ATOM 28 N GLY A 3 3.292 3.305 -4.391 1.00 22.14 N ATOM 29 CA GLY A 3 4.550 3.966 -4.686 1.00 53.33 C ATOM 30 C GLY A 3 5.688 2.985 -4.885 1.00 40.31 C ATOM 31 O GLY A 3 5.770 1.969 -4.194 1.00 51.32 O ATOM 32 H GLY A 3 2.727 2.980 -5.123 1.00 44.40 H ATOM 33 HA2 GLY A 3 4.433 4.553 -5.585 1.00 53.10 H ATOM 34 HA3 GLY A 3 4.797 4.626 -3.867 1.00 65.25 H ATOM 35 N CYS A 4 6.569 3.288 -5.833 1.00 74.42 N ATOM 36 CA CYS A 4 7.707 2.424 -6.124 1.00 10.35 C ATOM 37 C CYS A 4 8.544 2.993 -7.266 1.00 12.33 C ATOM 38 O CYS A 4 9.725 3.302 -7.109 1.00 2.42 O ATOM 39 CB CYS A 4 7.228 1.016 -6.480 1.00 73.14 C ATOM 40 SG CYS A 4 7.658 -0.251 -5.245 1.00 25.53 S ATOM 41 H CYS A 4 6.450 4.112 -6.351 1.00 40.12 H ATOM 42 HA CYS A 4 8.319 2.373 -5.236 1.00 63.32 H ATOM 43 HB2 CYS A 4 6.152 1.024 -6.580 1.00 10.43 H ATOM 44 HB3 CYS A 4 7.668 0.722 -7.421 1.00 64.54 H ATOM 45 N PRO A 5 7.918 3.136 -8.444 1.00 21.25 N ATOM 46 CA PRO A 5 8.585 3.669 -9.635 1.00 23.10 C ATOM 47 C PRO A 5 8.896 5.156 -9.509 1.00 14.52 C ATOM 48 O PRO A 5 9.999 5.599 -9.828 1.00 22.11 O ATOM 49 CB PRO A 5 7.565 3.428 -10.750 1.00 41.14 C ATOM 50 CG PRO A 5 6.248 3.387 -10.056 1.00 55.44 C ATOM 51 CD PRO A 5 6.511 2.788 -8.703 1.00 31.23 C ATOM 52 HA PRO A 5 9.495 3.130 -9.855 1.00 23.13 H ATOM 53 HB2 PRO A 5 7.611 4.238 -11.465 1.00 3.01 H ATOM 54 HB3 PRO A 5 7.780 2.492 -11.244 1.00 41.41 H ATOM 55 HG2 PRO A 5 5.855 4.388 -9.954 1.00 24.34 H ATOM 56 HG3 PRO A 5 5.559 2.768 -10.612 1.00 41.24 H ATOM 57 HD2 PRO A 5 5.862 3.230 -7.961 1.00 74.45 H ATOM 58 HD3 PRO A 5 6.379 1.716 -8.732 1.00 53.34 H ATOM 59 N TRP A 6 7.917 5.922 -9.042 1.00 15.52 N ATOM 60 CA TRP A 6 8.086 7.361 -8.873 1.00 42.33 C ATOM 61 C TRP A 6 7.855 7.770 -7.423 1.00 4.43 C ATOM 62 O TRP A 6 8.493 8.695 -6.920 1.00 55.15 O ATOM 63 CB TRP A 6 7.124 8.120 -9.789 1.00 64.23 C ATOM 64 CG TRP A 6 5.911 7.324 -10.166 1.00 0.54 C ATOM 65 CD1 TRP A 6 5.726 6.604 -11.311 1.00 25.52 C ATOM 66 CD2 TRP A 6 4.714 7.172 -9.396 1.00 32.34 C ATOM 67 NE1 TRP A 6 4.486 6.012 -11.299 1.00 24.31 N ATOM 68 CE2 TRP A 6 3.846 6.344 -10.135 1.00 11.04 C ATOM 69 CE3 TRP A 6 4.291 7.652 -8.153 1.00 61.51 C ATOM 70 CZ2 TRP A 6 2.582 5.989 -9.671 1.00 21.11 C ATOM 71 CZ3 TRP A 6 3.036 7.298 -7.694 1.00 43.44 C ATOM 72 CH2 TRP A 6 2.194 6.473 -8.451 1.00 40.12 C ATOM 73 H TRP A 6 7.059 5.511 -8.805 1.00 12.25 H ATOM 74 HA TRP A 6 9.101 7.609 -9.148 1.00 20.21 H ATOM 75 HB2 TRP A 6 6.793 9.017 -9.289 1.00 14.12 H ATOM 76 HB3 TRP A 6 7.642 8.389 -10.698 1.00 44.53 H ATOM 77 HD1 TRP A 6 6.456 6.521 -12.102 1.00 1.43 H ATOM 78 HE1 TRP A 6 4.121 5.443 -12.009 1.00 21.42 H ATOM 79 HE3 TRP A 6 4.926 8.289 -7.555 1.00 71.31 H ATOM 80 HZ2 TRP A 6 1.921 5.353 -10.242 1.00 44.11 H ATOM 81 HZ3 TRP A 6 2.692 7.660 -6.736 1.00 43.25 H ATOM 82 HH2 TRP A 6 1.222 6.223 -8.054 1.00 4.21 H ATOM 83 N ASN A 7 6.940 7.075 -6.755 1.00 5.43 N ATOM 84 CA ASN A 7 6.626 7.368 -5.361 1.00 31.41 C ATOM 85 C ASN A 7 7.484 6.526 -4.422 1.00 24.05 C ATOM 86 O ASN A 7 7.117 6.292 -3.271 1.00 33.13 O ATOM 87 CB ASN A 7 5.144 7.107 -5.086 1.00 15.54 C ATOM 88 CG ASN A 7 4.337 8.389 -5.004 1.00 40.25 C ATOM 89 OD1 ASN A 7 4.754 9.431 -5.510 1.00 50.24 O ATOM 90 ND2 ASN A 7 3.175 8.317 -4.365 1.00 43.52 N ATOM 91 H ASN A 7 6.465 6.349 -7.210 1.00 22.05 H ATOM 92 HA ASN A 7 6.838 8.411 -5.185 1.00 52.53 H ATOM 93 HB2 ASN A 7 4.737 6.499 -5.881 1.00 3.32 H ATOM 94 HB3 ASN A 7 5.044 6.581 -4.148 1.00 62.24 H ATOM 95 HD21 ASN A 7 2.907 7.454 -3.987 1.00 21.11 H ATOM 96 HD22 ASN A 7 2.633 9.131 -4.298 1.00 42.24 H ATOM 97 N ALA A 8 8.630 6.075 -4.921 1.00 23.40 N ATOM 98 CA ALA A 8 9.542 5.262 -4.126 1.00 64.42 C ATOM 99 C ALA A 8 9.836 5.920 -2.783 1.00 10.35 C ATOM 100 O ALA A 8 10.050 5.239 -1.780 1.00 21.33 O ATOM 101 CB ALA A 8 10.835 5.019 -4.891 1.00 23.43 C ATOM 102 H ALA A 8 8.868 6.295 -5.846 1.00 23.25 H ATOM 103 HA ALA A 8 9.071 4.305 -3.951 1.00 41.05 H ATOM 104 HB1 ALA A 8 10.881 5.686 -5.739 1.00 64.54 H ATOM 105 HB2 ALA A 8 11.678 5.203 -4.241 1.00 14.31 H ATOM 106 HB3 ALA A 8 10.863 3.996 -5.235 1.00 32.54 H ATOM 107 N TYR A 9 9.845 7.248 -2.770 1.00 1.53 N ATOM 108 CA TYR A 9 10.116 7.999 -1.549 1.00 53.13 C ATOM 109 C TYR A 9 9.183 7.563 -0.423 1.00 50.24 C ATOM 110 O TYR A 9 9.530 7.654 0.754 1.00 74.33 O ATOM 111 CB TYR A 9 9.960 9.499 -1.803 1.00 42.44 C ATOM 112 CG TYR A 9 11.136 10.320 -1.323 1.00 14.04 C ATOM 113 CD1 TYR A 9 12.346 10.302 -2.004 1.00 40.34 C ATOM 114 CD2 TYR A 9 11.035 11.114 -0.187 1.00 2.13 C ATOM 115 CE1 TYR A 9 13.423 11.050 -1.568 1.00 74.11 C ATOM 116 CE2 TYR A 9 12.106 11.866 0.256 1.00 2.11 C ATOM 117 CZ TYR A 9 13.298 11.830 -0.438 1.00 12.33 C ATOM 118 OH TYR A 9 14.367 12.578 -0.001 1.00 25.53 O ATOM 119 H TYR A 9 9.667 7.736 -3.601 1.00 2.22 H ATOM 120 HA TYR A 9 11.135 7.798 -1.255 1.00 63.42 H ATOM 121 HB2 TYR A 9 9.850 9.669 -2.863 1.00 70.34 H ATOM 122 HB3 TYR A 9 9.077 9.854 -1.293 1.00 54.32 H ATOM 123 HD1 TYR A 9 12.440 9.690 -2.890 1.00 2.22 H ATOM 124 HD2 TYR A 9 10.101 11.140 0.355 1.00 55.13 H ATOM 125 HE1 TYR A 9 14.356 11.022 -2.111 1.00 54.35 H ATOM 126 HE2 TYR A 9 12.009 12.477 1.141 1.00 1.24 H ATOM 127 HH TYR A 9 14.463 12.474 0.949 1.00 2.00 H ATOM 128 N GLU A 10 7.998 7.089 -0.796 1.00 11.55 N ATOM 129 CA GLU A 10 7.015 6.639 0.183 1.00 54.43 C ATOM 130 C GLU A 10 7.490 5.373 0.889 1.00 3.44 C ATOM 131 O GLU A 10 7.543 5.317 2.118 1.00 11.14 O ATOM 132 CB GLU A 10 5.668 6.382 -0.496 1.00 53.24 C ATOM 133 CG GLU A 10 4.653 5.699 0.404 1.00 34.14 C ATOM 134 CD GLU A 10 4.280 6.542 1.609 1.00 44.05 C ATOM 135 OE1 GLU A 10 4.425 7.780 1.532 1.00 12.34 O ATOM 136 OE2 GLU A 10 3.845 5.964 2.626 1.00 3.34 O ATOM 137 H GLU A 10 7.780 7.042 -1.750 1.00 13.13 H ATOM 138 HA GLU A 10 6.894 7.422 0.916 1.00 53.52 H ATOM 139 HB2 GLU A 10 5.255 7.327 -0.819 1.00 74.50 H ATOM 140 HB3 GLU A 10 5.829 5.756 -1.362 1.00 33.05 H ATOM 141 HG2 GLU A 10 3.758 5.501 -0.167 1.00 43.34 H ATOM 142 HG3 GLU A 10 5.070 4.765 0.752 1.00 13.20 H ATOM 143 N CYS A 11 7.835 4.359 0.104 1.00 63.41 N ATOM 144 CA CYS A 11 8.306 3.092 0.652 1.00 13.21 C ATOM 145 C CYS A 11 9.621 3.280 1.403 1.00 62.55 C ATOM 146 O CYS A 11 9.950 2.506 2.302 1.00 63.11 O ATOM 147 CB CYS A 11 8.486 2.064 -0.466 1.00 72.13 C ATOM 148 SG CYS A 11 8.272 0.336 0.071 1.00 45.32 S ATOM 149 H CYS A 11 7.772 4.464 -0.869 1.00 73.33 H ATOM 150 HA CYS A 11 7.559 2.732 1.344 1.00 43.14 H ATOM 151 HB2 CYS A 11 7.760 2.257 -1.243 1.00 42.50 H ATOM 152 HB3 CYS A 11 9.480 2.161 -0.877 1.00 73.33 H ATOM 153 N ASP A 12 10.368 4.311 1.026 1.00 5.34 N ATOM 154 CA ASP A 12 11.647 4.602 1.664 1.00 24.10 C ATOM 155 C ASP A 12 11.441 5.117 3.085 1.00 45.41 C ATOM 156 O ASP A 12 11.900 4.506 4.050 1.00 4.21 O ATOM 157 CB ASP A 12 12.429 5.629 