Browse entries in the PDBbind-CN Database
HEADER 4WKI_COMPLEX COMPND 4WKI_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 58 SER LEU SER ARG PHE VAL GLU THR LEU VAL VAL ALA ASP SEQRES 2 A 58 ASP LYS MET ALA ALA PHE HIS GLY ALA GLY LEU LYS ARG SEQRES 3 A 58 TYR LEU LEU THR VAL MET ALA ALA ALA ALA LYS ALA PHE SEQRES 4 A 58 LYS HIS PRO SER ILE ARG ASN PRO VAL SER LEU VAL VAL SEQRES 5 A 58 THR ARG LEU VAL ILE LEU SEQRES 1 A 107 GLY PRO GLN VAL GLY PRO SER ALA ALA GLN THR LEU ARG SEQRES 2 A 107 SER PHE CYS ALA TRP GLN ARG GLY LEU ASN THR PRO GLU SEQRES 3 A 107 ASP SER ASP PRO ASP HIS PHE ASP THR ALA ILE LEU PHE SEQRES 4 A 107 THR ARG GLN ASP LEU CYS GLY VAL SER THR CYS ASP THR SEQRES 5 A 107 LEU GLY MET ALA ASP VAL GLY THR VAL CYS ASP PRO ALA SEQRES 6 A 107 ARG SER CYS ALA ILE VAL GLU ASP ASP GLY LEU GLN SER SEQRES 7 A 107 ALA PHE THR ALA ALA HIS GLU LEU GLY HIS VAL PHE ASN SEQRES 8 A 107 MET LEU HIS ASP ASN SER LYS PRO CYS ILE SER LEU ASN SEQRES 9 A 107 GLY PRO LEU SEQRES 1 A 49 SER ARG HIS VAL MET ALA PRO VAL MET ALA HIS VAL ASP SEQRES 2 A 49 PRO GLU GLU PRO TRP SER PRO CYS SER ALA ARG PHE ILE SEQRES 3 A 49 THR ASP PHE LEU ASP ASN GLY TYR GLY HIS CYS LEU LEU SEQRES 4 A 49 ASP LYS PRO GLU ALA PRO LEU HIS LEU PRO HET ZN A 1 1 HET CA A 2 1 HET CA A 3 1 HET CA A 4 1 HET UNN A 437 41 SSBOND 1 CYS A 322 CYS A 327 SSBOND 2 CYS A 293 CYS A 345 SSBOND 3 CYS A 377 CYS A 407 SSBOND 4 CYS A 339 CYS A 423 ATOM 1 N SER A 215 17.775 18.554 21.088 1.00 60.12 N ATOM 2 CA SER A 215 18.955 17.627 21.098 1.00 58.69 C ATOM 3 C SER A 215 19.211 16.960 22.448 1.00 58.32 C ATOM 4 O SER A 215 19.780 15.867 22.503 1.00 57.49 O ATOM 5 CB SER A 215 20.222 18.373 20.675 1.00 58.53 C ATOM 6 OG SER A 215 21.322 17.483 20.576 1.00 57.42 O ATOM 7 HG SER A 215 21.481 17.057 21.456 1.00 0.00 H ATOM 8 HN3 SER A 215 17.927 19.314 21.782 1.00 0.00 H ATOM 9 HN2 SER A 215 16.916 18.023 21.336 1.00 0.00 H ATOM 10 HN1 SER A 215 17.667 18.966 20.139 1.00 0.00 H ATOM 11 N LEU A 216 18.816 17.635 23.525 1.00 55.52 N ATOM 12 CA LEU A 216 18.999 17.136 24.878 1.00 53.80 C ATOM 13 C LEU A 216 18.493 15.720 25.008 1.00 49.76 C ATOM 14 O LEU A 216 17.368 15.423 24.594 1.00 47.73 O ATOM 15 CB LEU A 216 18.211 17.983 25.867 1.00 54.50 C ATOM 16 CG LEU A 216 18.845 19.272 26.354 1.00 55.62 C ATOM 17 CD1 LEU A 216 18.894 20.353 25.279 1.00 56.23 C ATOM 18 CD2 LEU A 216 18.017 19.702 27.543 1.00 55.31 C ATOM 19 H LEU A 216 18.357 18.559 23.393 1.00 0.00 H ATOM 20 N SER A 217 19.322 14.859 25.590 1.00 48.07 N ATOM 21 CA SER A 217 18.897 13.524 25.950 1.00 43.98 C ATOM 22 C SER A 217 17.805 13.659 27.000 1.00 41.75 C ATOM 23 O SER A 217 17.937 14.436 27.949 1.00 40.40 O ATOM 24 CB SER A 217 20.059 12.701 26.508 1.00 45.39 C ATOM 25 OG SER A 217 21.106 12.583 25.565 1.00 47.39 O ATOM 26 HG SER A 217 21.841 12.046 25.955 1.00 0.00 H ATOM 27 H SER A 217 20.299 15.152 25.791 1.00 0.00 H ATOM 28 N ARG A 218 16.711 12.938 26.795 1.00 36.61 N ATOM 29 CA ARG A 218 15.636 12.876 27.764 1.00 35.94 C ATOM 30 C ARG A 218 15.563 11.441 28.252 1.00 33.30 C ATOM 31 O ARG A 218 15.589 10.501 27.446 1.00 33.23 O ATOM 32 CB ARG A 218 14.309 13.270 27.135 1.00 37.94 C ATOM 33 CG ARG A 218 14.290 14.645 26.488 1.00 39.66 C ATOM 34 CD ARG A 218 13.894 15.730 27.469 1.00 41.36 C ATOM 35 NE ARG A 218 13.867 17.042 26.824 1.00 44.08 N ATOM 36 CZ ARG A 218 13.659 18.197 27.456 1.00 43.73 C ATOM 37 NH1 ARG A 218 13.452 18.232 28.769 1.00 43.28 N ATOM 38 NH2 ARG A 218 13.660 19.333 26.768 1.00 44.53 N ATOM 39 HE ARG A 218 14.022 17.077 25.796 1.00 0.00 H ATOM 40 HH12 ARG A 218 13.291 19.142 29.246 1.00 0.00 H ATOM 41 HH11 ARG A 218 13.451 17.349 29.319 1.00 0.00 H ATOM 42 HH22 ARG A 218 13.498 20.237 27.256 1.00 0.00 H ATOM 43 HH21 ARG A 218 13.823 19.319 25.741 1.00 0.00 H ATOM 44 H ARG A 218 16.622 12.400 25.910 1.00 0.00 H ATOM 45 N PHE A 219 15.471 11.298 29.567 1.00 30.84 N ATOM 46 CA PHE A 219 15.351 10.003 30.245 1.00 29.17 C ATOM 47 C PHE A 219 14.115 9.988 31.140 1.00 31.13 C ATOM 48 O PHE A 219 13.969 10.822 32.038 1.00 28.83 O ATOM 49 CB PHE A 219 16.590 9.743 31.107 1.00 30.27 C ATOM 50 CG PHE A 219 17.879 9.965 30.381 1.00 32.01 C ATOM 51 CD1 PHE A 219 18.499 11.209 30.412 1.00 34.25 C ATOM 52 CD2 PHE A 219 18.453 8.949 29.636 1.00 33.48 C ATOM 53 CE1 PHE A 219 19.678 11.428 29.725 1.00 34.24 C ATOM 54 CE2 PHE A 219 19.635 9.163 28.954 1.00 34.71 C ATOM 55 CZ PHE A 219 20.243 10.403 28.999 1.00 35.82 C ATOM 56 H PHE A 219 15.485 12.157 30.154 1.00 0.00 H ATOM 57 N VAL A 220 13.235 9.020 30.923 1.00 27.60 N ATOM 58 CA VAL A 220 12.042 8.888 31.743 1.00 27.81 C ATOM 59 C VAL A 220 12.305 7.756 32.712 1.00 27.37 C ATOM 60 O VAL A 220 12.332 6.586 32.317 1.00 24.98 O ATOM 61 CB VAL A 220 10.788 8.537 30.918 1.00 27.69 C ATOM 62 CG1 VAL A 220 9.549 8.559 31.798 1.00 27.19 C ATOM 63 CG2 VAL A 220 10.617 9.468 29.726 1.00 28.62 C ATOM 64 H VAL A 220 13.402 8.343 30.152 1.00 0.00 H ATOM 65 N GLU A 221 12.539 8.116 33.966 1.00 26.73 N ATOM 66 CA GLU A 221 12.752 7.140 35.022 1.00 24.89 C ATOM 67 C GLU A 221 11.418 6.499 35.406 1.00 26.21 C ATOM 68 O GLU A 221 10.528 7.145 35.984 1.00 25.44 O ATOM 69 CB GLU A 221 13.442 7.782 36.221 1.00 26.86 C ATOM 70 CG GLU A 221 14.824 8.348 35.897 1.00 26.58 C ATOM 71 CD GLU A 221 15.386 9.203 37.018 1.00 27.10 C ATOM 72 OE1 GLU A 221 14.858 10.306 37.242 1.00 27.60 O ATOM 73 OE2 GLU A 221 16.333 8.799 37.717 1.00 27.29 O ATOM 74 H GLU A 221 12.571 9.128 34.202 1.00 0.00 H ATOM 75 N THR A 222 11.292 5.214 35.090 1.00 24.58 N ATOM 76 CA THR A 222 9.981 4.562 35.087 1.00 25.87 C ATOM 77 C THR A 222 9.819 3.519 36.188 1.00 24.63 C ATOM 78 O THR A 222 10.613 2.591 36.324 1.00 24.53 O ATOM 79 CB THR A 222 9.668 3.930 33.713 1.00 24.91 C ATOM 80 OG1 THR A 222 9.860 4.902 32.665 1.00 25.55 O ATOM 81 CG2 THR A 222 8.224 3.434 33.671 1.00 24.85 C ATOM 82 HG1 THR A 222 10.800 5.213 32.673 1.00 0.00 H ATOM 83 H THR A 222 12.138 4.663 34.841 1.00 0.00 H ATOM 84 N LEU A 223 8.761 3.695 36.968 1.00 23.35 N ATOM 85 CA LEU A 223 8.282 2.672 37.885 1.00 25.11 C ATOM 86 C LEU A 223 7.309 1.770 37.132 1.00 24.90 C ATOM 87 O LEU A 223 6.281 2.249 36.628 1.00 24.42 O ATOM 88 CB LEU A 223 7.570 3.312 39.083 1.00 26.43 C ATOM 89 CG LEU A 223 6.773 2.322 39.946 1.00 26.95 C ATOM 90 CD1 LEU A 223 7.691 1.314 40.618 1.00 28.16 C ATOM 91 CD2 LEU A 223 5.901 2.997 40.994 1.00 28.10 C ATOM 92 H LEU A 223 8.253 4.601 36.922 1.00 0.00 H ATOM 93 N VAL A 224 7.626 0.484 37.037 1.00 24.29 N ATOM 94 CA VAL A 224 6.732 -0.503 36.403 1.00 24.72 C ATOM 95 C VAL A 224 6.102 -1.337 37.499 1.00 24.73 C ATOM 96 O VAL A 224 6.800 -1.831 38.365 1.00 26.12 O ATOM 97 CB VAL A 224 7.511 -1.421 35.447 1.00 24.05 C ATOM 98 CG1 VAL A 224 6.648 -2.579 34.955 1.00 26.01 C ATOM 99 CG2 VAL A 224 8.072 -0.615 34.289 1.00 24.67 C ATOM 100 H VAL A 224 8.536 0.162 37.423 1.00 0.00 H ATOM 101 N VAL A 225 4.779 -1.474 37.468 1.00 26.20 N ATOM 102 CA VAL A 225 4.046 -2.202 38.494 1.00 25.84 C ATOM 103 C VAL A 225 3.212 -3.282 37.812 1.00 26.30 C ATOM 104 O VAL A 225 2.588 -3.027 36.792 1.00 26.15 O ATOM 105 CB VAL A 225 3.140 -1.269 39.345 1.00 27.65 C ATOM 106 CG1 VAL A 225 2.415 -2.051 40.434 1.00 29.29 C ATOM 107 CG2 VAL A 225 3.954 -0.135 39.968 1.00 26.88 C ATOM 108 H VAL A 225 4.249 -1.046 36.682 1.00 0.00 H ATOM 109 N ALA A 226 3.250 -4.489 38.366 1.00 26.39 N ATOM 110 CA ALA A 226 2.420 -5.596 37.899 1.00 28.24 C ATOM 111 C ALA A 226 1.532 -6.047 39.043 1.00 28.90 C ATOM 112 O ALA A 226 2.001 -6.184 40.170 1.00 28.72 O ATOM 113 CB ALA A 226 3.301 -6.736 37.445 1.00 28.54 C ATOM 114 H ALA A 226 3.897 -4.652 39.164 1.00 0.00 H ATOM 115 N ASP A 227 0.259 -6.308 38.767 1.00 31.56 N ATOM 116 CA ASP A 227 -0.664 -6.718 39.845 1.00 33.90 C ATOM 117 C ASP A 227 -0.619 -8.221 40.128 1.00 34.51 C ATOM 118 O ASP A 227 0.112 -8.963 39.475 1.00 35.13 O ATOM 119 CB ASP A 227 -2.093 -6.230 39.563 1.00 34.48 C ATOM 120 CG ASP A 227 -2.793 -7.001 38.451 1.00 35.56 C ATOM 121 OD1 ASP A 227 -2.157 -7.769 37.698 1.00 35.78 O ATOM 122 OD2 ASP A 227 -4.013 -6.819 38.341 1.00 37.73 O ATOM 123 H ASP A 227 -0.088 -6.224 37.790 1.00 0.00 H ATOM 124 N ASP A 228 -1.396 -8.658 41.119 1.00 37.51 N ATOM 125 CA ASP A 228 -1.439 -10.077 41.506 1.00 38.70 C ATOM 126 C ASP A 228 -1.855 -11.008 40.357 1.00 37.28 C ATOM 127 O ASP A 228 -1.361 -12.138 40.240 1.00 37.05 O ATOM 128 CB ASP A 228 -2.340 -10.291 42.742 1.00 41.74 C ATOM 129 CG ASP A 228 -3.722 -9.662 42.602 1.00 43.77 C ATOM 130 OD1 ASP A 228 -4.122 -9.263 41.490 1.00 47.75 O ATOM 131 OD2 ASP A 228 -4.419 -9.563 43.633 1.00 47.39 O ATOM 132 H ASP A 228 -1.989 -7.976 41.634 1.00 0.00 H ATOM 133 N LYS A 229 -2.735 -10.515 39.493 1.00 38.85 N ATOM 134 CA LYS A 229 -3.172 -11.277 38.325 1.00 37.92 C ATOM 135 C LYS A 229 -2.034 -11.529 37.339 1.00 36.25 C ATOM 136 O LYS A 229 -1.951 -12.600 36.750 1.00 35.32 O ATOM 137 CB LYS A 229 -4.326 -10.565 37.628 1.00 39.65 C ATOM 138 CG LYS A 229 -5.614 -10.510 38.439 1.00 42.25 C ATOM 139 CD LYS A 229 -6.525 -9.406 37.930 1.00 44.66 C ATOM 140 CE LYS A 229 -7.992 -9.790 37.979 1.00 47.55 C ATOM 141 NZ LYS A 229 -8.609 -9.637 39.323 1.00 49.63 N ATOM 142 HZ1 LYS A 229 -8.108 -10.243 40.004 1.00 0.00 H ATOM 143 HZ2 LYS A 229 -8.539 -8.644 39.624 1.00 0.00 H ATOM 144 HZ3 LYS A 229 -9.609 -9.918 39.278 1.00 0.00 H ATOM 145 H LYS A 229 -3.123 -9.563 39.652 1.00 0.00 H ATOM 146 N MET A 230 -1.164 -10.536 37.159 1.00 33.97 N ATOM 147 CA MET A 230 0.017 -10.692 36.321 1.00 33.78 C ATOM 148 C MET A 230 0.968 -11.735 36.896 1.00 36.11 C ATOM 149 O MET A 230 1.546 -12.538 36.153 1.00 34.63 O ATOM 150 CB MET A 230 0.751 -9.354 36.191 1.00 32.73 C ATOM 151 CG MET A 230 -0.001 -8.329 35.365 1.00 32.54 C ATOM 152 SD MET A 230 0.035 -8.661 33.597 1.00 31.14 S ATOM 153 CE MET A 230 1.749 -8.325 33.223 1.00 29.52 C ATOM 154 H MET A 230 -1.333 -9.624 37.630 1.00 0.00 H ATOM 155 N ALA A 231 1.148 -11.702 38.218 1.00 37.86 N ATOM 156 CA ALA A 231 2.018 -12.661 38.900 1.00 39.97 C ATOM 157 C ALA A 231 1.461 -14.073 38.790 1.00 40.47 C ATOM 158 O ALA A 231 2.205 -15.011 38.529 1.00 41.42 O ATOM 159 CB ALA A 231 2.193 -12.285 40.365 1.00 40.94 C ATOM 160 H ALA A 231 0.657 -10.976 38.778 1.00 0.00 H ATOM 161 N ALA A 232 0.156 -14.208 38.996 1.00 42.04 N ATOM 162 CA ALA A 232 -0.511 -15.509 38.946 1.00 43.89 C ATOM 163 C ALA A 232 -0.341 -16.163 37.579 1.00 44.71 C ATOM 164 O ALA A 232 -0.111 -17.376 37.495 1.00 48.57 O ATOM 165 CB ALA A 232 -1.988 -15.360 39.275 1.00 43.97 C ATOM 166 H ALA A 