -10.838 6.876 -8.203 1.00 0.03 H ATOM 1312 HG12 VAL A 90 -10.208 8.370 -7.458 1.00 0.03 H ATOM 1313 HG13 VAL A 90 -11.963 8.161 -7.688 1.00 0.03 H ATOM 1314 HG21 VAL A 90 -10.990 10.603 -10.451 1.00 0.03 H ATOM 1315 HG22 VAL A 90 -12.031 10.379 -9.024 1.00 0.03 H ATOM 1316 HG23 VAL A 90 -10.271 10.585 -8.814 1.00 0.03 H ATOM 1317 HXT VAL A 90 -10.395 8.484 -13.384 1.00 0.00 H