0.844 1.00 52.34 C ATOM 158 CG ASP A 12 13.650 6.147 1.577 1.00 44.52 C ATOM 159 OD1 ASP A 12 14.715 5.501 1.487 1.00 22.34 O ATOM 160 OD2 ASP A 12 13.542 7.200 2.239 1.00 0.23 O ATOM 161 H ASP A 12 10.052 4.892 0.303 1.00 50.21 H ATOM 162 HA ASP A 12 12.213 3.683 1.706 1.00 1.44 H ATOM 163 HB2 ASP A 12 12.754 5.172 -0.080 1.00 34.44 H ATOM 164 HB3 ASP A 12 11.784 6.466 0.619 1.00 41.05 H ATOM 165 N ARG A 13 10.750 6.246 3.205 1.00 32.21 N ATOM 166 CA ARG A 13 10.485 6.845 4.508 1.00 63.23 C ATOM 167 C ARG A 13 9.861 5.827 5.458 1.00 63.43 C ATOM 168 O ARG A 13 10.040 5.905 6.674 1.00 45.05 O ATOM 169 CB ARG A 13 9.559 8.053 4.359 1.00 43.34 C ATOM 170 CG ARG A 13 10.270 9.310 3.884 1.00 0.32 C ATOM 171 CD ARG A 13 10.396 10.334 5.001 1.00 1.24 C ATOM 172 NE ARG A 13 10.378 11.703 4.494 1.00 53.44 N ATOM 173 CZ ARG A 13 10.137 12.766 5.254 1.00 70.14 C ATOM 174 NH1 ARG A 13 9.896 12.618 6.549 1.00 61.30 N ATOM 175 NH2 ARG A 13 10.137 13.980 4.718 1.00 4.02 N ATOM 176 H ARG A 13 10.410 6.687 2.399 1.00 73.35 H ATOM 177 HA ARG A 13 11.428 7.173 4.919 1.00 13.25 H ATOM 178 HB2 ARG A 13 8.785 7.813 3.645 1.00 40.23 H ATOM 179 HB3 ARG A 13 9.104 8.263 5.315 1.00 72.53 H ATOM 180 HG2 ARG A 13 11.259 9.046 3.541 1.00 61.55 H ATOM 181 HG3 ARG A 13 9.708 9.745 3.071 1.00 63.32 H ATOM 182 HD2 ARG A 13 9.572 10.203 5.686 1.00 14.52 H ATOM 183 HD3 ARG A 13 11.327 10.166 5.522 1.00 33.44 H ATOM 184 HE ARG A 13 10.553 11.836 3.539 1.00 22.10 H ATOM 185 HH11 ARG A 13 9.896 11.704 6.955 1.00 2.23 H ATOM 186 HH12 ARG A 13 9.716 13.420 7.119 1.00 23.43 H ATOM 187 HH21 ARG A 13 10.319 14.096 3.742 1.00 32.31 H ATOM 188 HH22 ARG A 13 9.956 14.779 5.291 1.00 60.22 H ATOM 189 N HIS A 14 9.128 4.872 4.895 1.00 74.33 N ATOM 190 CA HIS A 14 8.477 3.838 5.692 1.00 71.34 C ATOM 191 C HIS A 14 9.501 3.061 6.514 1.00 14.12 C ATOM 192 O HIS A 14 9.267 2.751 7.683 1.00 60.12 O ATOM 193 CB HIS A 14 7.700 2.880 4.787 1.00 2.51 C ATOM 194 CG HIS A 14 7.057 1.748 5.526 1.00 72.40 C ATOM 195 ND1 HIS A 14 5.798 1.831 6.082 1.00 32.44 N ATOM 196 CD2 HIS A 14 7.505 0.500 5.797 1.00 31.42 C ATOM 197 CE1 HIS A 14 5.500 0.683 6.665 1.00 1.14 C ATOM 198 NE2 HIS A 14 6.519 -0.142 6.506 1.00 3.13 N ATOM 199 H HIS A 14 9.022 4.862 3.921 1.00 51.22 H ATOM 200 HA HIS A 14 7.787 4.323 6.365 1.00 55.05 H ATOM 201 HB2 HIS A 14 6.921 3.429 4.278 1.00 21.13 H ATOM 202 HB3 HIS A 14 8.375 2.460 4.055 1.00 34.21 H ATOM 203 HD1 HIS A 14 5.211 2.614 6.055 1.00 12.34 H ATOM 204 HD2 HIS A 14 8.461 0.084 5.510 1.00 51.30 H ATOM 205 HE1 HIS A 14 4.580 0.457 7.184 1.00 42.05 H ATOM 206 N CYS A 15 10.635 2.749 5.897 1.00 50.15 N ATOM 207 CA CYS A 15 11.694 2.008 6.570 1.00 22.31 C ATOM 208 C CYS A 15 12.674 2.958 7.252 1.00 45.02 C ATOM 209 O CYS A 15 13.294 2.612 8.257 1.00 24.34 O ATOM 210 CB CYS A 15 12.439 1.120 5.571 1.00 33.21 C ATOM 211 SG CYS A 15 12.559 -0.627 6.074 1.00 0.24 S ATOM 212 H CYS A 15 10.763 3.024 4.964 1.00 42.13 H ATOM 213 HA CYS A 15 11.236 1.383 7.322 1.00 40.13 H ATOM 214 HB2 CYS A 15 11.926 1.152 4.621 1.00 40.44 H ATOM 215 HB3 CYS A 15 13.443 1.496 5.445 1.00 1.33 H ATOM 216 N VAL A 16 12.809 4.158 6.697 1.00 42.51 N ATOM 217 CA VAL A 16 13.712 5.160 7.251 1.00 24.12 C ATOM 218 C VAL A 16 13.376 5.457 8.708 1.00 14.50 C ATOM 219 O VAL A 16 14.228 5.908 9.474 1.00 70.45 O ATOM 220 CB VAL A 16 13.659 6.471 6.445 1.00 1.32 C ATOM 221 CG1 