232 -0.411 -13.360 39.200 1.00 0.00 H ATOM 167 N PHE A 233 -0.442 -15.359 36.516 1.00 44.80 N ATOM 168 CA PHE A 233 -0.378 -15.870 35.142 1.00 41.54 C ATOM 169 C PHE A 233 1.042 -16.095 34.617 1.00 40.53 C ATOM 170 O PHE A 233 1.343 -17.161 34.075 1.00 39.80 O ATOM 171 CB PHE A 233 -1.125 -14.957 34.164 1.00 41.20 C ATOM 172 CG PHE A 233 -1.115 -15.475 32.751 1.00 43.31 C ATOM 173 CD1 PHE A 233 -2.012 -16.454 32.352 1.00 43.86 C ATOM 174 CD2 PHE A 233 -0.168 -15.026 31.837 1.00 42.59 C ATOM 175 CE1 PHE A 233 -1.986 -16.951 31.059 1.00 43.58 C ATOM 176 CE2 PHE A 233 -0.136 -15.515 30.548 1.00 43.65 C ATOM 177 CZ PHE A 233 -1.049 -16.481 30.157 1.00 44.43 C ATOM 178 H PHE A 233 -0.570 -14.338 36.668 1.00 0.00 H ATOM 179 N HIS A 234 1.901 -15.086 34.755 1.00 38.19 N ATOM 180 CA HIS A 234 3.263 -15.155 34.211 1.00 38.52 C ATOM 181 C HIS A 234 4.250 -15.839 35.154 1.00 37.98 C ATOM 182 O HIS A 234 5.303 -16.311 34.712 1.00 37.82 O ATOM 183 CB HIS A 234 3.779 -13.754 33.878 1.00 37.81 C ATOM 184 CG HIS A 234 3.057 -13.100 32.744 1.00 37.81 C ATOM 185 ND1 HIS A 234 3.335 -13.385 31.424 1.00 37.38 N ATOM 186 CD2 HIS A 234 2.067 -12.176 32.731 1.00 37.13 C ATOM 187 CE1 HIS A 234 2.546 -12.663 30.647 1.00 37.18 C ATOM 188 NE2 HIS A 234 1.768 -11.922 31.416 1.00 37.47 N ATOM 189 H HIS A 234 1.599 -14.229 35.260 1.00 0.00 H ATOM 190 N GLY A 235 3.913 -15.841 36.444 1.00 39.24 N ATOM 191 CA GLY A 235 4.725 -16.456 37.499 1.00 40.38 C ATOM 192 C GLY A 235 6.161 -15.991 37.512 1.00 39.98 C ATOM 193 O GLY A 235 6.436 -14.798 37.377 1.00 39.61 O ATOM 194 H GLY A 235 3.022 -15.379 36.718 1.00 0.00 H ATOM 195 N ALA A 236 7.071 -16.950 37.677 1.00 40.16 N ATOM 196 CA ALA A 236 8.521 -16.716 37.640 1.00 40.55 C ATOM 197 C ALA A 236 9.031 -15.942 36.410 1.00 38.74 C ATOM 198 O ALA A 236 10.073 -15.297 36.492 1.00 40.95 O ATOM 199 CB ALA A 236 9.256 -18.051 37.717 1.00 40.94 C ATOM 200 H ALA A 236 6.735 -17.921 37.842 1.00 0.00 H ATOM 201 N GLY A 237 8.323 -16.019 35.282 1.00 37.09 N ATOM 202 CA GLY A 237 8.738 -15.311 34.057 1.00 36.55 C ATOM 203 C GLY A 237 8.263 -13.865 33.931 1.00 35.26 C ATOM 204 O GLY A 237 8.504 -13.223 32.897 1.00 35.64 O ATOM 205 H GLY A 237 7.456 -16.593 35.266 1.00 0.00 H ATOM 206 N LEU A 238 7.602 -13.357 34.972 1.00 34.12 N ATOM 207 CA LEU A 238 7.022 -12.000 34.953 1.00 32.71 C ATOM 208 C LEU A 238 8.038 -10.869 34.786 1.00 32.64 C ATOM 209 O LEU A 238 7.832 -9.975 33.965 1.00 29.99 O ATOM 210 CB LEU A 238 6.199 -11.749 36.216 1.00 32.76 C ATOM 211 CG LEU A 238 5.457 -10.408 36.268 1.00 33.57 C ATOM 212 CD1 LEU A 238 4.584 -10.174 35.038 1.00 33.17 C ATOM 213 CD2 LEU A 238 4.625 -10.304 37.528 1.00 33.69 C ATOM 214 H LEU A 238 7.491 -13.938 35.828 1.00 0.00 H ATOM 215 N LYS A 239 9.115 -10.884 35.564 1.00 32.98 N ATOM 216 CA LYS A 239 10.104 -9.813 35.480 1.00 33.98 C ATOM 217 C LYS A 239 10.686 -9.740 34.075 1.00 33.26 C ATOM 218 O LYS A 239 10.772 -8.670 33.476 1.00 32.13 O ATOM 219 CB LYS A 239 11.220 -10.004 36.513 1.00 36.44 C ATOM 220 CG LYS A 239 12.178 -8.829 36.572 1.00 38.39 C ATOM 221 CD LYS A 239 13.074 -8.827 37.804 1.00 41.51 C ATOM 222 CE LYS A 239 13.620 -7.429 38.050 1.00 43.81 C ATOM 223 NZ LYS A 239 14.680 -7.350 39.095 1.00 46.18 N ATOM 224 HZ1 LYS A 239 14.298 -7.688 40.001 1.00 0.00 H ATOM 225 HZ2 LYS A 239 15.487 -7.944 38.815 1.00 0.00 H ATOM 226 HZ3 LYS A 239 14.993 -6.363 39.196 1.00 0.00 H ATOM 227 H LYS A 239 9.255 -11.664 36.238 1.00 0.00 H ATOM 228 N ARG A 240 11.068 -10.888 33.529 1.00 33.02 N ATOM 229 CA ARG A 240 11.598 -10.917 32.180 1.00 33.71 C ATOM 230 C ARG A 240 10.551 -10.412 31.181 1.00 31.36 C ATOM 231 O ARG A 240 10.874 -9.669 30.263 1.00 29.92 O ATOM 232 CB ARG A 240 12.037 -12.328 31.797 1.00 36.60 C ATOM 233 CG ARG A 240 12.770 -12.365 30.473 1.00 40.47 C ATOM 234 CD ARG A 240 13.499 -13.673 30.272 1.00 45.00 C ATOM 235 NE ARG A 240 14.459 -13.549 29.178 1.00 49.82 N ATOM 236 CZ ARG A 240 15.639 -14.166 29.123 1.00 53.31 C ATOM 237 NH1 ARG A 240 16.043 -14.970 30.105 1.00 53.18 N ATOM 238 NH2 ARG A 240 16.427 -13.973 28.070 1.00 55.97 N ATOM 239 HE ARG A 240 14.202 -12.932 28.381 1.00 0.00 H ATOM 240 HH12 ARG A 240 16.967 -15.442 30.043 1.00 0.00 H ATOM 241 HH11 ARG A 240 15.434 -15.125 30.934 1.00 0.00 H ATOM 242 HH22 ARG A 240 17.350 -14.450 28.017 1.00 0.00 H ATOM 243 HH21 ARG A 240 16.121 -13.345 27.299 1.00 0.00 H ATOM 244 H ARG A 240 10.987 -11.771 34.072 1.00 0.00 H ATOM 245 N TYR A 241 9.298 -10.798 31.389 1.00 30.79 N ATOM 246 CA TYR A 241 8.229 -10.394 30.485 1.00 30.01 C ATOM 247 C TYR A 241 8.064 -8.878 30.483 1.00 28.44 C ATOM 248 O TYR A 241 7.986 -8.265 29.414 1.00 28.35 O ATOM 249 CB TYR A 241 6.916 -11.083 30.842 1.00 30.15 C ATOM 250 CG TYR A 241 5.766 -10.624 29.981 1.00 29.37 C ATOM 251 CD1 TYR A 241 5.756 -10.853 28.615 1.00 29.94 C ATOM 252 CD2 TYR A 241 4.701 -9.921 30.534 1.00 28.52 C ATOM 253 CE1 TYR A 241 4.704 -10.420 27.821 1.00 29.60 C ATOM 254 CE2 TYR A 241 3.647 -9.485 29.745 1.00 28.64 C ATOM 255 CZ TYR A 241 3.652 -9.736 28.393 1.00 28.54 C ATOM 256 OH TYR A 241 2.612 -9.300 27.596 1.00 29.18 O ATOM 257 HH TYR A 241 1.765 -9.707 27.908 1.00 0.00 H ATOM 258 H TYR A 241 9.076 -11.398 32.209 1.00 0.00 H ATOM 259 N LEU A 242 8.044 -8.283 31.679 1.00 29.45 N ATOM 260 CA LEU A 242 7.834 -6.844 31.819 1.00 29.50 C ATOM 261 C LEU A 242 8.981 -6.059 31.207 1.00 29.81 C ATOM 262 O LEU A 242 8.742 -5.077 30.507 1.00 28.00 O ATOM 263 CB LEU A 242 7.659 -6.455 33.290 1.00 29.46 C ATOM 264 CG LEU A 242 6.366 -6.947 33.941 1.00 31.16 C ATOM 265 CD1 LEU A 242 6.402 -6.782 35.448 1.00 32.56 C ATOM 266 CD2 LEU A 242 5.159 -6.221 33.377 1.00 31.52 C ATOM 267 H LEU A 242 8.182 -8.860 32.533 1.00 0.00 H ATOM 268 N LEU A 243 10.217 -6.495 31.451 1.00 27.82 N ATOM 269 CA LEU A 243 11.365 -5.833 30.815 1.00 29.58 C ATOM 270 C LEU A 243 11.364 -5.969 29.285 1.00 28.45 C ATOM 271 O LEU A 243 11.825 -5.071 28.585 1.00 28.92 O ATOM 272 CB LEU A 243 12.682 -6.313 31.417 1.00 31.39 C ATOM 273 CG LEU A 243 12.864 -5.946 32.888 1.00 32.77 C ATOM 274 CD1 LEU A 243 14.142 -6.579 33.419 1.00 33.05 C ATOM 275 CD2 LEU A 243 12.857 -4.445 33.132 1.00 32.79 C ATOM 276 H LEU A 243 10.369 -7.302 32.090 1.00 0.00 H ATOM 277 N THR A 244 10.860 -7.089 28.772 1.00 29.25 N ATOM 278 CA THR A 244 10.739 -7.285 27.331 1.00 30.10 C ATOM 279 C THR A 244 9.699 -6.315 26.757 1.00 28.79 C ATOM 280 O THR A 244 9.958 -5.649 25.769 1.00 30.18 O ATOM 281 CB THR A 244 10.385 -8.747 26.997 1.00 31.15 C ATOM 282 OG1 THR A 244 11.424 -9.603 27.491 1.00 33.82 O ATOM 283 CG2 THR A 244 10.226 -8.965 25.493 1.00 30.92 C ATOM 284 HG1 THR A 244 11.502 -9.493 28.472 1.00 0.00 H ATOM 285 H THR A 244 10.544 -7.844 29.414 1.00 0.00 H ATOM 286 N VAL A 245 8.553 -6.208 27.424 1.00 27.25 N ATOM 287 CA VAL A 245 7.484 -5.297 27.010 1.00 26.55 C ATOM 288 C VAL A 245 8.014 -3.861 27.007 1.00 24.84 C ATOM 289 O VAL A 245 7.806 -3.103 26.054 1.00 25.92 O ATOM 290 CB VAL A 245 6.229 -5.443 27.914 1.00 26.43 C ATOM 291 CG1 VAL A 245 5.247 -4.302 27.707 1.00 27.84 C ATOM 292 CG2 VAL A 245 5.523 -6.771 27.636 1.00 27.32 C ATOM 293 H VAL A 245 8.411 -6.794 28.272 1.00 0.00 H ATOM 294 N MET A 246 8.735 -3.506 28.064 1.00 25.49 N ATOM 295 CA MET A 246 9.209 -2.142 28.218 1.00 25.28 C ATOM 296 C MET A 246 10.357 -1.847 27.248 1.00 25.97 C ATOM 297 O MET A 246 10.470 -0.747 26.737 1.00 26.20 O ATOM 298 CB MET A 246 9.591 -1.853 29.684 1.00 26.19 C ATOM 299 CG MET A 246 8.403 -1.765 30.645 1.00 26.02 C ATOM 300 SD MET A 246 7.152 -0.547 30.197 1.00 26.94 S ATOM 301 CE MET A 246 8.073 0.947 30.560 1.00 26.79 C ATOM 302 H MET A 246 8.963 -4.214 28.791 1.00 0.00 H ATOM 303 N ALA A 247 11.196 -2.834 26.959 1.00 25.58 N ATOM 304 CA ALA A 247 12.212 -2.649 25.922 1.00 26.44 C ATOM 305 C ALA A 247 11.577 -2.309 24.577 1.00 26.08 C ATOM 306 O ALA A 247 12.090 -1.476 23.837 1.00 27.28 O ATOM 307 CB ALA A 247 13.075 -3.893 25.791 1.00 27.67 C ATOM 308 H ALA A 247 11.131 -3.738 27.469 1.00 0.00 H ATOM 309 N ALA A 248 10.498 -3.007 24.239 1.00 26.56 N ATOM 310 CA ALA A 248 9.781 -2.760 23.005 1.00 26.30 C ATOM 311 C ALA A 248 9.139 -1.375 22.990 1.00 26.65 C ATOM 312 O ALA A 248 9.231 -0.644 21.993 1.00 26.70 O ATOM 313 CB ALA A 248 8.741 -3.833 22.785 1.00 28.15 C ATOM 314 H ALA A 248 10.158 -3.753 24.879 1.00 0.00 H ATOM 315 N ALA A 249 8.501 -0.990 24.093 1.00 24.29 N ATOM 316 CA ALA A 249 7.982 0.377 24.181 1.00 24.87 C ATOM 317 C ALA A 249 9.111 1.406 24.061 1.00 24.52 C ATOM 318 O ALA A 249 8.966 2.443 23.420 1.00 24.52 O ATOM 319 CB ALA A 249 7.219 0.568 25.478 1.00 24.77 C ATOM 320 H ALA A 249 8.372 -1.653 24.884 1.00 0.00 H ATOM 321 N ALA A 250 10.246 1.121 24.686 1.00 24.86 N ATOM 322 CA ALA A 250 11.386 2.033 24.617 1.00 25.86 C ATOM 323 C ALA A 250 11.893 2.180 23.183 1.00 25.85 C ATOM 324 O ALA A 250 12.277 3.264 22.746 1.00 27.80 O ATOM 325 CB ALA A 250 12.487 1.565 25.545 1.00 26.92 C ATOM 326 H ALA A 250 10.325 0.239 25.231 1.00 0.00 H ATOM 327 N LYS A 251 11.854 1.090 22.425 1.00 27.97 N ATOM 328 CA LYS A 251 12.290 1.141 21.035 1.00 29.84 C ATOM 329 C LYS A 251 11.401 2.090 20.226 1.00 28.43 C ATOM 330 O LYS A 251 11.897 2.906 19.432 1.00 30.10 O ATOM 331 CB LYS A 251 12.276 -0.250 20.438 1.00 31.55 C ATOM 332 CG LYS A 251 12.913 -0.316 19.072 1.00 34.57 C ATOM 333 CD LYS A 251 12.901 -1.736 18.547 1.00 36.95 C ATOM 334 CE LYS A 251 13.518 -1.798 17.162 1.00 40.82 C ATOM 335 NZ LYS A 251 13.248 -3.114 16.530 1.00 44.18 N ATOM 336 HZ1 LYS A 251 13.657 -3.869 17.116 1.00 0.00 H ATOM 337 HZ2 LYS A 251 12.221 -3.254 16.449 1.00 0.00 H ATOM 338 HZ3 LYS A 251 13.678 -3.137 15.583 1.00 0.00 H ATOM 339 H LYS A 251 11.510 0.194 22.826 1.00 0.00 H ATOM 340 N ALA A 252 10.091 2.013 20.458 1.00 28.31 N ATOM 341 CA ALA A 252 9.152 2.961 19.842 1.00 27.80 C ATOM 342 C ALA A 252 9.503 4.406 20.149 1.00 27.67 C ATOM 343 O ALA A 252 9.502 5.245 19.238 1.00 29.58 O ATOM 344 CB ALA A 252 7.719 2.668 20.259 1.00 27.09 C ATOM 345 H ALA A 252 9.727 1.269 21.086 1.00 0.00 H ATOM 346 N PHE A 253 9.840 4.704 21.407 1.00 27.43 N ATOM 347 CA PHE A 253 10.142 6.081 21.819 1.00 28.52 C ATOM 348 C PHE A 253 11.483 6.610 21.317 1.00 29.42 C ATOM 349 O PHE A 253 11.729 7.800 21.409 1.00 30.48 O ATOM 350 CB PHE A 253 10.008 6.255 23.342 1.00 29.14 C ATOM 351 CG PHE A 253 8.623 6.597 23.767 1.00 28.98 C ATOM 352 CD1 PHE A 253 7.713 5.611 24.105 1.00 28.80 C ATOM 353 CD2 PHE A 253 8.203 7.922 23.763 1.00 29.00 C ATOM 354 CE1 PHE A 253 6.421 5.938 24.456 1.00 29.16 C ATOM 355 CE2 PHE A 253 6.914 8.254 24.123 1.00 29.56 C ATOM 356 CZ PHE A 253 6.017 7.257 24.468 1.00 29.67 C ATOM 357 H PHE A 253 9.890 3.941 22.112 1.00 0.00 H ATOM 358 N LYS A 254 12.331 5.733 20.784 1.00 31.53 N ATOM 359 CA LYS A 254 13.558 6.181 20.132 1.00 33.75 C ATOM 360 C LYS A 254 13.433 6.275 18.618 1.00 32.85 C ATOM 361 O LYS A 254 14.386 6.676 17.939 1.00 33.72 O ATOM 362 CB LYS A 254 14.720 5.270 20.514 1.00 34.75 C ATOM 363 CG LYS A 254 15.369 5.678 21.828 1.00 38.00 C ATOM 364 CD LYS A 254 15.995 4.481 22.526 1.00 39.84 C ATOM 365 CE LYS A 254 16.140 4.705 24.025 1.00 41.22 C ATOM 366 NZ LYS A 254 15.627 3.543 24.800 1.00 39.32 N ATOM 367 HZ1 LYS A 254 14.620 3.401 24.583 1.00 0.00 H ATOM 368 HZ2 LYS A 254 16.163 2.691 24.540 1.00 0.00 H ATOM 369 HZ3 LYS A 254 15.741 3.729 25.817 1.00 0.00 H ATOM 370 H LYS A 254 12.117 4.716 20.833 1.00 0.00 H ATOM 371 N HIS A 255 12.279 5.923 18.067 1.00 33.23 N ATOM 372 CA HIS A 255 12.136 5.979 16.624 1.00 34.23 C ATOM 373 C HIS A 255 12.174 7.443 16.174 1.00 33.85 C ATOM 374 O HIS A 255 11.547 8.309 16.795 1.00 32.37 O ATOM 375 CB HIS A 255 10.870 5.270 16.149 1.00 32.92 C ATOM 376 CG HIS A 255 10.806 5.103 14.661 1.00 34.28 C ATOM 377 ND1 HIS A 255 10.364 6.102 13.825 1.00 33.67 N ATOM 378 CD2 HIS A 255 11.158 4.070 13.856 1.00 34.32 C ATOM 379 CE1 HIS A 255 10.427 5.694 12.571 1.00 33.69 C ATOM 380 NE2 HIS A 255 10.907 4.463 12.561 1.00 34.98 N ATOM 381 H HIS A 255 11.486 5.610 18.662 1.00 0.00 H ATOM 382 N PRO A 256 12.945 7.734 15.109 1.00 34.42 N ATOM 383 CA PRO A 256 13.108 9.112 14.644 1.00 34.20 C ATOM 384 C PRO A 256 11.801 9.875 14.333 1.00 32.67 C ATOM 385 O PRO A 256 11.771 11.104 14.484 1.00 34.73 O ATOM 386 CB PRO A 256 13.952 8.949 13.371 1.00 35.32 C ATOM 387 CG PRO A 256 14.689 7.671 13.564 1.00 35.38 C ATOM 388 CD PRO A 256 13.744 6.782 14.311 1.00 35.46 C ATOM 389 N SER A 257 10.754 9.166 13.896 1.00 32.23 N ATOM 390 CA SER A 257 9.410 9.749 13.682 1.00 32.83 C ATOM 391 C SER A 257 8.857 10.558 14.865 1.00 33.51 C ATOM 392 O SER A 257 8.036 11.450 14.658 1.00 33.79 O ATOM 393 CB SER A 257 8.374 8.691 13.247 1.00 33.31 C ATOM 394 OG SER A 257 8.075 7.761 14.280 1.00 31.17 O ATOM 395 HG SER A 257 8.902 7.286 14.545 1.00 0.00 H ATOM 396 H SER A 257 10.891 8.155 13.697 1.00 0.00 H ATOM 397 N ILE A 258 9.320 10.282 16.083 1.00 32.13 N ATOM 398 CA ILE A 258 8.887 11.033 17.268 1.00 32.34 C ATOM 399 C ILE A 258 9.511 12.437 17.360 1.00 34.53 C ATOM 400 O ILE A 258 9.041 13.286 18.126 1.00 34.68 O ATOM 401 CB ILE A 258 9.143 10.212 18.569 1.00 32.83 C ATOM 402 CG1 ILE A 258 8.223 10.682 19.707 1.00 33.15 C ATOM 403 CG2 ILE A 258 10.607 10.281 18.984 1.00 33.01 C ATOM 404 CD1 ILE A 258 8.249 9.760 20.918 1.00 32.62 C ATOM 405 H ILE A 258 10.009 9.511 16.198 1.00 0.00 H ATOM 406 N ARG A 259 10.584 12.656 16.597 1.00 36.91 N ATOM 407 CA ARG A 259 11.287 13.951 16.477 1.00 39.63 C ATOM 408 C ARG A 259 12.060 14.403 17.717 1.00 40.48 C ATOM 409 O ARG A 259 13.124 14.990 17.583 1.00 41.02 O ATOM 410 CB ARG A 259 10.373 15.084 15.986 1.00 41.94 C ATOM 411 CG ARG A 259 11.156 16.370 15.713 1.00 45.54 C ATOM 412 CD ARG A 259 10.522 17.264 14.660 1.00 47.57 C ATOM 413 NE ARG A 259 9.395 18.026 15.195 1.00 48.55 N ATOM 414 CZ ARG A 259 8.160 18.055 14.685 1.00 53.07 C ATOM 415 NH1 ARG A 259 7.229 18.797 15.274 1.00 53.03 N ATOM 416 NH2 ARG A 259 7.837 17.362 13.591 1.00 54.01 N ATOM 417 HE ARG A 259 9.570 18.596 16.047 1.00 0.00 H ATOM 418 HH12 ARG A 259 6.265 18.827 14.885 1.00 0.00 H ATOM 419 HH11 ARG A 259 7.464 19.348 16.124 1.00 0.00 H ATOM 420 HH22 ARG A 259 6.868 17.404 13.216 1.00 0.00 H ATOM 421 HH21 ARG A 259 8.555 16.780 13.113 1.00 0.00 H ATOM 422 H ARG A 259 10.953 11.855 16.045 1.00 0.00 H ATOM 423 N ASN A 260 11.516 14.192 18.909 1.00 41.08 N ATOM 424 CA ASN A 260 12.250 14.453 20.143 1.00 41.20 C ATOM 425 C ASN A 260 12.328 13.128 20.875 1.00 40.22 C ATOM 426 O ASN A 260 11.515 12.883 21.770 1.00 38.26 O ATOM 427 CB ASN A 260 11.519 15.486 21.013 1.00 42.61 C ATOM 428 CG ASN A 260 11.917 16.921 20.711 1.00 46.11 C ATOM 429 OD1 ASN A 260 12.026 17.735 21.632 1.00 52.02 O ATOM 430 ND2 ASN A 260 12.117 17.250 19.435 1.00 49.87 N ATOM 431 HD22 ASN A 260 12.014 16.531 18.690 1.00 0.00 H ATOM 432 HD21 ASN A 260 12.376 18.225 19.184 1.00 0.00 H ATOM 433 H ASN A 260 10.542 13.832 18.965 1.00 0.00 H ATOM 434 N PRO A 261 13.272 12.251 20.477 1.00 37.90 N ATOM 435 CA PRO A 261 13.308 10.950 21.131 1.00 38.36 C ATOM 436 C PRO A 261 13.654 11.029 22.615 1.00 38.36 C ATOM 437 O PRO A 261 14.321 11.968 23.076 1.00 42.73 O ATOM 438 CB PRO A 261 14.380 10.169 20.355 1.00 39.44 C ATOM 439 CG PRO A 261 15.183 11.191 19.635 1.00 40.17 C ATOM 440 CD PRO A 261 14.277 12.365 19.403 1.00 40.15 C ATOM 441 N VAL A 262 13.163 10.046 23.356 1.00 36.26 N ATOM 442 CA VAL A 262 13.336 10.002 24.788 1.00 33.97 C ATOM 443 C VAL A 262 13.703 8.569 25.127 1.00 31.69 C ATOM 444 O VAL A 262 13.321 7.635 24.416 1.00 32.01 O ATOM 445 CB VAL A 262 12.053 10.437 25.542 1.00 35.31 C ATOM 446 CG1 VAL A 262 11.582 11.818 25.088 1.00 35.01 C ATOM 447 CG2 VAL A 262 10.936 9.435 25.350 1.00 35.99 C ATOM 448 H VAL A 262 12.635 9.281 22.890 1.00 0.00 H ATOM 449 N SER A 263 14.466 8.403 26.195 1.00 28.69 N ATOM 450 CA SER A 263 14.870 7.082 26.640 1.00 28.06 C ATOM 451 C SER A 263 13.941 6.652 27.775 1.00 26.80 C ATOM 452 O SER A 263 14.003 7.213 28.862 1.00 26.86 O ATOM 453 CB SER A 263 16.328 7.099 27.126 1.00 28.59 C ATOM 454 OG SER A 263 17.221 7.351 26.051 1.00 30.82 O ATOM 455 HG SER A 263 17.010 8.230 25.648 1.00 0.00 H ATOM 456 H SER A 263 14.783 9.238 26.728 1.00 0.00 H ATOM 457 N LEU A 264 13.068 5.683 27.502 1.00 25.65 N ATOM 458 CA LEU A 264 12.206 5.117 28.523 1.00 25.68 C ATOM 459 C LEU A 264 13.021 4.094 29.311 1.00 25.82 C ATOM 460 O LEU A 264 13.385 3.041 28.782 1.00 27.00 O ATOM 461 CB LEU A 264 10.990 4.472 27.858 1.00 26.16 C ATOM 462 CG LEU A 264 9.872 3.924 28.734 1.00 25.95 C ATOM 463 CD1 LEU A 264 9.150 5.032 29.482 1.00 26.70 C ATOM 464 CD2 LEU A 264 8.913 3.152 27.839 1.00 25.97 C ATOM 465 H LEU A 264 13.003 5.322 26.529 1.00 0.00 H ATOM 466 N VAL A 265 13.301 4.407 30.566 1.00 24.30 N ATOM 467 CA VAL A 265 14.203 3.586 31.372 1.00 25.66 C ATOM 468 C VAL A 265 13.478 2.991 32.575 1.00 26.26 C ATOM 469 O VAL A 265 12.976 3.723 33.425 1.00 27.57 O ATOM 470 CB VAL A 265 15.385 4.452 31.849 1.00 26.81 C ATOM 471 CG1 VAL A 265 16.402 3.615 32.578 1.00 29.02 C ATOM 472 CG2 VAL A 265 16.038 5.181 30.679 1.00 27.90 C ATOM 473 H VAL A 265 12.870 5.255 30.988 1.00 0.00 H ATOM 474 N VAL A 266 13.431 1.662 32.679 1.00 26.11 N ATOM 475 CA VAL A 266 12.867 1.047 33.879 1.00 26.01 C ATOM 476 C VAL A 266 13.876 1.188 35.005 1.00 26.69 C ATOM 477 O VAL A 266 14.991 0.682 34.890 1.00 26.35 O ATOM 478 CB VAL A 266 12.515 -0.440 33.691 1.00 26.22 C ATOM 479 CG1 VAL A 266 11.920 -1.029 34.972 1.00 26.88 C ATOM 480 CG2 VAL A 266 11.546 -0.594 32.524 1.00 26.90 C ATOM 481 H VAL A 266 13.795 1.065 31.909 1.00 0.00 H ATOM 482 N THR A 267 13.482 1.903 36.060 1.00 25.13 N ATOM 483 CA THR A 267 14.337 2.087 37.263 1.00 25.88 C ATOM 484 C THR A 267 13.828 1.356 38.521 1.00 26.68 C ATOM 485 O THR A 267 14.606 1.062 39.448 1.00 27.92 O ATOM 486 CB THR A 267 14.537 3.582 37.557 1.00 26.48 C ATOM 487 OG1 THR A 267 13.260 4.212 37.755 1.00 27.49 O ATOM 488 CG2 THR A 267 15.235 4.249 36.403 1.00 25.88 C ATOM 489 HG1 THR A 267 13.394 5.175 37.944 1.00 0.00 H ATOM 490 H THR A 267 12.542 2.348 36.041 1.00 0.00 H ATOM 491 N ARG A 268 12.530 1.084 38.568 1.00 25.85 N ATOM 492 CA ARG A 268 11.933 0.322 39.637 1.00 26.16 C ATOM 493 C ARG A 268 10.864 -0.587 39.060 1.00 26.41 C ATOM 494 O ARG A 268 10.176 -0.239 38.097 1.00 25.10 O ATOM 495 CB ARG A 268 11.336 1.256 40.701 1.00 26.35 C ATOM 496 CG ARG A 268 12.400 2.010 41.478 1.00 26.93 C ATOM 497 CD ARG A 268 11.824 3.035 42.440 1.00 26.21 C ATOM 498 NE ARG A 268 11.116 2.411 43.541 1.00 26.93 N ATOM 499 CZ ARG A 268 10.534 3.079 44.534 1.00 26.42 C ATOM 500 NH1 ARG A 268 10.570 4.407 44.553 1.00 28.32 N ATOM 501 NH2 ARG A 268 9.884 2.425 45.476 1.00 28.93 N ATOM 502 HE ARG A 268 11.059 1.373 43.556 1.00 0.00 H ATOM 503 HH12 ARG A 268 10.115 4.928 45.329 1.00 0.00 H ATOM 504 HH11 ARG A 268 11.053 4.925 43.792 1.00 0.00 H ATOM 505 HH22 ARG A 268 9.429 2.947 46.252 1.00 0.00 H ATOM 506 HH21 ARG A 268 9.826 1.387 45.443 1.00 0.00 H ATOM 507 H ARG A 268 11.919 1.434 37.803 1.00 0.00 H ATOM 508 N LEU A 269 10.764 -1.765 39.646 1.00 27.89 N ATOM 509 CA LEU A 269 9.822 -2.764 39.182 1.00 28.79 C ATOM 510 C LEU A 269 9.185 -3.388 40.410 1.00 28.81 C ATOM 511 O LEU A 269 9.877 -4.001 41.231 1.00 30.91 O ATOM 512 CB LEU A 269 10.534 -3.809 38.319 1.00 28.92 C ATOM 513 CG LEU A 269 9.652 -4.778 37.519 1.00 29.60 C ATOM 514 CD1 LEU A 269 10.368 -5.222 36.249 1.00 29.08 C ATOM 515 CD2 LEU A 269 9.265 -5.986 38.357 1.00 29.77 C ATOM 516 H LEU A 269 11.375 -1.982 40.459 1.00 0.00 H ATOM 517 N VAL A 270 7.872 -3.200 40.542 1.00 28.52 N ATOM 518 CA VAL A 270 7.088 -3.719 41.661 1.00 30.49 C ATOM 519 C VAL A 270 6.134 -4.824 41.195 1.00 32.24 C ATOM 520 O VAL A 270 5.367 -4.635 40.247 1.00 30.54 O ATOM 521 CB VAL A 270 6.276 -2.594 42.327 1.00 30.56 C ATOM 522 CG1 VAL A 270 5.392 -3.126 43.462 1.00 33.24 C ATOM 523 CG2 VAL A 270 7.216 -1.539 42.872 1.00 31.03 C ATOM 524 H VAL A 270 7.378 -2.654 39.808 1.00 0.00 H ATOM 525 N ILE A 271 6.196 -5.980 41.856 1.00 33.64 N ATOM 526 CA ILE A 271 5.243 -7.066 41.588 1.00 35.94 C ATOM 527 C ILE A 271 4.386 -7.235 42.841 1.00 37.70 C ATOM 528 O ILE A 271 4.914 -7.557 43.906 1.00 42.18 O ATOM 529 CB ILE A 271 5.960 -8.386 41.222 1.00 35.44 C ATOM 530 CG1 ILE A 271 6.850 -8.193 39.981 1.00 36.51 C ATOM 531 CG2 ILE A 271 4.947 -9.498 40.987 1.00 36.53 C ATOM 532 CD1 ILE A 271 7.718 -9.382 39.605 1.00 38.00 C ATOM 533 H ILE A 271 6.934 -6.116 42.576 1.00 0.00 H ATOM 534 N LEU A 272 3.080 -7.012 42.722 1.00 39.48 N ATOM 535 CA LEU A 272 2.181 -7.044 43.883 1.00 40.36 C ATOM 536 C LEU A 272 1.704 -8.464 44.186 1.00 43.17 C ATOM 537 O LEU A 272 1.019 -9.080 43.373 1.00 45.86 O ATOM 538 CB LEU A 272 0.987 -6.115 43.664 1.00 40.60 C ATOM 539 CG LEU A 272 1.336 -4.637 43.426 1.00 41.73 C ATOM 540 CD1 LEU A 272 0.124 -3.882 42.907 1.00 41.76 C ATOM 541 CD2 LEU A 272 1.880 -3.982 44.686 1.00 42.56 C ATOM 542 H LEU A 272 2.685 -6.810 41.782 1.00 0.00 H TER 543 LEU A 272 ATOM 544 N GLY A 278 -1.754 -2.706 48.004 1.00 48.47 N ATOM 545 CA GLY A 278 -1.815 -2.272 46.614 1.00 47.78 C ATOM 