VAL A 16 14.568 7.519 7.069 1.00 12.35 C ATOM 222 CG2 VAL A 16 14.040 6.220 4.994 1.00 53.00 C ATOM 223 H VAL A 16 12.288 4.376 5.896 1.00 0.01 H ATOM 224 HA VAL A 16 14.718 4.769 7.197 1.00 41.11 H ATOM 225 HB VAL A 16 12.646 6.845 6.470 1.00 31.42 H ATOM 226 HG11 VAL A 16 14.196 7.780 8.049 1.00 14.14 H ATOM 227 HG12 VAL A 16 15.569 7.122 7.157 1.00 54.41 H ATOM 228 HG13 VAL A 16 14.583 8.400 6.445 1.00 53.41 H ATOM 229 HG21 VAL A 16 14.835 6.892 4.708 1.00 23.25 H ATOM 230 HG22 VAL A 16 14.372 5.199 4.881 1.00 22.25 H ATOM 231 HG23 VAL A 16 13.181 6.390 4.361 1.00 14.42 H ATOM 232 N SER A 17 12.127 5.202 9.085 1.00 53.41 N ATOM 233 CA SER A 17 11.675 5.446 10.450 1.00 43.11 C ATOM 234 C SER A 17 12.018 4.266 11.354 1.00 2.12 C ATOM 235 O SER A 17 12.382 4.444 12.517 1.00 15.51 O ATOM 236 CB SER A 17 10.167 5.700 10.473 1.00 33.52 C ATOM 237 OG SER A 17 9.819 6.612 11.500 1.00 34.32 O ATOM 238 H SER A 17 11.493 4.844 8.428 1.00 2.22 H ATOM 239 HA SER A 17 12.185 6.325 10.816 1.00 61.13 H ATOM 240 HB2 SER A 17 9.859 6.110 9.524 1.00 54.41 H ATOM 241 HB3 SER A 17 9.650 4.766 10.646 1.00 5.34 H ATOM 242 HG SER A 17 8.914 6.451 11.779 1.00 61.33 H ATOM 243 N LYS A 18 11.900 3.059 10.812 1.00 41.15 N ATOM 244 CA LYS A 18 12.198 1.848 11.566 1.00 20.34 C ATOM 245 C LYS A 18 13.639 1.859 12.068 1.00 54.54 C ATOM 246 O LYS A 18 13.911 1.502 13.213 1.00 74.32 O ATOM 247 CB LYS A 18 11.959 0.610 10.699 1.00 34.20 C ATOM 248 CG LYS A 18 10.551 0.050 10.813 1.00 24.14 C ATOM 249 CD LYS A 18 9.606 0.713 9.826 1.00 74.31 C ATOM 250 CE LYS A 18 8.572 -0.271 9.298 1.00 43.41 C ATOM 251 NZ LYS A 18 7.326 -0.257 10.113 1.00 41.20 N ATOM 252 H LYS A 18 11.606 2.981 9.879 1.00 11.13 H ATOM 253 HA LYS A 18 11.534 1.815 12.417 1.00 71.13 H ATOM 254 HB2 LYS A 18 12.138 0.869 9.666 1.00 71.21 H ATOM 255 HB3 LYS A 18 12.655 -0.162 10.994 1.00 44.31 H ATOM 256 HG2 LYS A 18 10.578 -1.011 10.613 1.00 42.21 H ATOM 257 HG3 LYS A 18 10.187 0.220 11.817 1.00 72.54 H ATOM 258 HD2 LYS A 18 9.093 1.525 10.321 1.00 63.55 H ATOM 259 HD3 LYS A 18 10.179 1.099 8.995 1.00 3.54 H ATOM 260 HE2 LYS A 18 8.330 -0.006 8.280 1.00 15.23 H ATOM 261 HE3 LYS A 18 8.996 -1.264 9.320 1.00 51.11 H ATOM 262 HZ1 LYS A 18 7.547 -0.012 11.099 1.00 14.12 H ATOM 263 HZ2 LYS A 18 6.875 -1.194 10.092 1.00 64.01 H ATOM 264 HZ3 LYS A 18 6.659 0.445 9.734 1.00 72.44 H ATOM 265 N GLY A 19 14.559 2.275 11.202 1.00 75.32 N ATOM 266 CA GLY A 19 15.960 2.327 11.576 1.00 33.52 C ATOM 267 C GLY A 19 16.883 2.051 10.406 1.00 31.51 C ATOM 268 O GLY A 19 18.047 2.453 10.416 1.00 35.01 O ATOM 269 H GLY A 19 14.283 2.548 10.302 1.00 44.14 H ATOM 270 HA2 GLY A 19 16.179 3.307 11.971 1.00 4.04 H ATOM 271 HA3 GLY A 19 16.142 1.590 12.345 1.00 4.21 H ATOM 272 N TYR A 20 16.365 1.361 9.396 1.00 51.22 N ATOM 273 CA TYR A 20 17.152 1.028 8.215 1.00 61.14 C ATOM 274 C TYR A 20 17.420 2.270 7.370 1.00 74.00 C ATOM 275 O TYR A 20 16.997 3.374 7.715 1.00 2.14 O ATOM 276 CB TYR A 20 16.430 -0.027 7.375 1.00 33.34 C ATOM 277 CG TYR A 20 15.959 -1.220 8.177 1.00 64.24 C ATOM 278 CD1 TYR A 20 16.805 -2.295 8.420 1.00 24.31 C ATOM 279 CD2 TYR A 20 14.669 -1.273 8.689 1.00 1.11 C ATOM 280 CE1 TYR A 20 16.380 -3.388 9.151 1.00 40.31 C ATOM 281 CE2 TYR A 20 14.236 -2.361 9.422 1.00 13.52 C ATOM 282 CZ TYR A 20 15.095 -3.415 9.650 1.00 34.43 C ATOM 283 OH TYR A 20 14.666 -4.501 10.379 1.00 