546 C GLY A 278 -3.048 -1.458 46.255 1.00 47.19 C ATOM 547 O GLY A 278 -3.924 -1.243 47.093 1.00 48.29 O ATOM 548 HN3 GLY A 278 -2.580 -3.301 48.217 1.00 0.00 H ATOM 549 HN2 GLY A 278 -1.756 -1.873 48.626 1.00 0.00 H ATOM 550 HN1 GLY A 278 -0.883 -3.253 48.157 1.00 0.00 H ATOM 551 N PRO A 279 -3.123 -1.000 44.992 1.00 44.53 N ATOM 552 CA PRO A 279 -4.228 -0.187 44.488 1.00 42.63 C ATOM 553 C PRO A 279 -5.462 -1.012 44.113 1.00 42.15 C ATOM 554 O PRO A 279 -5.367 -2.229 43.950 1.00 41.72 O ATOM 555 CB PRO A 279 -3.626 0.456 43.241 1.00 43.07 C ATOM 556 CG PRO A 279 -2.681 -0.574 42.730 1.00 43.21 C ATOM 557 CD PRO A 279 -2.102 -1.234 43.952 1.00 44.50 C ATOM 558 N GLN A 280 -6.605 -0.344 43.971 1.00 43.52 N ATOM 559 CA GLN A 280 -7.857 -1.016 43.606 1.00 44.66 C ATOM 560 C GLN A 280 -7.980 -1.227 42.097 1.00 41.67 C ATOM 561 O GLN A 280 -8.149 -0.275 41.338 1.00 42.12 O ATOM 562 CB GLN A 280 -9.061 -0.219 44.125 1.00 47.03 C ATOM 563 CG GLN A 280 -9.048 -0.013 45.634 1.00 49.33 C ATOM 564 CD GLN A 280 -8.805 -1.311 46.389 1.00 52.01 C ATOM 565 OE1 GLN A 280 -7.670 -1.624 46.751 1.00 56.15 O ATOM 566 NE2 GLN A 280 -9.866 -2.091 46.597 1.00 54.52 N ATOM 567 HE22 GLN A 280 -10.807 -1.787 46.274 1.00 0.00 H ATOM 568 HE21 GLN A 280 -9.753 -3.004 47.082 1.00 0.00 H ATOM 569 H GLN A 280 -6.610 0.685 44.123 1.00 0.00 H ATOM 570 N VAL A 281 -7.897 -2.485 41.669 1.00 41.62 N ATOM 571 CA VAL A 281 -8.014 -2.826 40.255 1.00 40.86 C ATOM 572 C VAL A 281 -9.367 -3.466 39.980 1.00 39.90 C ATOM 573 O VAL A 281 -9.694 -4.494 40.561 1.00 38.81 O ATOM 574 CB VAL A 281 -6.912 -3.804 39.812 1.00 42.06 C ATOM 575 CG1 VAL A 281 -7.039 -4.104 38.324 1.00 41.53 C ATOM 576 CG2 VAL A 281 -5.535 -3.229 40.133 1.00 41.86 C ATOM 577 H VAL A 281 -7.745 -3.246 42.362 1.00 0.00 H ATOM 578 N GLY A 282 -10.139 -2.847 39.095 1.00 40.91 N ATOM 579 CA GLY A 282 -11.430 -3.389 38.675 1.00 42.18 C ATOM 580 C GLY A 282 -11.758 -3.034 37.239 1.00 42.51 C ATOM 581 O GLY A 282 -10.914 -2.474 36.530 1.00 42.49 O ATOM 582 H GLY A 282 -9.815 -1.947 38.687 1.00 0.00 H ATOM 583 N PRO A 283 -12.989 -3.366 36.793 1.00 41.19 N ATOM 584 CA PRO A 283 -13.436 -3.156 35.410 1.00 40.43 C ATOM 585 C PRO A 283 -13.370 -1.709 34.924 1.00 40.27 C ATOM 586 O PRO A 283 -13.015 -1.471 33.769 1.00 40.28 O ATOM 587 CB PRO A 283 -14.895 -3.642 35.422 1.00 40.99 C ATOM 588 CG PRO A 283 -14.987 -4.568 36.581 1.00 40.55 C ATOM 589 CD PRO A 283 -13.997 -4.086 37.597 1.00 40.16 C ATOM 590 N SER A 284 -13.714 -0.750 35.783 1.00 37.04 N ATOM 591 CA SER A 284 -13.639 0.649 35.394 1.00 37.37 C ATOM 592 C SER A 284 -12.177 1.033 35.265 1.00 37.13 C ATOM 593 O SER A 284 -11.420 0.984 36.243 1.00 35.59 O ATOM 594 CB SER A 284 -14.301 1.560 36.418 1.00 36.27 C ATOM 595 OG SER A 284 -13.986 2.914 36.153 1.00 39.23 O ATOM 596 HG SER A 284 -14.310 3.156 35.249 1.00 0.00 H ATOM 597 H SER A 284 -14.038 -1.004 36.738 1.00 0.00 H ATOM 598 N ALA A 285 -11.791 1.417 34.055 1.00 35.04 N ATOM 599 CA ALA A 285 -10.439 1.894 33.805 1.00 35.87 C ATOM 600 C ALA A 285 -10.195 3.231 34.499 1.00 36.66 C ATOM 601 O ALA A 285 -9.122 3.454 35.062 1.00 34.16 O ATOM 602 CB ALA A 285 -10.201 2.021 32.316 1.00 36.14 C ATOM 603 H ALA A 285 -12.470 1.376 33.268 1.00 0.00 H ATOM 604 N ALA A 286 -11.190 4.118 34.465 1.00 35.11 N ATOM 605 CA ALA A 286 -11.054 5.434 35.099 1.00 35.46 C ATOM 606 C ALA A 286 -10.744 5.333 36.588 1.00 36.76 C ATOM 607 O ALA A 286 -9.850 6.016 37.087 1.00 36.01 O ATOM 608 CB ALA A 286 -12.309 6.268 34.872 1.00 35.36 C ATOM 609 H ALA A 286 -12.077 3.873 33.981 1.00 0.00 H ATOM 610 N GLN A 287 -11.465 4.482 37.312 1.00 37.95 N ATOM 611 CA GLN A 287 -11.232 4.407 38.752 1.00 39.00 C ATOM 612 C GLN A 287 -9.996 3.566 39.106 1.00 37.82 C ATOM 613 O GLN A 287 -9.348 3.829 40.118 1.00 38.76 O ATOM 614 CB GLN A 287 -12.497 3.996 39.505 1.00 40.59 C ATOM 615 CG GLN A 287 -12.852 2.530 39.547 1.00 43.02 C ATOM 616 CD GLN A 287 -14.263 2.315 40.092 1.00 47.45 C ATOM 617 OE1 GLN A 287 -14.960 3.273 40.438 1.00 50.26 O ATOM 618 NE2 GLN A 287 -14.690 1.058 40.165 1.00 49.97 N ATOM 619 HE22 GLN A 287 -14.070 0.280 39.863 1.00 0.00 H ATOM 620 HE21 GLN A 287 -15.644 0.853 40.524 1.00 0.00 H ATOM 621 H GLN A 287 -12.183 3.880 36.861 1.00 0.00 H ATOM 622 N THR A 288 -9.651 2.585 38.263 1.00 35.47 N ATOM 623 CA THR A 288 -8.388 1.850 38.412 1.00 35.07 C ATOM 624 C THR A 288 -7.197 2.797 38.214 1.00 33.54 C ATOM 625 O THR A 288 -6.216 2.728 38.950 1.00 32.62 O ATOM 626 CB THR A 288 -8.289 0.669 37.410 1.00 34.46 C ATOM 627 OG1 THR A 288 -9.298 -0.311 37.708 1.00 34.74 O ATOM 628 CG2 THR A 288 -6.922 -0.003 37.473 1.00 35.18 C ATOM 629 HG1 THR A 288 -10.193 0.106 37.635 1.00 0.00 H ATOM 630 H THR A 288 -10.293 2.337 37.483 1.00 0.00 H ATOM 631 N LEU A 289 -7.293 3.685 37.230 1.00 31.66 N ATOM 632 CA LEU A 289 -6.244 4.675 36.999 1.00 30.88 C ATOM 633 C LEU A 289 -6.143 5.644 38.182 1.00 32.32 C ATOM 634 O LEU A 289 -5.045 5.953 38.634 1.00 32.42 O ATOM 635 CB LEU A 289 -6.467 5.451 35.705 1.00 30.64 C ATOM 636 CG LEU A 289 -5.488 6.597 35.436 1.00 30.84 C ATOM 637 CD1 LEU A 289 -4.066 6.106 35.203 1.00 29.89 C ATOM 638 CD2 LEU A 289 -5.961 7.420 34.266 1.00 31.81 C ATOM 639 H LEU A 289 -8.130 3.675 36.613 1.00 0.00 H ATOM 640 N ARG A 290 -7.288 6.113 38.677 1.00 33.56 N ATOM 641 CA ARG A 290 -7.297 7.046 39.805 1.00 34.19 C ATOM 642 C ARG A 290 -6.735 6.380 41.060 1.00 33.02 C ATOM 643 O ARG A 290 -5.937 6.983 41.779 1.00 34.91 O ATOM 644 CB ARG A 290 -8.713 7.586 40.051 1.00 37.53 C ATOM 645 CG ARG A 290 -9.271 8.444 38.912 1.00 39.59 C ATOM 646 CD ARG A 290 -8.915 9.924 39.047 1.00 41.52 C ATOM 647 NE ARG A 290 -7.475 10.167 38.948 1.00 43.42 N ATOM 648 CZ ARG A 290 -6.781 10.299 37.812 1.00 44.60 C ATOM 649 NH1 ARG A 290 -7.376 10.216 36.619 1.00 46.12 N ATOM 650 NH2 ARG A 290 -5.466 10.506 37.873 1.00 46.40 N ATOM 651 HE ARG A 290 -6.945 10.244 39.839 1.00 0.00 H ATOM 652 HH12 ARG A 290 -6.815 10.322 35.750 1.00 0.00 H ATOM 653 HH11 ARG A 290 -8.400 10.045 36.559 1.00 0.00 H ATOM 654 HH22 ARG A 290 -4.915 10.610 36.997 1.00 0.00 H ATOM 655 HH21 ARG A 290 -4.991 10.563 38.796 1.00 0.00 H ATOM 656 H ARG A 290 -8.189 5.811 38.255 1.00 0.00 H ATOM 657 N SER A 291 -7.132 5.131 41.306 1.00 31.50 N ATOM 658 CA SER A 291 -6.635 4.379 42.447 1.00 32.24 C ATOM 659 C SER A 291 -5.128 4.199 42.341 1.00 30.96 C ATOM 660 O SER A 291 -4.387 4.548 43.266 1.00 32.50 O ATOM 661 CB SER A 291 -7.320 3.019 42.569 1.00 32.39 C ATOM 662 OG SER A 291 -6.965 2.381 43.786 1.00 34.84 O ATOM 663 HG SER A 291 -7.244 2.948 44.548 1.00 0.00 H ATOM 664 H SER A 291 -7.816 4.682 40.664 1.00 0.00 H ATOM 665 N PHE A 292 -4.675 3.687 41.199 1.00 30.72 N ATOM 666 CA PHE A 292 -3.240 3.481 40.981 1.00 30.05 C ATOM 667 C PHE A 292 -2.440 4.770 41.117 1.00 29.15 C ATOM 668 O PHE A 292 -1.391 4.780 41.763 1.00 30.48 O ATOM 669 CB PHE A 292 -2.978 2.852 39.620 1.00 29.73 C ATOM 670 CG PHE A 292 -1.514 2.706 39.281 1.00 28.61 C ATOM 671 CD1 PHE A 292 -0.709 1.830 39.993 1.00 27.49 C ATOM 672 CD2 PHE A 292 -0.949 3.432 38.241 1.00 28.95 C ATOM 673 CE1 PHE A 292 0.634 1.693 39.681 1.00 28.27 C ATOM 674 CE2 PHE A 292 0.388 3.280 37.911 1.00 26.96 C ATOM 675 CZ PHE A 292 1.179 2.412 38.636 1.00 27.95 C ATOM 676 H PHE A 292 -5.349 3.429 40.450 1.00 0.00 H ATOM 677 N CYS A 293 -2.935 5.850 40.525 1.00 30.35 N ATOM 678 CA CYS A 293 -2.203 7.112 40.550 1.00 31.35 C ATOM 679 C CYS A 293 -2.094 7.688 41.969 1.00 32.34 C ATOM 680 O CYS A 293 -1.069 8.274 42.323 1.00 31.79 O ATOM 681 CB CYS A 293 -2.800 8.127 39.575 1.00 32.53 C ATOM 682 SG CYS A 293 -1.583 9.352 38.996 1.00 36.18 S ATOM 683 H CYS A 293 -3.853 5.796 40.039 1.00 0.00 H ATOM 684 N ALA A 294 -3.123 7.503 42.797 1.00 32.36 N ATOM 685 CA ALA A 294 -3.006 7.889 44.207 1.00 32.77 C ATOM 686 C ALA A 294 -2.007 6.986 44.940 1.00 33.18 C ATOM 687 O ALA A 294 -1.176 7.456 45.716 1.00 31.99 O ATOM 688 CB ALA A 294 -4.369 7.851 44.891 1.00 33.64 C ATOM 689 H ALA A 294 -4.007 7.085 42.443 1.00 0.00 H ATOM 690 N TRP A 295 -2.083 5.687 44.681 1.00 31.90 N ATOM 691 CA TRP A 295 -1.231 4.722 45.363 1.00 33.59 C ATOM 692 C TRP A 295 0.256 4.930 45.045 1.00 32.17 C ATOM 693 O TRP A 295 1.101 4.857 45.948 1.00 33.29 O ATOM 694 CB TRP A 295 -1.671 3.305 45.005 1.00 34.46 C ATOM 695 CG TRP A 295 -0.778 2.222 45.496 1.00 35.67 C ATOM 696 CD1 TRP A 295 -0.863 1.555 46.688 1.00 38.22 C ATOM 697 CD2 TRP A 295 0.335 1.655 44.799 1.00 37.06 C ATOM 698 NE1 TRP A 295 0.133 0.612 46.770 1.00 38.35 N ATOM 699 CE2 TRP A 295 0.883 0.654 45.627 1.00 38.02 C ATOM 700 CE3 TRP A 295 0.925 1.900 43.555 1.00 37.75 C ATOM 701 CZ2 TRP A 295 1.990 -0.105 45.247 1.00 38.77 C ATOM 702 CZ3 TRP A 295 2.024 1.151 43.181 1.00 37.86 C ATOM 703 CH2 TRP A 295 2.549 0.163 44.027 1.00 37.74 C ATOM 704 HE1 TRP A 295 0.291 -0.031 47.572 1.00 0.00 H ATOM 705 H TRP A 295 -2.767 5.350 43.974 1.00 0.00 H ATOM 706 N GLN A 296 0.583 5.202 43.780 1.00 30.87 N ATOM 707 CA GLN A 296 1.991 5.264 43.367 1.00 30.66 C ATOM 708 C GLN A 296 2.720 6.450 43.992 1.00 31.06 C ATOM 709 O GLN A 296 3.924 6.395 44.186 1.00 31.83 O ATOM 710 CB GLN A 296 2.156 5.244 41.832 1.00 29.00 C ATOM 711 CG GLN A 296 1.471 6.358 41.051 1.00 29.70 C ATOM 712 CD GLN A 296 2.210 7.681 41.097 1.00 29.51 C ATOM 713 OE1 GLN A 296 3.438 7.714 41.104 1.00 30.39 O ATOM 714 NE2 GLN A 296 1.468 8.775 41.101 1.00 28.30 N ATOM 715 HE22 GLN A 296 0.431 8.700 41.095 1.00 0.00 H ATOM 716 HE21 GLN A 296 1.921 9.711 41.110 1.00 0.00 H ATOM 717 H GLN A 296 -0.167 5.372 43.080 1.00 0.00 H ATOM 718 N ARG A 297 1.987 7.519 44.303 1.00 32.01 N ATOM 719 CA ARG A 297 2.555 8.671 45.003 1.00 33.98 C ATOM 720 C ARG A 297 3.351 8.243 46.229 1.00 33.70 C ATOM 721 O ARG A 297 4.418 8.788 46.514 1.00 33.69 O ATOM 722 CB ARG A 297 1.444 9.616 45.457 1.00 35.94 C ATOM 723 CG ARG A 297 0.907 10.534 44.381 1.00 36.80 C ATOM 724 CD ARG A 297 -0.101 11.489 44.999 1.00 38.58 C ATOM 725 NE ARG A 297 -1.451 11.303 44.485 1.00 39.00 N ATOM 726 CZ ARG A 297 -2.552 11.329 45.235 1.00 39.67 C ATOM 727 NH1 ARG A 297 -3.733 11.164 44.676 1.00 39.57 N ATOM 728 NH2 ARG A 297 -2.474 11.492 46.547 1.00 40.38 N ATOM 729 HE ARG A 297 -1.563 11.139 43.464 1.00 0.00 H ATOM 730 HH12 ARG A 297 -4.593 11.184 45.261 1.00 0.00 H ATOM 731 HH11 ARG A 297 -3.806 11.013 43.650 1.00 0.00 H ATOM 732 HH22 ARG A 297 -3.341 11.510 47.121 1.00 0.00 H ATOM 733 HH21 ARG A 297 -1.546 11.602 47.003 1.00 0.00 H ATOM 734 H ARG A 297 0.981 7.534 44.040 1.00 0.00 H ATOM 735 N GLY A 298 2.812 7.273 46.963 1.00 32.84 N ATOM 736 CA GLY A 298 3.420 6.811 48.193 1.00 34.65 C ATOM 737 C GLY A 298 4.793 6.185 48.053 1.00 35.92 C ATOM 738 O GLY A 298 5.563 6.172 49.011 1.00 37.49 O ATOM 739 H GLY A 298 1.926 6.833 46.643 1.00 0.00 H ATOM 740 N LEU A 299 5.102 5.655 46.872 1.00 33.50 N ATOM 741 CA LEU A 299 6.388 5.002 46.649 1.00 33.28 C ATOM 742 C LEU A 299 7.462 5.998 46.238 1.00 32.74 C ATOM 743 O LEU A 299 8.651 5.686 46.307 1.00 33.01 O ATOM 744 CB LEU A 299 6.270 3.918 45.580 1.00 34.53 C ATOM 745 CG LEU A 299 5.698 2.569 46.014 1.00 35.93 C ATOM 746 CD1 LEU A 299 4.303 2.682 46.598 1.00 36.71 C ATOM 747 CD2 LEU A 299 5.703 1.641 44.810 1.00 36.38 C ATOM 748 H LEU A 299 4.414 5.707 46.094 1.00 0.00 H ATOM 749 N ASN A 300 7.049 7.185 45.809 1.00 32.80 N ATOM 750 CA ASN A 300 7.976 8.154 45.243 1.00 30.62 C ATOM 751 C ASN A 300 8.631 8.974 46.355 1.00 32.87 C ATOM 752 O ASN A 300 8.263 8.859 47.527 1.00 33.96 O ATOM 753 CB ASN A 300 7.269 9.055 44.219 1.00 29.82 C ATOM 754 CG ASN A 300 8.166 9.452 43.047 1.00 29.12 C ATOM 755 OD1 ASN A 300 9.397 9.324 43.106 1.00 29.71 O ATOM 756 ND2 ASN A 300 7.557 9.951 41.983 1.00 27.33 N ATOM 757 HD22 ASN A 300 6.521 10.042 41.972 1.00 0.00 H ATOM 758 HD21 ASN A 300 8.114 10.252 41.158 1.00 0.00 H ATOM 759 H ASN A 300 6.040 7.428 45.879 1.00 0.00 H ATOM 760 N THR A 301 9.640 9.743 45.969 1.00 32.90 N ATOM 761 CA THR A 301 10.323 10.664 46.877 1.00 33.90 C ATOM 762 C THR A 301 10.151 12.082 46.350 1.00 34.63 C ATOM 763 O THR A 301 9.864 12.280 45.173 1.00 33.91 O ATOM 764 CB THR A 301 11.803 10.287 47.013 1.00 33.43 C ATOM 765 OG1 THR A 301 12.443 10.382 45.738 1.00 35.53 O ATOM 766 CG2 THR A 301 11.940 8.871 47.574 1.00 34.90 C ATOM 767 HG1 THR A 301 13.398 10.138 45.830 1.00 0.00 H ATOM 768 H THR A 301 9.959 9.689 44.980 1.00 0.00 H ATOM 769 N PRO A 302 10.313 13.101 47.220 1.00 36.72 N ATOM 770 CA PRO A 302 10.027 14.474 46.758 1.00 37.00 C ATOM 771 C PRO A 302 10.952 15.033 45.683 1.00 35.82 C ATOM 772 O PRO A 302 10.493 15.816 44.852 1.00 37.65 O ATOM 773 CB PRO A 302 10.156 15.310 48.039 1.00 37.23 C ATOM 774 CG PRO A 302 9.941 14.337 49.135 1.00 37.89 C ATOM 775 CD PRO A 302 10.577 13.065 48.665 1.00 37.91 C ATOM 776 N GLU A 303 12.230 14.648 45.695 1.00 34.46 N ATOM 777 CA GLU A 303 13.212 15.229 44.790 1.00 35.70 C ATOM 778 C GLU A 303 13.792 14.213 43.810 1.00 36.24 C ATOM 779 O GLU A 303 14.100 13.071 44.187 1.00 36.45 O ATOM 780 CB GLU A 303 14.342 15.879 45.592 1.00 37.22 C ATOM 781 CG GLU A 303 13.855 16.880 46.629 1.00 37.82 C ATOM 782 CD GLU A 303 13.108 18.053 46.016 1.00 40.02 C ATOM 783 OE1 GLU A 303 13.295 18.330 44.813 1.00 42.31 O ATOM 784 OE2 GLU A 303 12.335 18.712 46.743 1.00 43.95 O ATOM 785 H GLU A 303 12.532 13.915 46.368 1.00 0.00 H ATOM 786 N ASP A 304 13.954 14.670 42.567 1.00 36.02 N ATOM 787 CA ASP A 304 14.465 13.852 41.463 1.00 35.02 C ATOM 788 C ASP A 304 15.921 13.442 41.661 1.00 37.02 C ATOM 789 O ASP A 304 16.377 12.453 41.071 1.00 34.05 O ATOM 790 CB ASP A 304 14.296 14.582 40.132 1.00 35.95 C ATOM 791 CG ASP A 304 14.119 13.637 38.962 1.00 33.20 C ATOM 792 OD1 ASP A 304 14.295 12.413 39.147 1.00 34.96 O ATOM 793 OD2 ASP A 304 13.842 14.132 37.858 1.00 35.53 O ATOM 794 H ASP A 304 13.704 15.660 42.371 1.00 0.00 H ATOM 795 N SER A 305 16.628 14.206 42.494 1.00 38.32 N ATOM 796 CA SER A 305 17.990 13.896 42.951 1.00 41.11 C ATOM 797 C SER A 305 18.129 12.552 43.658 1.00 39.35 C ATOM 798 O SER A 305 19.194 11.950 43.629 1.00 42.28 O ATOM 799 CB SER A 305 18.495 14.995 43.915 1.00 39.96 C ATOM 800 OG SER A 305 18.060 14.754 45.257 1.00 42.16 O ATOM 801 HG SER A 305 17.070 14.742 45.285 1.00 0.00 H ATOM 802 H SER A 305 16.186 15.080 42.844 1.00 0.00 H ATOM 803 N ASP A 306 17.064 12.108 44.317 1.00 39.91 N ATOM 804 CA ASP A 306 17.036 10.828 45.025 1.00 39.10 C ATOM 805 C ASP A 306 16.982 9.676 44.018 1.00 39.81 C ATOM 806 O ASP A 306 16.149 9.719 43.125 1.00 37.25 O ATOM 807 CB ASP A 306 15.771 10.774 45.882 1.00 41.49 C ATOM 808 CG ASP A 306 15.803 9.676 46.920 1.00 43.17 C ATOM 809 OD1 ASP A 306 15.413 9.970 48.068 1.00 52.04 O ATOM 810 OD2 ASP A 306 16.193 8.524 46.615 1.00 49.04 O ATOM 811 H ASP A 306 16.209 12.699 44.330 1.00 0.00 H ATOM 812 N PRO A 307 17.843 8.640 44.173 1.00 39.51 N ATOM 813 CA PRO A 307 17.812 7.482 43.253 1.00 39.95 C ATOM 814 C PRO A 307 16.472 6.736 43.161 1.00 38.07 C ATOM 815 O PRO A 307 16.171 6.139 42.116 1.00 36.63 O ATOM 816 CB PRO A 307 18.893 6.534 43.805 1.00 42.00 C ATOM 817 CG PRO A 307 19.716 7.334 44.742 1.00 40.93 C ATOM 818 CD PRO A 307 18.994 8.598 45.097 1.00 41.23 C ATOM 819 N ASP A 308 15.702 6.744 44.246 1.00 35.72 N ATOM 820 CA ASP A 308 14.405 6.064 44.296 1.00 34.26 C ATOM 821 C ASP A 308 13.317 6.861 43.587 1.00 32.25 C ATOM 822 O ASP A 308 12.220 6.339 43.348 1.00 30.65 O ATOM 823 CB ASP A 308 13.960 5.837 45.746 1.00 37.58 C ATOM 824 CG ASP A 308 14.768 4.779 46.452 1.00 40.41 C ATOM 825 OD1 ASP A 308 15.506 4.026 45.776 1.00 41.79 O ATOM 826 OD2 ASP A 308 14.650 4.688 47.694 1.00 41.62 O ATOM 827 H ASP A 308 16.033 7.252 45.091 1.00 0.00 H ATOM 828 N HIS A 309 13.587 8.125 43.276 1.00 31.18 N ATOM 829 CA HIS A 309 12.591 8.941 42.588 1.00 29.40 C ATOM 830 C HIS A 309 12.358 8.430 41.184 1.00 27.89 C ATOM 831 O HIS A 309 13.289 8.024 40.504 1.00 26.77 O ATOM 832 CB HIS A 309 12.997 10.409 42.511 1.00 30.38 C ATOM 833 CG HIS A 309 11.929 11.288 41.940 1.00 30.20 C ATOM 834 ND1 HIS A 309 10.940 11.853 42.716 1.00 31.90 N ATOM 835 CD2 HIS A 309 11.692 11.699 40.673 1.00 30.31 C ATOM 836 CE1 HIS A 309 10.133 12.565 41.950 1.00 30.94 C ATOM 837 NE2 HIS A 309 10.574 12.496 40.709 1.00 30.06 N ATOM 838 H HIS A 309 14.511 8.534 43.524 1.00 0.00 H ATOM 839 N PHE A 310 11.100 8.474 40.756 1.00 28.38 N ATOM 840 CA PHE A 310 10.729 8.095 39.407 1.00 26.21 C ATOM 841 C PHE A 310 9.833 9.162 38.792 1.00 25.92 C ATOM 842 O PHE A 310 9.108 9.892 39.519 1.00 26.54 O ATOM 843 CB PHE A 310 10.064 6.696 39.386 1.00 25.86 C ATOM 844 CG PHE A 310 8.892 6.564 40.327 1.00 25.42 C ATOM 845 CD1 PHE A 310 7.615 6.910 39.907 1.00 25.13 C ATOM 846 CD2 PHE A 310 9.058 6.065 41.622 1.00 26.28 C ATOM 847 CE1 PHE A 310 6.537 6.790 40.777 1.00 26.91 C ATOM 848 CE2 PHE A 310 7.979 5.927 42.493 1.00 27.20 C ATOM 849 CZ PHE A 310 6.713 6.300 42.057 1.00 26.53 C ATOM 850 H PHE A 310 10.357 8.791 41.411 1.00 0.00 H ATOM 851 N ASP A 311 9.897 9.238 37.465 1.00 25.26 N ATOM 852 CA ASP A 311 9.229 10.266 36.663 1.00 24.27 C ATOM 853 C ASP A 311 7.825 9.848 36.195 1.00 25.77 C ATOM 854 O ASP A 311 6.978 10.700 35.962 1.00 26.15 O ATOM 855 CB ASP A 311 10.078 10.654 35.443 1.00 25.55 C ATOM 856 CG ASP A 311 11.448 11.188 35.821 1.00 27.62 C ATOM 857 OD1 ASP A 311 11.534 11.946 36.812 1.00 28.82 O ATOM 858 OD2 ASP A 311 12.432 10.861 35.117 1.00 27.98 O ATOM 859 H ASP A 311 10.458 8.520 36.964 1.00 0.00 H ATOM 860 N THR A 312 7.589 8.548 36.024 1.00 24.16 N ATOM 861 CA THR A 312 6.268 8.076 35.622 1.00 25.23 C ATOM 862 C THR A 312 6.030 6.676 36.184 1.00 23.42 C ATOM 863 O THR A 312 6.980 5.964 36.515 1.00 24.11 O ATOM 864 CB THR A 312 6.084 8.144 34.084 1.00 25.96 C ATOM 865 OG1 THR A 312 4.684 8.180 33.763 1.00 25.97 O ATOM 866 CG2 THR A 312 6.753 6.947 33.394 1.00 25.05 C ATOM 867 HG1 THR A 312 4.272 8.979 34.178 1.00 0.00 H ATOM 868 H THR A 312 8.355 7.862 36.179 1.00 0.00 H ATOM 869 N ALA A 313 4.757 6.350 36.389 1.00 24.60 N ATOM 870 CA ALA A 313 4.335 5.069 36.947 1.00 23.78 C ATOM 871 C ALA A 313 3.394 4.380 35.961 1.00 24.24 C ATOM 872 O ALA A 313 2.415 4.979 35.511 1.00 23.29 O ATOM 873 CB ALA A 313 3.629 5.285 38.275 1.00 23.92 C ATOM 874 H ALA A 313 4.024 7.044 36.139 1.00 0.00 H ATOM 875 N ILE A 314 3.680 3.121 35.634 1.00 23.17 N ATOM 876 CA ILE A 314 2.847 2.373 34.681 1.00 24.18 C ATOM 877 C ILE A 314 2.457 1.020 35.294 1.00 24.62 C ATOM 878 O ILE A 314 3.313 0.250 35.790 1.00 25.27 O ATOM 879 CB ILE A 314 3.539 2.230 33.290 1.00 24.28 C ATOM 880 CG1 ILE A 314 2.591 1.563 32.266 1.00 24.90 C ATOM 881 CG2 ILE A 314 4.874 1.500 33.403 1.00 25.94 C ATOM 882 CD1 ILE A 314 3.083 1.676 30.857 1.00 25.49 C ATOM 883 H ILE A 314 4.508 2.658 36.061 1.00 0.00 H ATOM 884 N LEU A 315 1.150 0.749 35.278 1.00 25.82 N ATOM 885 CA LEU A 315 0.612 -0.474 35.845 1.00 26.06 C ATOM 886 C LEU A 315 0.186 -1.423 34.742 1.00 26.40 C ATOM 887 O LEU A 315 -0.528 -1.012 33.839 1.00 27.13 O ATOM 888 CB LEU A 315 -0.608 -0.169 36.711 1.00 25.66 C ATOM 889 CG LEU A 315 -1.398 -1.388 37.217 1.00 26.90 C ATOM 890 CD1 LEU A 315 -0.572 -2.170 38.215 1.00 27.64 C ATOM 891 CD2 LEU A 315 -2.726 -0.980 37.840 1.00 26.65 C ATOM 892 H LEU A 315 0.498 1.435 34.846 1.00 0.00 H ATOM 893 N PHE A 316 0.639 -2.673 34.828 1.00 26.33 N ATOM 894 CA PHE A 316 0.144 -3.763 33.988 1.00 26.58 C ATOM 895 C PHE A 316 -0.738 -4.671 34.834 1.00 27.68 C ATOM 896 O PHE A 316 -0.371 -5.065 35.948 1.00 27.52 O ATOM 897 CB PHE A 316 1.277 -4.583 33.377 1.00 26.43 C ATOM 898 CG PHE A 316 2.129 -3.803 32.431 1.00 24.91 C ATOM 899 CD1 PHE A 316 3.196 -3.060 32.907 1.00 25.13 C ATOM 900 CD2 PHE A 316 1.841 -3.755 31.067 1.00 24.70 C ATOM 901 CE1 PHE A 316 3.980 -2.321 32.031 1.00 25.29 C ATOM 902 CE2 PHE A 316 2.628 -3.016 30.199 1.00 24.84 C ATOM 903 CZ PHE A 316 3.688 -2.286 30.685 1.00 24.84 C ATOM 904 H PHE A 316 1.380 -2.884 35.526 1.00 0.00 H ATOM 905 N THR A 317 -1.899 -4.983 34.281 1.00 29.36 N ATOM 906 CA THR A 317 -2.859 -5.869 34.923 1.00 30.24 C ATOM 907 C THR A 317 -3.474 -6.799 33.883 1.00 31.50 C ATOM 908 O THR A 317 -3.542 -6.456 32.704 1.00 30.38 O ATOM 909 CB THR A 317 -3.977 -5.065 35.615 1.00 31.47 C ATOM 910 OG1 THR A 317 -4.943 -5.965 36.167 1.00 32.28 O ATOM 911 CG2 THR A 317 -4.664 -4.104 34.651 1.00 31.13 C ATOM 912 HG1 THR A 317 -4.502 -6.555 36.829 1.00 0.00 H ATOM 913 H THR A 317 -2.135 -4.580 33.352 1.00 0.00 H ATOM 914 N ARG A 318 -3.913 -7.966 34.340 1.00 33.62 N ATOM 915 CA ARG A 318 -4.692 -8.888 33.508 1.00 34.30 C ATOM 916 C ARG A 318 -6.197 -8.598 33.572 1.00 35.01 C ATOM 917 O ARG A 318 -6.962 -9.214 32.826 1.00 35.81 O ATOM 918 CB ARG A 318 -4.452 -10.342 33.925 1.00 35.20 C ATOM 919 CG ARG A 318 -3.010 -10.805 33.911 1.00 36.45 C ATOM 920 CD ARG A 318 -2.507 -11.035 32.500 1.00 37.24 C ATOM 921 NE ARG A 318 -2.971 -12.308 31.954 1.00 39.08 N ATOM 922 CZ ARG A 318 -2.613 -12.782 30.766 1.00 39.02 C ATOM 923 NH1 ARG A 318 -3.079 -13.960 30.359 1.00 40.06 N ATOM 924 NH2 ARG A 318 -1.796 -12.082 29.978 1.00 37.92 N ATOM 925 HE ARG A 318 -3.622 -12.878 32.531 1.00 0.00 