61.31 O ATOM 284 H TYR A 20 15.431 1.068 9.446 1.00 63.33 H ATOM 285 HA TYR A 20 18.096 0.623 8.549 1.00 44.44 H ATOM 286 HB2 TYR A 20 15.565 0.422 6.912 1.00 71.44 H ATOM 287 HB3 TYR A 20 17.099 -0.386 6.607 1.00 32.20 H ATOM 288 HD1 TYR A 20 17.812 -2.271 8.028 1.00 52.33 H ATOM 289 HD2 TYR A 20 13.999 -0.445 8.508 1.00 32.12 H ATOM 290 HE1 TYR A 20 17.052 -4.214 9.330 1.00 3.10 H ATOM 291 HE2 TYR A 20 13.229 -2.383 9.813 1.00 40.31 H ATOM 292 HH TYR A 20 14.624 -5.273 9.809 1.00 45.32 H ATOM 293 N THR A 21 18.125 2.081 6.259 1.00 53.43 N ATOM 294 CA THR A 21 18.450 3.185 5.364 1.00 60.44 C ATOM 295 C THR A 21 17.228 3.622 4.564 1.00 43.32 C ATOM 296 O THR A 21 17.146 4.764 4.112 1.00 21.24 O ATOM 297 CB THR A 21 19.578 2.802 4.387 1.00 24.23 C ATOM 298 OG1 THR A 21 20.028 3.962 3.679 1.00 3.34 O ATOM 299 CG2 THR A 21 19.103 1.750 3.397 1.00 61.23 C ATOM 300 H THR A 21 18.433 1.178 6.037 1.00 3.14 H ATOM 301 HA THR A 21 18.790 4.014 5.966 1.00 10.24 H ATOM 302 HB THR A 21 20.402 2.394 4.955 1.00 23.04 H ATOM 303 HG1 THR A 21 20.551 4.513 4.267 1.00 1.21 H ATOM 304 HG21 THR A 21 19.953 1.201 3.020 1.00 31.32 H ATOM 305 HG22 THR A 21 18.594 2.232 2.575 1.00 2.44 H ATOM 306 HG23 THR A 21 18.425 1.070 3.891 1.00 2.01 H ATOM 307 N GLY A 22 16.279 2.707 4.392 1.00 25.34 N ATOM 308 CA GLY A 22 15.074 3.018 3.647 1.00 11.31 C ATOM 309 C GLY A 22 14.607 1.859 2.789 1.00 14.05 C ATOM 310 O GLY A 22 15.420 1.111 2.249 1.00 75.44 O ATOM 311 H GLY A 22 16.399 1.812 4.775 1.00 2.32 H ATOM 312 HA2 GLY A 22 14.290 3.277 4.343 1.00 30.42 H ATOM 313 HA3 GLY A 22 15.269 3.867 3.009 1.00 53.55 H ATOM 314 N GLY A 23 13.291 1.709 2.666 1.00 62.42 N ATOM 315 CA GLY A 23 12.740 0.629 1.868 1.00 32.12 C ATOM 316 C GLY A 23 12.584 1.007 0.409 1.00 54.52 C ATOM 317 O GLY A 23 11.882 1.963 0.080 1.00 3.34 O ATOM 318 H GLY A 23 12.690 2.336 3.120 1.00 45.00 H ATOM 319 HA2 GLY A 23 13.394 -0.227 1.939 1.00 21.14 H ATOM 320 HA3 GLY A 23 11.771 0.363 2.265 1.00 72.34 H ATOM 321 N ASN A 24 13.240 0.257 -0.469 1.00 65.53 N ATOM 322 CA ASN A 24 13.173 0.520 -1.902 1.00 51.11 C ATOM 323 C ASN A 24 12.607 -0.683 -2.651 1.00 24.15 C ATOM 324 O ASN A 24 12.561 -1.793 -2.119 1.00 65.14 O ATOM 325 CB ASN A 24 14.561 0.866 -2.444 1.00 64.42 C ATOM 326 CG ASN A 24 15.421 1.579 -1.419 1.00 42.40 C ATOM 327 OD1 ASN A 24 16.567 1.198 -1.180 1.00 32.35 O ATOM 328 ND2 ASN A 24 14.870 2.622 -0.808 1.00 23.31 N ATOM 329 H ASN A 24 13.784 -0.492 -0.146 1.00 72.44 H ATOM 330 HA ASN A 24 12.517 1.364 -2.053 1.00 41.21 H ATOM 331 HB2 ASN A 24 15.064 -0.045 -2.735 1.00 62.25 H ATOM 332 HB3 ASN A 24 14.456 1.505 -3.307 1.00 52.43 H ATOM 333 HD21 ASN A 24 13.953 2.869 -1.049 1.00 71.41 H ATOM 334 HD22 ASN A 24 15.404 3.102 -0.141 1.00 21.00 H ATOM 335 N CYS A 25 12.178 -0.455 -3.887 1.00 62.33 N ATOM 336 CA CYS A 25 11.616 -1.519 -4.710 1.00 73.22 C ATOM 337 C CYS A 25 12.641 -2.025 -5.721 1.00 10.20 C ATOM 338 O CYS A 25 13.505 -1.273 -6.173 1.00 71.31 O ATOM 339 CB CYS A 25 10.366 -1.022 -5.440 1.00 4.32 C ATOM 340 SG CYS A 25 9.179 -0.147 -4.370 1.00 44.21 S ATOM 341 H CYS A 25 12.241 0.451 -4.256 1.00 40.52 H ATOM 342 HA CYS A 25 11.340 -2.333 -4.057 1.00 63.44 H ATOM 343 HB2 CYS A 25 10.664 -0.341 -6.224 1.00 42.12 H ATOM 344 HB3 CYS A 25 9.855 -1.866 -5.878 1.00 53.31 H ATOM 345 N ARG A 26 12.538 -3.303 -6.071 1.00 2.22 N ATOM 346 CA ARG A 26 13.456 -3.909 -7.027 1.00 64.40 C ATOM 347 C ARG A 26 12.761 -5.006 -7.828 1.00 72.12 C ATOM 348 O ARG A 26 11.599 -5.327 -7.582 1.00 21.12 O ATOM 349 CB ARG A 26 14.674 -4.487 -6.302 1.00 15.30 C ATOM 350 CG ARG A 26 15.595 -3.427 -5.719 1.00 75.24 C ATOM 351 CD ARG A 26 16.266 -2.610 -6.813 1.00 33.44 C ATOM 352 NE ARG A 26 17.458 -1.921 -6.327 1.00 12.23 N ATOM 353 CZ ARG A 26 18.244 -1.179 -7.099 1.00 53.11 C ATOM 354 NH1 ARG A 26 17.965 -1.031 -8.387 1.00 34.02 N ATOM 355 NH2 ARG A 26 19.311 -0.583 -6.583 1.00 40.44 N ATOM 356 H ARG A 26 11.828 -3.851 -5.676 1.00 24.31 H ATOM 357 HA ARG A 26 13.786 -3.138 -7.706 1.00 52.44 H ATOM 358 HB2 ARG A 26 14.331 -5.118 -5.495 1.00 5.21 H ATOM 359 HB3 ARG A 26 15.242 -5.084 -6.999 1.00 5.34 H ATOM 360 HG2 ARG A 26 15.015 -2.764 -5.094 1.00 41.24 H ATOM 361 HG3 ARG A 26 16.355 -3.912 -5.126 1.00 10.04 H ATOM 362 HD2 ARG A 26 16.548 -3.273 -7.617 1.00 32.21 H ATOM 363 HD3 ARG A 26 15.562 -1.878 -7.180 1.00 31.54 H ATOM 364 HE ARG A 26 17.683 -2.017 -5.378 1.00 53.42 H ATOM 365 HH11 ARG A 26 17.161 -1.478 -8.778 1.00 35.32 H ATOM 366 HH12 ARG A 26 18.557 -0.471 -8.966 1.00 4.20 H ATOM 367 HH21 ARG A 26 19.524 -0.692 -5.613 1.00 45.41 H ATOM 368 HH22 ARG A 26 19.902 -0.025 -7.165 1.00 52.34 H ATOM 369 N GLY A 27 13.481 -5.577 -8.789 1.00 73.14 N ATOM 370 CA GLY A 27 12.916 -6.631 -9.612 1.00 43.45 C ATOM 371 C GLY A 27 13.211 -8.014 -9.066 1.00 55.42 C ATOM 372 O GLY A 27 13.442 -8.954 -9.827 1.00 14.13 O ATOM 373 H GLY A 27 14.403 -5.280 -8.941 1.00 35.32 H ATOM 374 HA2 GLY A 27 11.846 -6.496 -9.666 1.00 62.23 H ATOM 375 HA3 GLY A 27 13.329 -6.554 -10.608 1.00 21.32 H ATOM 376 N LYS A 28 13.204 -8.139 -7.743 1.00 60.25 N ATOM 377 CA LYS A 28 13.473 -9.417 -7.094 1.00 55.04 C ATOM 378 C LYS A 28 12.588 -10.517 -7.672 1.00 62.33 C ATOM 379 O LYS A 28 12.983 -11.682 -7.721 1.00 24.50 O ATOM 380 CB LYS A 28 13.244 -9.304 -5.585 1.00 52.05 C ATOM 381 CG LYS A 28 11.964 -8.574 -5.217 1.00 74.14 C ATOM 382 CD LYS A 28 12.243 -7.149 -4.770 1.00 70.12 C ATOM 383 CE LYS A 28 12.484 -7.073 -3.270 1.00 44.24 C ATOM 384 NZ LYS A 28 11.240 -7.333 -2.494 1.00 43.14 N ATOM 385 H LYS A 28 13.013 -7.353 -7.190 1.00 12.32 H ATOM 386 HA LYS A 28 14.506 -9.670 -7.275 1.00 61.23 H ATOM 387 HB2 LYS A 28 13.201 -10.298 -5.165 1.00 11.34 H ATOM 388 HB3 LYS A 28 14.076 -8.772 -5.146 1.00 55.14 H ATOM 389 HG2 LYS A 28 11.314 -8.548 -6.079 1.00 72.54 H ATOM 390 HG3 LYS A 28 11.476 -9.105 -4.412 1.00 70.53 H ATOM 391 HD2 LYS A 28 13.121 -6.785 -5.283 1.00 73.24 H ATOM 392 HD3 LYS A 28 11.394 -6.529 -5.021 1.00 71.25 H ATOM 393 HE2 LYS A 28 13.227 -7.808 -3.001 1.00 10.14 H ATOM 394 HE3 LYS A 28 12.850 -6.086 -3.028 1.00 2.11 H ATOM 395 HZ1 LYS A 28 10.661 -6.471 -2.447 1.00 42.45 H ATOM 396 HZ2 LYS A 28 11.479 -7.631 -1.527 1.00 11.22 H ATOM 397 HZ3 LYS A 28 10.686 -8.086 -2.950 1.00 1.23 H ATOM 398 N ILE A 29 11.392 -10.140 -8.110 1.00 12.30 N ATOM 399 CA ILE A 29 10.454 -11.094 -8.687 1.00 34.52 C ATOM 400 C ILE A 29 9.502 -10.410 -9.662 1.00 11.43 C ATOM 401 O ILE A 29 9.194 -10.947 -10.726 1.00 4.02 O ATOM 402 CB ILE A 29 9.630 -11.804 -7.596 1.00 0.23 C ATOM 403 CG1 ILE A 29 9.112 -10.788 -6.576 1.00 13.21 C ATOM 404 CG2 ILE A 29 10.469 -12.871 -6.909 1.00 31.22 C ATOM 405 CD1 ILE A 29 8.308 -11.412 -5.456 1.00 41.53 C ATOM 406 H ILE A 29 11.134 -9.197 -8.044 1.00 43.31 H ATOM 407 HA ILE