H ATOM 926 HH12 ARG A 318 -2.802 -14.336 29.430 1.00 0.00 H ATOM 927 HH11 ARG A 318 -3.720 -14.505 30.970 1.00 0.00 H ATOM 928 HH22 ARG A 318 -1.520 -12.459 29.049 1.00 0.00 H ATOM 929 HH21 ARG A 318 -1.435 -11.159 30.292 1.00 0.00 H ATOM 930 H ARG A 318 -3.697 -8.235 35.321 1.00 0.00 H ATOM 931 N GLN A 319 -6.620 -7.681 34.448 1.00 34.42 N ATOM 932 CA GLN A 319 -8.016 -7.234 34.507 1.00 34.43 C ATOM 933 C GLN A 319 -8.489 -6.691 33.159 1.00 34.24 C ATOM 934 O GLN A 319 -7.821 -5.867 32.532 1.00 31.81 O ATOM 935 CB GLN A 319 -8.189 -6.133 35.569 1.00 34.87 C ATOM 936 CG GLN A 319 -9.568 -5.475 35.609 1.00 36.64 C ATOM 937 CD GLN A 319 -10.650 -6.421 36.114 1.00 38.34 C ATOM 938 OE1 GLN A 319 -10.473 -7.090 37.136 1.00 41.00 O ATOM 939 NE2 GLN A 319 -11.770 -6.496 35.389 1.00 39.09 N ATOM 940 HE22 GLN A 319 -11.876 -5.913 34.534 1.00 0.00 H ATOM 941 HE21 GLN A 319 -12.536 -7.137 35.680 1.00 0.00 H ATOM 942 H GLN A 319 -5.934 -7.269 35.112 1.00 0.00 H ATOM 943 N ASP A 320 -9.653 -7.146 32.713 1.00 33.81 N ATOM 944 CA ASP A 320 -10.278 -6.572 31.534 1.00 34.35 C ATOM 945 C ASP A 320 -10.776 -5.168 31.897 1.00 34.30 C ATOM 946 O ASP A 320 -11.762 -5.012 32.632 1.00 33.25 O ATOM 947 CB ASP A 320 -11.426 -7.468 31.044 1.00 34.47 C ATOM 948 CG ASP A 320 -12.070 -6.968 29.765 1.00 36.55 C ATOM 949 OD1 ASP A 320 -11.644 -5.935 29.204 1.00 33.44 O ATOM 950 OD2 ASP A 320 -13.032 -7.628 29.305 1.00 37.91 O ATOM 951 H ASP A 320 -10.125 -7.925 33.215 1.00 0.00 H ATOM 952 N LEU A 321 -10.070 -4.152 31.404 1.00 31.75 N ATOM 953 CA LEU A 321 -10.402 -2.756 31.680 1.00 31.90 C ATOM 954 C LEU A 321 -11.514 -2.307 30.759 1.00 32.67 C ATOM 955 O LEU A 321 -11.553 -2.693 29.591 1.00 32.75 O ATOM 956 CB LEU A 321 -9.171 -1.858 31.483 1.00 30.23 C ATOM 957 CG LEU A 321 -8.010 -2.095 32.457 1.00 29.70 C ATOM 958 CD1 LEU A 321 -6.804 -1.251 32.057 1.00 29.47 C ATOM 959 CD2 LEU A 321 -8.435 -1.785 33.890 1.00 29.86 C ATOM 960 H LEU A 321 -9.250 -4.360 30.799 1.00 0.00 H ATOM 961 N CYS A 322 -12.415 -1.481 31.288 1.00 34.61 N ATOM 962 CA CYS A 322 -13.591 -1.041 30.542 1.00 34.31 C ATOM 963 C CYS A 322 -13.811 0.460 30.622 1.00 35.48 C ATOM 964 O CYS A 322 -13.433 1.109 31.602 1.00 35.33 O ATOM 965 CB CYS A 322 -14.846 -1.767 31.052 1.00 36.75 C ATOM 966 SG CYS A 322 -14.705 -3.561 31.204 1.00 37.82 S ATOM 967 H CYS A 322 -12.277 -1.139 32.261 1.00 0.00 H ATOM 968 N GLY A 323 -14.432 0.993 29.570 1.00 35.22 N ATOM 969 CA GLY A 323 -14.923 2.362 29.553 1.00 36.60 C ATOM 970 C GLY A 323 -16.376 2.365 30.009 1.00 37.45 C ATOM 971 O GLY A 323 -16.857 1.403 30.605 1.00 36.58 O ATOM 972 H GLY A 323 -14.572 0.404 28.724 1.00 0.00 H ATOM 973 N VAL A 324 -17.075 3.453 29.716 1.00 38.26 N ATOM 974 CA VAL A 324 -18.482 3.601 30.122 1.00 41.01 C ATOM 975 C VAL A 324 -19.445 2.585 29.460 1.00 42.50 C ATOM 976 O VAL A 324 -20.393 2.111 30.104 1.00 40.55 O ATOM 977 CB VAL A 324 -18.977 5.057 29.889 1.00 42.07 C ATOM 978 CG1 VAL A 324 -18.816 5.484 28.440 1.00 44.58 C ATOM 979 CG2 VAL A 324 -20.425 5.227 30.324 1.00 42.06 C ATOM 980 H VAL A 324 -16.617 4.222 29.186 1.00 0.00 H ATOM 981 N SER A 325 -19.191 2.248 28.194 1.00 44.42 N ATOM 982 CA SER A 325 -20.128 1.446 27.382 1.00 47.98 C ATOM 983 C SER A 325 -19.599 0.088 26.906 1.00 47.96 C ATOM 984 O SER A 325 -20.393 -0.826 26.651 1.00 51.56 O ATOM 985 CB SER A 325 -20.596 2.260 26.169 1.00 50.04 C ATOM 986 OG SER A 325 -19.509 2.589 25.315 1.00 53.95 O ATOM 987 HG SER A 325 -18.847 3.126 25.818 1.00 0.00 H ATOM 988 H SER A 325 -18.298 2.562 27.763 1.00 0.00 H ATOM 989 N THR A 326 -18.283 -0.051 26.743 1.00 45.57 N ATOM 990 CA THR A 326 -17.706 -1.355 26.392 1.00 44.70 C ATOM 991 C THR A 326 -16.399 -1.601 27.129 1.00 41.35 C ATOM 992 O THR A 326 -15.861 -0.710 27.799 1.00 40.59 O ATOM 993 CB THR A 326 -17.435 -1.529 24.870 1.00 45.88 C ATOM 994 OG1 THR A 326 -16.225 -0.856 24.498 1.00 44.21 O ATOM 995 CG2 THR A 326 -18.613 -1.033 24.014 1.00 46.30 C ATOM 996 HG1 THR A 326 -16.067 -0.976 23.528 1.00 0.00 H ATOM 997 H THR A 326 -17.659 0.772 26.866 1.00 0.00 H ATOM 998 N CYS A 327 -15.906 -2.822 26.975 1.00 39.03 N ATOM 999 CA CYS A 327 -14.655 -3.247 27.571 1.00 38.60 C ATOM 1000 C CYS A 327 -13.558 -3.416 26.529 1.00 34.36 C ATOM 1001 O CYS A 327 -12.558 -4.074 26.799 1.00 34.23 O ATOM 1002 CB CYS A 327 -14.874 -4.538 28.353 1.00 39.40 C ATOM 1003 SG CYS A 327 -15.964 -4.294 29.780 1.00 41.49 S ATOM 1004 H CYS A 327 -16.441 -3.505 26.401 1.00 0.00 H ATOM 1005 N ASP A 328 -13.731 -2.780 25.369 1.00 34.42 N ATOM 1006 CA ASP A 328 -12.728 -2.798 24.285 1.00 33.22 C ATOM 1007 C ASP A 328 -11.444 -2.049 24.678 1.00 33.42 C ATOM 1008 O ASP A 328 -10.398 -2.225 24.049 1.00 31.55 O ATOM 1009 CB ASP A 328 -13.289 -2.158 23.010 1.00 37.14 C ATOM 1010 CG ASP A 328 -14.494 -2.903 22.448 1.00 38.77 C ATOM 1011 OD1 ASP A 328 -14.773 -4.045 22.883 1.00 43.32 O ATOM 1012 OD2 ASP A 328 -15.168 -2.326 21.569 1.00 43.00 O ATOM 1013 H ASP A 328 -14.612 -2.247 25.221 1.00 0.00 H ATOM 1014 N THR A 329 -11.547 -1.209 25.704 1.00 32.41 N ATOM 1015 CA THR A 329 -10.401 -0.411 26.140 1.00 32.01 C ATOM 1016 C THR A 329 -9.253 -1.339 26.588 1.00 30.73 C ATOM 1017 O THR A 329 -9.473 -2.397 27.166 1.00 29.93 O ATOM 1018 CB THR A 329 -10.780 0.624 27.238 1.00 33.50 C ATOM 1019 OG1 THR A 329 -10.947 -0.013 28.511 1.00 34.73 O ATOM 1020 CG2 THR A 329 -12.072 1.374 26.884 1.00 33.68 C ATOM 1021 HG1 THR A 329 -11.668 -0.688 28.449 1.00 0.00 H ATOM 1022 H THR A 329 -12.455 -1.118 26.203 1.00 0.00 H ATOM 1023 N LEU A 330 -8.015 -0.940 26.280 1.00 29.13 N ATOM 1024 CA LEU A 330 -6.830 -1.694 26.721 1.00 27.28 C ATOM 1025 C LEU A 330 -5.967 -0.909 27.710 1.00 26.24 C ATOM 1026 O LEU A 330 -4.964 -1.413 28.194 1.00 26.11 O ATOM 1027 CB LEU A 330 -5.980 -2.135 25.523 1.00 28.44 C ATOM 1028 CG LEU A 330 -6.659 -3.217 24.664 1.00 30.18 C ATOM 1029 CD1 LEU A 330 -5.933 -3.335 23.327 1.00 32.03 C ATOM 1030 CD2 LEU A 330 -6.669 -4.530 25.419 1.00 31.19 C ATOM 1031 H LEU A 330 -7.886 -0.076 25.715 1.00 0.00 H ATOM 1032 N GLY A 331 -6.346 0.322 28.013 1.00 27.91 N ATOM 1033 CA GLY A 331 -5.517 1.129 28.899 1.00 26.23 C ATOM 1034 C GLY A 331 -6.061 2.520 29.086 1.00 26.24 C ATOM 1035 O GLY A 331 -7.033 2.918 28.440 1.00 26.07 O ATOM 1036 H GLY A 331 -7.228 0.710 27.622 1.00 0.00 H ATOM 1037 N MET A 332 -5.414 3.270 29.967 1.00 25.52 N ATOM 1038 CA MET A 332 -5.836 4.648 30.239 1.00 27.01 C ATOM 1039 C MET A 332 -4.679 5.453 30.834 1.00 26.75 C ATOM 1040 O MET A 332 -3.848 4.902 31.548 1.00 27.63 O ATOM 1041 CB MET A 332 -7.055 4.643 31.185 1.00 28.80 C ATOM 1042 CG MET A 332 -7.799 5.970 31.269 1.00 29.87 C ATOM 1043 SD MET A 332 -9.380 5.898 32.154 1.00 32.72 S ATOM 1044 CE MET A 332 -10.528 5.772 30.784 1.00 33.50 C ATOM 1045 H MET A 332 -4.595 2.876 30.473 1.00 0.00 H ATOM 1046 N ALA A 333 -4.668 6.753 30.558 1.00 27.53 N ATOM 1047 CA ALA A 333 -3.707 7.679 31.137 1.00 27.91 C ATOM 1048 C ALA A 333 -4.274 9.075 31.026 1.00 30.35 C ATOM 1049 O ALA A 333 -4.976 9.377 30.066 1.00 32.60 O ATOM 1050 CB ALA A 333 -2.401 7.613 30.367 1.00 28.73 C ATOM 1051 H ALA A 333 -5.380 7.126 29.897 1.00 0.00 H ATOM 1052 N ASP A 334 -3.954 9.933 31.981 1.00 33.45 N ATOM 1053 CA ASP A 334 -4.248 11.353 31.794 1.00 34.25 C ATOM 1054 C ASP A 334 -3.195 11.961 30.880 1.00 33.91 C ATOM 1055 O ASP A 334 -2.099 11.428 30.702 1.00 34.16 O ATOM 1056 CB ASP A 334 -4.330 12.098 33.123 1.00 36.86 C ATOM 1057 CG ASP A 334 -5.463 11.599 33.981 1.00 37.66 C ATOM 1058 OD1 ASP A 334 -6.618 11.602 33.501 1.00 43.20 O ATOM 1059 OD2 ASP A 334 -5.200 11.159 35.116 1.00 38.83 O ATOM 1060 H ASP A 334 -3.498 9.601 32.855 1.00 0.00 H ATOM 1061 N VAL A 335 -3.541 13.092 30.292 1.00 31.22 N ATOM 1062 CA VAL A 335 -2.788 13.636 29.185 1.00 30.42 C ATOM 1063 C VAL A 335 -1.837 14.758 29.639 1.00 31.96 C ATOM 1064 O VAL A 335 -2.262 15.689 30.317 1.00 33.44 O ATOM 1065 CB VAL A 335 -3.776 14.163 28.122 1.00 30.62 C ATOM 1066 CG1 VAL A 335 -3.076 14.832 26.958 1.00 29.44 C ATOM 1067 CG2 VAL A 335 -4.658 13.029 27.622 1.00 30.30 C ATOM 1068 H VAL A 335 -4.378 13.605 30.635 1.00 0.00 H ATOM 1069 N GLY A 336 -0.564 14.661 29.251 1.00 29.72 N ATOM 1070 CA GLY A 336 0.414 15.738 29.458 1.00 31.87 C ATOM 1071 C GLY A 336 0.798 15.945 30.911 1.00 33.74 C ATOM 1072 O GLY A 336 0.750 17.072 31.419 1.00 34.97 O ATOM 1073 H GLY A 336 -0.251 13.787 28.783 1.00 0.00 H ATOM 1074 N THR A 337 1.214 14.861 31.569 1.00 31.63 N ATOM 1075 CA THR A 337 1.420 14.842 33.014 1.00 30.80 C ATOM 1076 C THR A 337 2.825 14.417 33.461 1.00 29.51 C ATOM 1077 O THR A 337 3.070 14.297 34.671 1.00 28.12 O ATOM 1078 CB THR A 337 0.447 13.847 33.668 1.00 31.52 C ATOM 1079 OG1 THR A 337 0.698 12.536 33.144 1.00 30.46 O ATOM 1080 CG2 THR A 337 -1.007 14.223 33.386 1.00 33.25 C ATOM 1081 HG1 THR A 337 0.074 11.890 33.561 1.00 0.00 H ATOM 1082 H THR A 337 1.399 13.992 31.029 1.00 0.00 H ATOM 1083 N VAL A 338 3.736 14.228 32.506 1.00 29.53 N ATOM 1084 CA VAL A 338 4.954 13.428 32.738 1.00 30.05 C ATOM 1085 C VAL A 338 5.836 13.908 33.891 1.00 28.86 C ATOM 1086 O VAL A 338 6.418 13.089 34.588 1.00 27.11 O ATOM 1087 CB VAL A 338 5.805 13.281 31.462 1.00 28.90 C ATOM 1088 CG1 VAL A 338 6.603 14.543 31.167 1.00 29.79 C ATOM 1089 CG2 VAL A 338 6.753 12.079 31.561 1.00 30.61 C ATOM 1090 H VAL A 338 3.584 14.657 31.571 1.00 0.00 H ATOM 1091 N CYS A 339 5.933 15.223 34.093 1.00 30.72 N ATOM 1092 CA CYS A 339 6.780 15.769 35.165 1.00 31.28 C ATOM 1093 C CYS A 339 6.019 16.229 36.417 1.00 32.72 C ATOM 1094 O CYS A 339 6.576 16.877 37.333 1.00 36.51 O ATOM 1095 CB CYS A 339 7.716 16.838 34.586 1.00 32.09 C ATOM 1096 SG CYS A 339 9.031 16.024 33.637 1.00 33.21 S ATOM 1097 H CYS A 339 5.400 15.874 33.482 1.00 0.00 H ATOM 1098 N ASP A 340 4.754 15.836 36.478 1.00 30.77 N ATOM 1099 CA ASP A 340 3.935 16.040 37.672 1.00 31.04 C ATOM 1100 C ASP A 340 3.797 14.721 38.410 1.00 30.56 C ATOM 1101 O ASP A 340 2.978 13.886 38.041 1.00 29.41 O ATOM 1102 CB ASP A 340 2.548 16.572 37.321 1.00 32.32 C ATOM 1103 CG ASP A 340 2.448 18.085 37.460 1.00 31.84 C ATOM 1104 OD1 ASP A 340 1.420 18.635 37.044 1.00 33.58 O ATOM 1105 OD2 ASP A 340 3.389 18.721 37.983 1.00 31.68 O ATOM 1106 H ASP A 340 4.331 15.368 35.651 1.00 0.00 H ATOM 1107 N PRO A 341 4.602 14.528 39.472 1.00 30.12 N ATOM 1108 CA PRO A 341 4.533 13.252 40.211 1.00 30.07 C ATOM 1109 C PRO A 341 3.176 12.820 40.762 1.00 31.13 C ATOM 1110 O PRO A 341 2.950 11.627 40.955 1.00 29.50 O ATOM 1111 CB PRO A 341 5.528 13.459 41.360 1.00 31.67 C