A 29 11.024 -11.840 -9.221 1.00 61.53 H ATOM 408 HB ILE A 29 8.790 -12.289 -8.069 1.00 21.35 H ATOM 409 HG12 ILE A 29 9.949 -10.271 -6.134 1.00 70.03 H ATOM 410 HG13 ILE A 29 8.479 -10.073 -7.081 1.00 54.24 H ATOM 411 HG21 ILE A 29 11.194 -12.398 -6.263 1.00 32.54 H ATOM 412 HG22 ILE A 29 9.827 -13.510 -6.321 1.00 72.02 H ATOM 413 HG23 ILE A 29 10.981 -13.461 -7.653 1.00 61.55 H ATOM 414 HD11 ILE A 29 7.791 -12.285 -5.828 1.00 1.21 H ATOM 415 HD12 ILE A 29 8.971 -11.701 -4.655 1.00 24.52 H ATOM 416 HD13 ILE A 29 7.588 -10.697 -5.088 1.00 74.02 H ATOM 417 N ARG A 30 9.040 -9.220 -9.292 1.00 1.42 N ATOM 418 CA ARG A 30 8.124 -8.460 -10.134 1.00 33.31 C ATOM 419 C ARG A 30 7.825 -7.096 -9.520 1.00 12.24 C ATOM 420 O ARG A 30 6.668 -6.756 -9.274 1.00 31.04 O ATOM 421 CB ARG A 30 6.821 -9.237 -10.336 1.00 42.34 C ATOM 422 CG ARG A 30 6.144 -8.953 -11.667 1.00 74.10 C ATOM 423 CD ARG A 30 6.612 -9.916 -12.747 1.00 42.41 C ATOM 424 NE ARG A 30 5.526 -10.305 -13.642 1.00 33.42 N ATOM 425 CZ ARG A 30 5.021 -9.507 -14.576 1.00 61.42 C ATOM 426 NH1 ARG A 30 5.503 -8.283 -14.738 1.00 12.34 N ATOM 427 NH2 ARG A 30 4.033 -9.934 -15.352 1.00 33.22 N ATOM 428 H ARG A 30 9.322 -8.843 -8.432 1.00 34.43 H ATOM 429 HA ARG A 30 8.598 -8.314 -11.093 1.00 31.02 H ATOM 430 HB2 ARG A 30 7.034 -10.294 -10.284 1.00 62.43 H ATOM 431 HB3 ARG A 30 6.135 -8.977 -9.545 1.00 13.41 H ATOM 432 HG2 ARG A 30 5.075 -9.058 -11.546 1.00 44.21 H ATOM 433 HG3 ARG A 30 6.376 -7.943 -11.971 1.00 24.43 H ATOM 434 HD2 ARG A 30 7.388 -9.436 -13.326 1.00 33.52 H ATOM 435 HD3 ARG A 30 7.011 -10.800 -12.273 1.00 62.14 H ATOM 436 HE ARG A 30 5.155 -11.206 -13.540 1.00 32.22 H ATOM 437 HH11 ARG A 30 6.248 -7.959 -14.155 1.00 42.23 H ATOM 438 HH12 ARG A 30 5.122 -7.684 -15.443 1.00 31.22 H ATOM 439 HH21 ARG A 30 3.667 -10.857 -15.233 1.00 41.12 H ATOM 440 HH22 ARG A 30 3.654 -9.333 -16.055 1.00 34.05 H ATOM 441 N GLN A 31 8.876 -6.320 -9.275 1.00 13.14 N ATOM 442 CA GLN A 31 8.725 -4.994 -8.688 1.00 1.51 C ATOM 443 C GLN A 31 8.137 -5.083 -7.284 1.00 32.03 C ATOM 444 O GLN A 31 6.953 -4.815 -7.076 1.00 52.11 O ATOM 445 CB GLN A 31 7.834 -4.120 -9.572 1.00 51.23 C ATOM 446 CG GLN A 31 8.210 -4.162 -11.045 1.00 13.33 C ATOM 447 CD GLN A 31 9.583 -3.579 -11.313 1.00 63.43 C ATOM 448 OE1 GLN A 31 9.730 -2.374 -11.516 1.00 5.24 O ATOM 449 NE2 GLN A 31 10.599 -4.435 -11.316 1.00 50.14 N ATOM 450 H GLN A 31 9.773 -6.647 -9.493 1.00 34.01 H ATOM 451 HA GLN A 31 9.705 -4.545 -8.626 1.00 61.41 H ATOM 452 HB2 GLN A 31 6.812 -4.453 -9.474 1.00 34.21 H ATOM 453 HB3 GLN A 31 7.904 -3.096 -9.234 1.00 65.44 H ATOM 454 HG2 GLN A 31 8.201 -5.189 -11.376 1.00 74.44 H ATOM 455 HG3 GLN A 31 7.479 -3.597 -11.605 1.00 62.34 H ATOM 456 HE21 GLN A 31 10.407 -5.382 -11.149 1.00 15.33 H ATOM 457 HE22 GLN A 31 11.498 -4.086 -11.488 1.00 55.00 H ATOM 458 N THR A 32 8.971 -5.462 -6.321 1.00 23.33 N ATOM 459 CA THR A 32 8.534 -5.589 -4.936 1.00 51.33 C ATOM 460 C THR A 32 9.365 -4.704 -4.014 1.00 61.30 C ATOM 461 O THR A 32 10.551 -4.478 -4.257 1.00 20.23 O ATOM 462 CB THR A 32 8.625 -7.047 -4.449 1.00 72.34 C ATOM 463 OG1 THR A 32 7.908 -7.907 -5.342 1.00 63.43 O ATOM 464 CG2 THR A 32 8.061 -7.185 -3.043 1.00 51.42 C ATOM 465 H THR A 32 9.903 -5.662 -6.549 1.00 21.23 H ATOM 466 HA THR A 32 7.501 -5.277 -4.883 1.00 73.21 H ATOM 467 HB THR A 32 9.665 -7.342 -4.435 1.00 15.32 H ATOM 468 HG1 THR A 32 7.962 -7.558 -6.235 1.00 53.02 H ATOM 469 HG21 THR A 32 7.093 -6.709 -2.996 1.00 40.11 H ATOM 470 HG22 THR A 32 8.729 -6.711 -2.339 1.00 41.34 H ATOM 471 HG23 THR A 32 7.961 -8.231 -2.796 1.00 54.03 H ATOM 472 N CYS A 33 8.736 -4.207 -2.954 1.00 45.55 N ATOM 473 CA CYS A 33 9.418 -3.347 -1.995 1.00 11.54 C ATOM 474 C CYS A 33 10.210 -4.176 -0.988 1.00 2.31 C ATOM 475 O CYS A 33 9.846 -5.311 -0.679 1.00 0.24 O ATOM 476 CB CYS A 33 8.406 -2.464 -1.261 1.00 2.11 C ATOM 477 SG CYS A 33 8.951 -0.741 -1.032 1.00 3.15 S ATOM 478 H CYS A 33 7.790 -4.423 -2.814 1.00 50.45 H ATOM 479 HA CYS A 33 10.103 -2.716 -2.541 1.00 74.22 H ATOM 480 HB2 CYS A 33 7.484 -2.444 -1.823 1.00 13.41 H ATOM 481 HB3 CYS A 33 8.217 -2.882 -0.284 1.00 20.45 H ATOM 482 N HIS A 34 11.296 -3.601 -0.480 1.00 14.32 N ATOM 483 CA HIS A 34 12.139 -4.286 0.493 1.00 45.22 C ATOM 484 C HIS A 34 12.994 -3.288 1.269 1.00 61.22 C ATOM 485 O HIS A 34 13.309 -2.206 0.772 1.00 25.50 O ATOM 486 CB HIS A 34 13.036 -5.307 -0.208 1.00 43.41 C ATOM 487 CG HIS A 34 13.470 -6.432 0.680 1.00 60.23 C ATOM 488 ND1 HIS A 34 14.727 -6.997 0.620 1.00 54.14 N ATOM 489 CD2 HIS A 34 12.807 -7.097 1.654 1.00 34.32 C ATOM 490 CE1 HIS A 34 14.817 -7.962 1.517 1.00 13.35 C ATOM 491 NE2 HIS A 34 13.665 -8.043 2.159 1.00 1.31 N ATOM 492 H HIS A 34 11.534 -2.694 -0.765 1.00 61.33 H ATOM 493 HA HIS A 34 11.494 -4.803 1.186 1.00 33.10 H ATOM 494 HB2 HIS A 34 12.501 -5.732 -1.044 1.00 43.24 H ATOM 495 HB3 HIS A 34 13.924 -4.808 -0.570 1.00 52.15 H ATOM 496 HD1 HIS A 34 15.445 -6.731 0.009 1.00 73.24 H ATOM 497 HD2 HIS A 34 11.790 -6.918 1.976 1.00 70.43 H ATOM 498 HE1 HIS A 34 15.684 -8.579 1.697 1.00 20.14 H ATOM 499 N CYS A 35 13.365 -3.658 2.490 1.00 63.42 N ATOM 500 CA CYS A 35 14.182 -2.797 3.336 1.00 41.54 C ATOM 501 C CYS A 35 15.640 -3.246 3.323 1.00 23.12 C ATOM 502 O CYS A 35 15.939 -4.426 3.511 1.00 52.23 O ATOM 503 CB CYS A 35 13.648 -2.800 4.769 1.00 2.44 C ATOM 504 SG CYS A 35 12.329 -1.581 5.074 1.00 0.23 S ATOM 505 H CYS A 35 13.083 -4.533 2.831 1.00 35.52 H ATOM 506 HA CYS A 35 14.124 -1.793 2.941 1.00 23.45 H ATOM 507 HB2 CYS A 35 13.249 -3.778 4.994 1.00 12.14 H ATOM 508 HB3 CYS A 35 14.460 -2.583 5.448 1.00 32.21 H ATOM 509 N TYR A 36 16.544 -2.298 3.101 1.00 32.14 N ATOM 510 CA TYR A 36 17.971 -2.596 3.062 1.00 35.12 C ATOM 511 C TYR A 36 18.795 -1.313 3.051 1.00 1.54 C ATOM 512 O TYR A 36 19.864 -1.245 3.655 1.00 22.15 O ATOM 513 CB TYR A 36 18.303 -3.439 1.830 1.00 21.52 C ATOM 514 CG TYR A 36 18.110 -2.704 0.523 1.00 21.41 C ATOM 515 CD1 TYR A 36 16.838 -2.382 0.066 1.00 1.13 C ATOM 516 CD2 TYR A 36 19.199 -2.333 -0.255 1.00 63.25 C ATOM 517 CE1 TYR A 36 16.657 -1.711 -1.128 1.00 13.03 C ATOM 518 CE2 TYR A 36 19.027 -1.661 -1.450 1.00 5.11 C ATOM 519 CZ TYR A 36 17.754 -1.352 -1.882 1.00 24.21 C ATOM 520 OH TYR A 36 17.579 -0.684 -3.072 1.00 0.22 O ATOM 521 H TYR A 36 16.244 -1.376 2.959 1.00 45.11 H ATOM 522 HA TYR A 36 18.216 -3.161 3.950 1.00 51.32 H ATOM 523 HB2 TYR A 36 19.334 -3.753 1.885 1.00 42.15 H ATOM 524 HB3 TYR A 36 17.667 -4.312 1.817 1.00 33.25 H ATOM 525 HD1 TYR A 36 15.980 -2.664 0.659 1.00 21.22 H ATOM 526 HD2 TYR A 36 20.195 -2.577 0.086 1.00 61.04 H ATOM 527 HE1 TYR A 36 15.660 -1.469 -1.466 1.00 40.23 H ATOM 528 HE2 TYR A 36 19.887 -1.380 -2.041 1.00 32.31 H ATOM 529 HH TYR A 36 18.393 -0.715 -3.579 1.00 64.44 H