ATOM 1112 CG PRO A 341 6.529 14.394 40.784 1.00 30.28 C ATOM 1113 CD PRO A 341 5.705 15.370 39.988 1.00 31.04 C ATOM 1114 N ALA A 342 2.282 13.776 40.989 1.00 30.14 N ATOM 1115 CA ALA A 342 0.928 13.462 41.422 1.00 32.82 C ATOM 1116 C ALA A 342 0.079 12.840 40.321 1.00 32.24 C ATOM 1117 O ALA A 342 -0.914 12.174 40.620 1.00 35.87 O ATOM 1118 CB ALA A 342 0.239 14.727 41.926 1.00 32.73 C ATOM 1119 H ALA A 342 2.555 14.770 40.854 1.00 0.00 H ATOM 1120 N ARG A 343 0.452 13.076 39.067 1.00 31.03 N ATOM 1121 CA ARG A 343 -0.397 12.765 37.931 1.00 31.39 C ATOM 1122 C ARG A 343 0.234 11.878 36.859 1.00 30.46 C ATOM 1123 O ARG A 343 -0.468 11.481 35.929 1.00 30.36 O ATOM 1124 CB ARG A 343 -0.797 14.053 37.224 1.00 32.75 C ATOM 1125 CG ARG A 343 -1.569 15.051 38.057 1.00 35.31 C ATOM 1126 CD ARG A 343 -2.183 16.067 37.106 1.00 36.75 C ATOM 1127 NE ARG A 343 -3.274 15.480 36.318 1.00 40.41 N ATOM 1128 CZ ARG A 343 -3.672 15.895 35.111 1.00 41.05 C ATOM 1129 NH1 ARG A 343 -3.087 16.928 34.501 1.00 41.92 N ATOM 1130 NH2 ARG A 343 -4.675 15.268 34.502 1.00 42.76 N ATOM 1131 HE ARG A 343 -3.780 14.673 36.734 1.00 0.00 H ATOM 1132 HH12 ARG A 343 -3.415 17.231 33.562 1.00 0.00 H ATOM 1133 HH11 ARG A 343 -2.303 17.430 34.965 1.00 0.00 H ATOM 1134 HH22 ARG A 343 -4.992 15.583 33.563 1.00 0.00 H ATOM 1135 HH21 ARG A 343 -5.142 14.462 34.965 1.00 0.00 H ATOM 1136 H ARG A 343 1.386 13.499 38.893 1.00 0.00 H ATOM 1137 N SER A 344 1.540 11.609 36.946 1.00 29.32 N ATOM 1138 CA SER A 344 2.256 10.940 35.843 1.00 26.86 C ATOM 1139 C SER A 344 2.052 9.429 35.904 1.00 27.09 C ATOM 1140 O SER A 344 2.890 8.690 36.438 1.00 26.25 O ATOM 1141 CB SER A 344 3.748 11.286 35.896 1.00 25.86 C ATOM 1142 OG SER A 344 4.442 10.806 34.762 1.00 25.03 O ATOM 1143 HG SER A 344 5.399 11.049 34.835 1.00 0.00 H ATOM 1144 H SER A 344 2.061 11.876 37.806 1.00 0.00 H ATOM 1145 N CYS A 345 0.922 8.983 35.350 1.00 27.78 N ATOM 1146 CA CYS A 345 0.404 7.622 35.576 1.00 27.56 C ATOM 1147 C CYS A 345 -0.252 7.044 34.335 1.00 27.14 C ATOM 1148 O CYS A 345 -0.865 7.770 33.546 1.00 26.56 O ATOM 1149 CB CYS A 345 -0.651 7.633 36.684 1.00 31.20 C ATOM 1150 SG CYS A 345 0.002 8.277 38.226 1.00 33.87 S ATOM 1151 H CYS A 345 0.384 9.624 34.732 1.00 0.00 H ATOM 1152 N ALA A 346 -0.127 5.726 34.186 1.00 25.51 N ATOM 1153 CA ALA A 346 -0.764 5.004 33.091 1.00 25.27 C ATOM 1154 C ALA A 346 -1.074 3.581 33.551 1.00 24.78 C ATOM 1155 O ALA A 346 -0.381 3.033 34.426 1.00 24.88 O ATOM 1156 CB ALA A 346 0.123 4.986 31.857 1.00 26.22 C ATOM 1157 H ALA A 346 0.444 5.194 34.874 1.00 0.00 H ATOM 1158 N ILE A 347 -2.150 3.025 32.996 1.00 24.59 N ATOM 1159 CA ILE A 347 -2.525 1.634 33.230 1.00 25.60 C ATOM 1160 C ILE A 347 -2.673 0.918 31.877 1.00 25.58 C ATOM 1161 O ILE A 347 -3.065 1.516 30.864 1.00 24.47 O ATOM 1162 CB ILE A 347 -3.797 1.497 34.127 1.00 25.59 C ATOM 1163 CG1 ILE A 347 -5.058 1.962 33.391 1.00 25.80 C ATOM 1164 CG2 ILE A 347 -3.616 2.306 35.412 1.00 25.05 C ATOM 1165 CD1 ILE A 347 -6.360 1.608 34.094 1.00 26.81 C ATOM 1166 H ILE A 347 -2.746 3.605 32.372 1.00 0.00 H ATOM 1167 N VAL A 348 -2.310 -0.360 31.871 1.00 25.60 N ATOM 1168 CA VAL A 348 -2.307 -1.187 30.670 1.00 25.95 C ATOM 1169 C VAL A 348 -2.910 -2.551 30.987 1.00 26.20 C ATOM 1170 O VAL A 348 -2.478 -3.235 31.921 1.00 26.88 O ATOM 1171 CB VAL A 348 -0.868 -1.383 30.115 1.00 26.68 C ATOM 1172 CG1 VAL A 348 -0.819 -2.407 28.980 1.00 26.63 C ATOM 1173 CG2 VAL A 348 -0.283 -0.044 29.685 1.00 27.16 C ATOM 1174 H VAL A 348 -2.013 -0.793 32.769 1.00 0.00 H ATOM 1175 N GLU A 349 -3.898 -2.932 30.183 1.00 25.91 N ATOM 1176 CA GLU A 349 -4.426 -4.289 30.192 1.00 26.75 C ATOM 1177 C GLU A 349 -3.481 -5.158 29.376 1.00 26.25 C ATOM 1178 O GLU A 349 -3.322 -4.947 28.173 1.00 26.00 O ATOM 1179 CB GLU A 349 -5.818 -4.317 29.575 1.00 26.56 C ATOM 1180 CG GLU A 349 -6.440 -5.712 29.524 1.00 27.83 C ATOM 1181 CD GLU A 349 -7.792 -5.726 28.849 1.00 29.87 C ATOM 1182 OE1 GLU A 349 -8.567 -4.773 29.036 1.00 30.18 O ATOM 1183 OE2 GLU A 349 -8.094 -6.709 28.131 1.00 33.58 O ATOM 1184 H GLU A 349 -4.307 -2.238 29.526 1.00 0.00 H ATOM 1185 N ASP A 350 -2.819 -6.095 30.043 1.00 26.08 N ATOM 1186 CA ASP A 350 -1.891 -7.016 29.386 1.00 27.82 C ATOM 1187 C ASP A 350 -2.641 -8.037 28.521 1.00 29.75 C ATOM 1188 O ASP A 350 -3.339 -8.902 29.049 1.00 32.89 O ATOM 1189 CB ASP A 350 -1.069 -7.765 30.434 1.00 27.62 C ATOM 1190 CG ASP A 350 -0.104 -8.757 29.824 1.00 27.60 C ATOM 1191 OD1 ASP A 350 0.428 -8.481 28.723 1.00 28.04 O ATOM 1192 OD2 ASP A 350 0.120 -9.824 30.437 1.00 28.55 O ATOM 1193 H ASP A 350 -2.965 -6.178 31.069 1.00 0.00 H ATOM 1194 N ASP A 351 -2.481 -7.938 27.207 1.00 29.08 N ATOM 1195 CA ASP A 351 -3.134 -8.888 26.281 1.00 30.23 C ATOM 1196 C ASP A 351 -2.226 -10.062 25.935 1.00 31.06 C ATOM 1197 O ASP A 351 -2.678 -11.044 25.318 1.00 32.49 O ATOM 1198 CB ASP A 351 -3.606 -8.168 25.019 1.00 30.13 C ATOM 1199 CG ASP A 351 -2.467 -7.755 24.128 1.00 31.22 C ATOM 1200 OD1 ASP A 351 -1.922 -8.623 23.407 1.00 33.25 O ATOM 1201 OD2 ASP A 351 -2.082 -6.563 24.156 1.00 32.22 O ATOM 1202 H ASP A 351 -1.885 -7.178 26.821 1.00 0.00 H ATOM 1203 N GLY A 352 -0.949 -9.956 26.300 1.00 31.56 N ATOM 1204 CA GLY A 352 0.007 -11.055 26.172 1.00 32.20 C ATOM 1205 C GLY A 352 0.882 -11.022 24.934 1.00 33.32 C ATOM 1206 O GLY A 352 1.846 -11.800 24.845 1.00 35.01 O ATOM 1207 H GLY A 352 -0.618 -9.052 26.693 1.00 0.00 H ATOM 1208 N LEU A 353 0.561 -10.132 23.992 1.00 31.97 N ATOM 1209 CA LEU A 353 1.262 -10.037 22.705 1.00 34.18 C ATOM 1210 C LEU A 353 1.542 -8.605 22.244 1.00 32.49 C ATOM 1211 O LEU A 353 2.632 -8.322 21.738 1.00 34.99 O ATOM 1212 CB LEU A 353 0.458 -10.771 21.625 1.00 34.44 C ATOM 1213 CG LEU A 353 1.021 -10.857 20.204 1.00 35.66 C ATOM 1214 CD1 LEU A 353 2.349 -11.599 20.166 1.00 35.83 C ATOM 1215 CD2 LEU A 353 -0.003 -11.546 19.304 1.00 35.93 C ATOM 1216 H LEU A 353 -0.223 -9.475 24.179 1.00 0.00 H ATOM 1217 N GLN A 354 0.560 -7.716 22.377 1.00 31.99 N ATOM 1218 CA GLN A 354 0.710 -6.330 21.913 1.00 31.22 C ATOM 1219 C GLN A 354 0.820 -5.298 23.033 1.00 29.50 C ATOM 1220 O GLN A 354 0.619 -4.106 22.786 1.00 29.39 O ATOM 1221 CB GLN A 354 -0.472 -5.940 21.021 1.00 33.30 C ATOM 1222 CG GLN A 354 -0.762 -6.940 19.909 1.00 34.84 C ATOM 1223 CD GLN A 354 0.395 -7.113 18.937 1.00 38.27 C ATOM 1224 OE1 GLN A 354 1.342 -6.326 18.928 1.00 39.65 O ATOM 1225 NE2 GLN A 354 0.316 -8.147 18.094 1.00 41.46 N ATOM 1226 HE22 GLN A 354 -0.501 -8.789 18.134 1.00 0.00 H ATOM 1227 HE21 GLN A 354 1.072 -8.309 17.398 1.00 0.00 H ATOM 1228 H GLN A 354 -0.334 -8.009 22.820 1.00 0.00 H ATOM 1229 N SER A 355 1.149 -5.744 24.244 1.00 28.56 N ATOM 1230 CA SER A 355 1.136 -4.860 25.429 1.00 27.72 C ATOM 1231 C SER A 355 2.127 -3.702 25.327 1.00 26.52 C ATOM 1232 O SER A 355 1.864 -2.620 25.882 1.00 27.42 O ATOM 1233 CB SER A 355 1.371 -5.662 26.705 1.00 27.65 C ATOM 1234 OG SER A 355 0.366 -6.667 26.828 1.00 29.02 O ATOM 1235 HG SER A 355 0.520 -7.186 27.657 1.00 0.00 H ATOM 1236 H SER A 355 1.422 -6.741 24.359 1.00 0.00 H ATOM 1237 N ALA A 356 3.237 -3.903 24.618 1.00 25.61 N ATOM 1238 CA ALA A 356 4.201 -2.823 24.400 1.00 25.41 C ATOM 1239 C ALA A 356 3.588 -1.669 23.612 1.00 25.35 C ATOM 1240 O ALA A 356 3.913 -0.519 23.866 1.00 26.43 O ATOM 1241 CB ALA A 356 5.451 -3.331 23.705 1.00 26.90 C ATOM 1242 H ALA A 356 3.422 -4.843 24.213 1.00 0.00 H ATOM 1243 N PHE A 357 2.688 -1.977 22.684 1.00 24.46 N ATOM 1244 CA PHE A 357 2.058 -0.952 21.860 1.00 25.54 C ATOM 1245 C PHE A 357 1.034 -0.187 22.691 1.00 23.87 C ATOM 1246 O PHE A 357 0.915 1.041 22.597 1.00 26.05 O ATOM 1247 CB PHE A 357 1.393 -1.579 20.634 1.00 28.53 C ATOM 1248 CG PHE A 357 2.373 -2.018 19.599 1.00 31.32 C ATOM 1249 CD1 PHE A 357 2.720 -3.351 19.470 1.00 32.90 C ATOM 1250 CD2 PHE A 357 2.974 -1.086 18.778 1.00 33.97 C ATOM 1251 CE1 PHE A 357 3.638 -3.750 18.511 1.00 34.60 C ATOM 1252 CE2 PHE A 357 3.891 -1.476 17.813 1.00 34.50 C ATOM 1253 CZ PHE A 357 4.224 -2.810 17.682 1.00 34.48 C ATOM 1254 H PHE A 357 2.427 -2.974 22.542 1.00 0.00 H ATOM 1255 N THR A 358 0.304 -0.908 23.532 1.00 24.06 N ATOM 1256 CA THR A 358 -0.627 -0.256 24.443 1.00 23.71 C ATOM 1257 C THR A 358 0.132 0.651 25.409 1.00 23.21 C ATOM 1258 O THR A 358 -0.253 1.806 25.627 1.00 24.46 O ATOM 1259 CB THR A 358 -1.465 -1.272 25.216 1.00 24.79 C ATOM 1260 OG1 THR A 358 -2.178 -2.091 24.279 1.00 27.03 O ATOM 1261 CG2 THR A 358 -2.449 -0.562 26.155 1.00 25.74 C ATOM 1262 HG1 THR A 358 -2.725 -2.754 24.771 1.00 0.00 H ATOM 1263 H THR A 358 0.397 -1.944 23.541 1.00 0.00 H ATOM 1264 N ALA A 359 1.235 0.155 25.941 1.00 22.42 N ATOM 1265 CA ALA A 359 2.061 0.982 26.821 1.00 22.06 C ATOM 1266 C ALA A 359 2.544 2.229 26.090 1.00 22.96 C ATOM 1267 O ALA A 359 2.541 3.313 26.666 1.00 22.71 O ATOM 1268 CB ALA A 359 3.243 0.210 27.347 1.00 21.63 C ATOM 1269 H ALA A 359 1.516 -0.825 25.734 1.00 0.00 H ATOM 1270 N ALA A 360 3.011 2.069 24.854 1.00 22.69 N ATOM 1271 CA ALA A 360 3.476 3.237 24.087 1.00 23.62 C ATOM 1272 C ALA A 360 2.335 4.250 23.857 1.00 23.62 C ATOM 1273 O ALA A 360 2.552 5.457 23.934 1.00 24.99 O ATOM 1274 CB ALA A 360 4.152 2.841 22.772 1.00 24.34 C ATOM 1275 H ALA A 360 3.047 1.120 24.430 1.00 0.00 H ATOM 1276 N HIS A 361 1.118 3.762 23.604 1.00 23.68 N ATOM 1277 CA HIS A 361 -0.045 4.648 23.424 1.00 24.68 C ATOM 1278 C HIS A 361 -0.319 5.467 24.696 1.00 24.47 C ATOM 1279 O HIS A 361 -0.490 6.700 24.646 1.00 23.64 O ATOM 1280 CB HIS A 361 -1.281 3.815 23.048 1.00 24.88 C ATOM 1281 CG HIS A 361 -2.517 4.618 22.799 1.00 25.56 C ATOM 1282 ND1 HIS A 361 -2.883 5.061 21.546 1.00 24.90 N ATOM 1283 CD2 HIS A 361 -3.503 5.016 23.638 1.00 25.76 C ATOM 1284 CE1 HIS A 361 -4.016 5.728 21.627 1.00 26.02 C ATOM 1285 NE2 HIS A 361 -4.421 5.701 22.880 1.00 24.89 N ATOM 1286 H HIS A 361 0.988 2.733 23.532 1.00 0.00 H ATOM 1287 N GLU A 362 -0.317 4.788 25.841 1.00 24.27 N ATOM 1288 CA GLU A 362 -0.634 5.432 27.111 1.00 23.34 C ATOM 1289 C GLU A 362 0.459 6.425 27.474 1.00 23.50 C ATOM 1290 O GLU A 362 0.171 7.531 27.905 1.00 22.09 O ATOM 1291 CB GLU A 362 -0.825 4.389 28.218 1.00 25.19 C ATOM 1292 CG GLU A 362 -1.949 3.395 27.962 1.00 26.33 C ATOM 1293 CD GLU A 362 -3.272 4.034 27.564 1.00 27.60 C ATOM 1294 OE1 GLU A 362 -3.529 5.213 27.913 1.00 27.36 O ATOM 1295 OE2 GLU A 362 -4.056 3.336 26.884 1.00 26.97 O ATOM 1296 H GLU A 362 -0.084 3.775 25.830 1.00 0.00 H ATOM 1297 N LEU A 363 1.716 6.028 27.287 1.00 24.23 N ATOM 1298 CA LEU A 363 2.844 6.933 27.481 1.00 24.59 C ATOM 1299 C LEU A 363 2.821 8.118 26.506 1.00 24.48 C ATOM 1300 O LEU A 363 3.233 9.218 26.878 1.00 25.82 O ATOM 1301 CB LEU A 363 4.177 6.176 27.408 1.00 25.16 C ATOM 1302 CG LEU A 363 4.345 5.221 28.597 1.00 25.73 C ATOM 1303 CD1 LEU A 363 5.444 4.209 28.302 1.00 25.27 C ATOM 1304 CD2 LEU A 363 4.633 5.990 29.873 1.00 27.27 C ATOM 1305 H LEU A 363 1.899 5.047 26.995 1.00 0.00 H ATOM 1306 N GLY A 364 2.330 7.920 25.279 1.00 24.68 N ATOM 1307 CA GLY A 364 2.119 9.039 24.346 1.00 25.48 C ATOM 1308 C GLY A 364 1.165 10.060 24.954 1.00 26.34 C ATOM 1309 O GLY A 364 1.415 11.279 24.910 1.00 27.31 O ATOM 1310 H GLY A 364 2.092 6.954 24.977 1.00 0.00 H ATOM 1311 N HIS A 365 0.068 9.586 25.531 1.00 25.69 N ATOM 1312 CA HIS A 365 -0.838 10.501 26.249 1.00 26.65 C ATOM 1313 C HIS A 365 -0.143 11.228 27.404 1.00 26.14 C ATOM 1314 O HIS A 365 -0.324 12.427 27.592 1.00 27.26 O ATOM 1315 CB HIS A 365 -2.047 9.769 26.821 1.00 27.31 C ATOM 1316 CG HIS A 365 -3.070 9.386 25.804 1.00 26.60 C ATOM 1317 ND1 HIS A 365 -3.555 10.268 24.861 1.00 26.15 N ATOM 1318 CD2 HIS A 365 -3.754 8.233 25.629 1.00 26.49 C ATOM 1319 CE1 HIS A 365 -4.477 9.669 24.136 1.00 27.19 C ATOM 1320 NE2 HIS A 365 -4.621 8.438 24.585 1.00 27.67 N ATOM 1321 H HIS A 365 -0.152 8.571 25.477 1.00 0.00 H ATOM 1322 N VAL A 366 0.667 10.515 28.179 1.00 24.20 N ATOM 1323 CA VAL A 366 1.409 11.139 29.277 1.00 26.10 C ATOM 1324 C VAL A 366 2.300 12.270 28.748 1.00 26.52 C ATOM 1325 O VAL A 366 2.484 13.293 29.418 1.00 27.25 O ATOM 1326 CB VAL A 366 2.238 10.083 30.020 1.00 24.82 C ATOM 1327 CG1 VAL A 366 3.232 10.717 30.979 1.00 25.24 C ATOM 1328 CG2 VAL A 366 1.299 9.146 30.764 1.00 25.07 C ATOM 1329 H VAL A 366 0.776 9.496 28.003 1.00 0.00 H ATOM 1330 N PHE A 367 2.833 12.077 27.545 1.00 27.12 N ATOM 1331 CA PHE A 367 3.637 13.088 26.834 1.00 27.60 C ATOM 1332 C PHE A 367 2.814 14.132 26.039 1.00 29.51 C ATOM 1333 O PHE A 367 3.358 14.860 25.190 1.00 29.20 O ATOM 1334 CB PHE A 367 4.678 12.405 25.945 1.00 28.44 C ATOM 1335 CG PHE A 367 5.947 12.064 26.669 1.00 29.82 C ATOM 1336 CD1 PHE A 367 6.209 10.765 27.073 1.00 30.05 C ATOM 1337 CD2 PHE A 367 6.880 13.062 26.960 1.00 29.56 C ATOM 1338 CE1 PHE A 367 7.377 10.451 27.749 1.00 31.10 C ATOM 1339 CE2 PHE A 367 8.048 12.750 27.634 1.00 30.80 C ATOM 1340 CZ PHE A 367 8.300 11.451 28.029 1.00 30.31 C ATOM 1341 H PHE A 367 2.674 11.161 27.079 1.00 0.00 H ATOM 1342 N ASN A 368 1.529 14.218 26.365 1.00 29.66 N ATOM 1343 CA ASN A 368 0.596 15.227 25.844 1.00 30.32 C ATOM 1344 C ASN A 368 0.038 14.960 24.451 1.00 29.88 C ATOM 1345 O ASN A 368 -0.585 15.851 23.853 1.00 30.96 O ATOM 1346 CB ASN A 368 1.203 16.643 25.901 1.00 30.76 C ATOM 1347 CG ASN A 368 0.146 17.726 26.018 1.00 31.98 C ATOM 1348 OD1 ASN A 368 -0.844 17.556 26.722 1.00 33.25 O ATOM 1349 ND2 ASN A 368 0.351 18.844 25.331 1.00 34.17 N ATOM 1350 HD22 ASN A 368 1.205 18.946 24.746 1.00 0.00 H ATOM 1351 HD21 ASN A 368 -0.342 19.618 25.378 1.00 0.00 H ATOM 1352 H ASN A 368 1.156 13.519 27.039 1.00 0.00 H ATOM 1353 N MET A 369 0.226 13.749 23.928 1.00 28.13 N ATOM 1354 CA MET A 369 -0.262 13.425 22.594 1.00 29.23 C ATOM 1355 C MET A 369 -1.769 13.156 22.563 1.00 28.72 C ATOM 1356 O MET A 369 -2.341 12.586 23.507 1.00 30.84 O ATOM 1357 CB MET A 369 0.456 12.200 22.021 1.00 28.93 C ATOM 1358 CG MET A 369 1.965 12.329 21.877 1.00 27.42 C ATOM 1359 SD MET A 369 2.673 10.779 21.287 1.00 28.09 S ATOM 1360 CE MET A 369 4.430 11.052 21.539 1.00 28.51 C ATOM 1361 H MET A 369 0.728 13.025 24.480 1.00 0.00 H ATOM 1362 N LEU A 370 -2.384 13.576 21.459 1.00 29.69 N ATOM 1363 CA LEU A 370 -3.789 13.316 21.141 1.00 32.06 C ATOM 1364 C LEU A 370 -3.935 12.102 20.247 1.00 31.81 C ATOM 1365 O LEU A 370 -2.949 11.596 19.715 1.00 30.43 O ATOM 1366 CB LEU A 370 -4.355 14.499 20.354 1.00 33.45 C ATOM 1367 CG LEU A 370 -4.106 15.893 20.923 1.00 35.51 C ATOM 1368 CD1 LEU A 370 -4.585 16.956 19.944 1.00 37.52 C ATOM 1369 CD2 LEU A 370 -4.796 16.021 22.265 1.00 37.97 C ATOM 1370 H LEU A 370 -1.827 14.127 20.775 1.00 0.00 H ATOM 1371 N HIS A 371 -5.179 11.686 20.005 1.00 31.66 N ATOM 1372 CA HIS A 371 -5.444 10.696 18.960 1.00 31.20 C ATOM 1373 C HIS A 371 -5.322 11.278 17.563 1.00 32.44 C ATOM 1374 O HIS A 371 -5.650 12.443 17.335 1.00 33.25 O ATOM 1375 CB HIS A 371 -6.829 10.075 19.115 1.00 31.30 C ATOM 1376 CG HIS A 371 -6.980 9.237 20.337 1.00 30.80 C ATOM 1377 ND1 HIS A 371 -8.206 9.001 20.923 1.00 31.57 N ATOM 1378 CD2 HIS A 371 -6.065 8.599 21.110 1.00 29.68 C ATOM 1379 CE1 HIS A 371 -8.042 8.246 21.993 1.00 31.84 C ATOM 1380 NE2 HIS A 371 -6.755 7.985 22.124 1.00 29.52 N ATOM 1381 H HIS A 371 -5.968 12.069 20.564 1.00 0.00 H ATOM 1382 N ASP A 372 -4.901 10.441 16.619 1.00 32.70 N ATOM 1383 CA ASP A 372 -4.634 10.872 15.256 1.00 33.63 C ATOM 1384 C ASP A 372 -5.864 11.237 14.435 1.00 35.08 C ATOM 1385 O ASP A 372 -5.721 11.833 13.373 1.00 38.29 O ATOM 1386 CB ASP A 372 -3.804 9.815 14.522 1.00 32.63 C ATOM 1387 CG ASP A 372 -2.359 9.829 14.961 1.00 33.88 C ATOM 1388 OD1 ASP A 372 -1.819 10.935 15.173 1.00 32.91 O ATOM 1389 OD2 ASP A 372 -1.763 8.745 15.093 1.00 32.50 O ATOM 1390 H ASP A 372 -4.757 9.441 16.865 1.00 0.00 H ATOM 1391 N ASN A 373 -7.044 10.858 14.916 1.00 36.76 N ATOM 1392 CA ASN A 373 -8.311 11.259 14.295 1.00 37.89 C ATOM 1393 C ASN A 373 -8.921 12.522 14.927 1.00 38.31 C ATOM 1394 O ASN A 373 -10.022 12.952 14.546 1.00 37.22 O ATOM 1395 CB ASN A 373 -9.311 10.094 14.336 1.00 38.45 C ATOM 1396 CG ASN A 373 -9.806 9.787 15.736 1.00 38.97 C ATOM 1397 OD1 ASN A 373 -9.103 10.010 16.726 1.00 39.21 O ATOM 1398 ND2 ASN A 373 -11.032 9.278 15.830 1.00 39.49 N ATOM 1399 HD22 ASN A 373 -11.591 9.106 14.970 1.00 0.00 H ATOM 1400 HD21 ASN A 373 -11.431 9.053 16.763 1.00 0.00 H ATOM 1401 H ASN A 373 -7.070 10.255 15.763 1.00 0.00 H ATOM 1402 N SER A 374 -8.212 13.119 15.885 1.00 37.57 N ATOM 1403 CA SER A 374 -8.626 14.398 16.480 1.00 38.68 C ATOM 1404 C SER A 374 -8.473 15.528 15.455 1.00 39.94 C ATOM 1405 O SER A 374 -7.724 15.391 14.481 1.00 38.57 O ATOM 1406 CB SER A 374 -7.783 14.719 17.707 1.00 39.51 C ATOM 1407 OG SER A 374 -6.488 15.124 17.312 1.00 37.31 O ATOM 1408 HG SER A 374 -6.056 14.394 16.802 1.00 0.00 H ATOM 1409 H SER A 374 -7.339 12.666 16.222 1.00 0.00 H ATOM 1410 N LYS A 375 -9.172 16.643 15.690 1.00 43.16 N ATOM 1411 CA LYS A 375 -9.176 17.768 14.740 1.00 45.04 C ATOM 1412 C LYS A 375 -7.779 18.359 14.565 1.00 43.96 C ATOM 1413 O LYS A 375 -7.328 18.534 13.427 1.00 41.92 O ATOM 1414 CB LYS A 375 -10.162 18.872 15.152 1.00 47.65 C ATOM 1415 CG LYS A 375 -11.608 18.423 15.306 1.00 50.30 C ATOM 1416 CD LYS A 375 -12.415 18.625 14.038 1.00 53.65 C ATOM 1417 CE LYS A 375 -13.903 18.525 14.332 1.00 55.41 C ATOM 1418 NZ LYS A 375 -14.721 18.638 13.096 1.00 57.11 N ATOM 1419 HZ1 LYS A 375 -14.539 19.557 12.644 1.00 0.00 H ATOM 1420 HZ2 LYS A 375 -14.465 17.871 12.441 1.00 0.00 H ATOM 1421 HZ3 LYS A 375 -15.729 18.565 13.341 1.00 0.00 H ATOM 1422 H LYS A 375 -9.727 16.718 16.566 1.00 0.00 H ATOM 1423 N PRO A 376 -7.076 18.640 15.689 1.00 41.64 N ATOM 1424 CA PRO A 376 -5.714 19.183 15.579 1.00 41.62 C ATOM 1425 C PRO A 376 -4.755 18.261 14.831 1.00 40.89 C ATOM 1426 O PRO A 376 -3.818 18.737 14.186 1.00 41.39 O ATOM 1427 CB PRO A 376 -5.264 19.334 17.039 1.00 40.73 C ATOM 1428 CG PRO A 376 -6.510 19.289 17.850 1.00 41.27 C ATOM 1429 CD PRO A 376 -7.455 18.415 17.095 1.00 41.40 C ATOM 1430 N CYS A 377 -4.983 16.953 14.923 1.00 39.85 N ATOM 1431 CA CYS A 377 -4.130 15.985 14.230 1.00 39.33 C ATOM 1432 C CYS A 377 -4.407 15.871 12.728 1.00 40.90 C ATOM 1433 O CYS A 377 -3.507 15.528 11.976 1.00 39.64 O ATOM 1434 CB CYS A 377 -4.212 14.604 14.900 1.00 37.13 C ATOM 1435 SG CYS A 377 -3.332 14.485 16.481 1.00 35.46 S ATOM 1436 H CYS A 377 -5.781 16.612 15.497 1.00 0.00 H ATOM 1437 N ILE A 378 -5.634 16.153 12.287 1.00 44.16 N ATOM 1438 CA ILE A 378 -5.959 16.086 10.853 1.00 46.19 C ATOM 1439 C ILE A 378 -5.154 17.121 10.061 1.00 45.09 C ATOM 1440 O ILE A 378 -4.615 16.811 9.003 1.00 42.62 O ATOM 1441 CB ILE A 378 -7.472 16.265 10.606 1.00 48.51 C ATOM 1442 CG1 ILE A 378 -8.229 15.061 11.184 1.00 50.57 C ATOM 1443 CG2 ILE A 378 -7.775 16.383 9.112 1.00 50.03 C ATOM 1444 CD1 ILE A 378 -9.551 15.414 11.826 1.00 50.83 C ATOM 1445 H ILE A 378 -6.373 16.424 12.967 1.00 0.00 H ATOM 1446 N SER A 379 -5.068 18.332 10.609 1.00 46.44 N ATOM 1447 CA SER A 379 -4.271 19.426 10.040 1.00 46.56 C ATOM 1448 C SER A 379 -2.765 19.128 9.997 1.00 45.60 C ATOM 1449 O SER A 379 -2.066 19.511 9.045 1.00 44.95 O ATOM 1450 CB SER A 379 -4.476 20.695 10.872 1.00 48.25 C ATOM 1451 OG SER A 379 -5.845 21.052 10.966 1.00 51.21 O ATOM 1452 HG SER A 379 -5.934 21.874 11.510 1.00 0.00 H ATOM 1453 H SER A 379 -5.594 18.512 11.488 1.00 0.00 H ATOM 1454 N LEU A 380 -2.272 18.467 11.045 1.00 41.51 N ATOM 1455 CA LEU A 380 -0.850 18.134 11.166 1.00 39.71 C ATOM 1456 C LEU A 380 -0.458 16.851 10.407 1.00 39.31 C ATOM 1457 O LEU A 380 0.671 16.735 9.944 1.00 41.27 O ATOM 1458 CB LEU A 380 -0.453 18.037 12.648 1.00 36.87 C ATOM 1459 CG LEU A 380 -0.316 19.358 13.438 1.00 36.03 C ATOM 1460 CD1 LEU A 380 -0.413 19.127 14.941 1.00 37.00 C ATOM 1461 CD2 LEU A 380 1.001 20.048 13.108 1.00 35.20 C ATOM 1462 H LEU A 380 -2.921 18.177 11.805 1.00 0.00 H ATOM 1463 N ASN A 381 -1.374 15.894 10.272 1.00 40.08 N ATOM 1464 CA ASN A 381 -1.063 14.631 9.588 1.00 40.97 C ATOM 1465 C ASN A 381 -1.356 14.620 8.088 1.00 43.32 C ATOM 1466 O ASN A 381 -0.730 13.867 7.346 1.00 41.23 O ATOM 1467 CB ASN A 381 -1.811 13.462 10.238 1.00 41.63 C ATOM 1468 CG ASN A 381 -1.358 13.194 11.663 1.00 38.72 C ATOM 1469 OD1 ASN A 381 -0.283 13.628 12.079 1.00 37.27 O ATOM 1470 ND2 ASN A 381 -2.184 12.484 12.420 1.00 36.71 N ATOM 1471 HD22 ASN A 381 -3.082 12.138 12.026 1.00 0.00 H ATOM 1472 HD21 ASN A 381 -1.934 12.274 13.407 1.00 0.00 H ATOM 1473 H ASN A 381 -2.328 16.043 10.658 1.00 0.00 H ATOM 1474 N GLY A 382 -2.308 15.442 7.652 1.00 44.62 N ATOM 1475 CA GLY A 382 -2.783 15.394 6.276 1.00 46.68 C ATOM 1476 C GLY A 382 -3.862 14.331 6.162 1.00 49.85 C ATOM 1477 O GLY A 382 -4.274 13.758 7.177 1.00 51.34 O ATOM 1478 H GLY A 382 -2.722 16.134 8.309 1.00 0.00 H ATOM 1479 N PRO A 383 -4.326 14.057 4.931 1.00 51.73 N ATOM 1480 CA PRO A 383 -5.454 13.166 4.692 1.00 53.45 C ATOM 1481 C PRO A 383 -5.081 11.718 4.343 1.00 56.96 C ATOM 1482 O PRO A 383 -5.969 10.861 4.296 1.00 59.67 O ATOM 1483 CB PRO A 383 -6.126 13.819 3.485 1.00 53.12 C ATOM 1484 CG PRO A 383 -4.980 14.376 2.698 1.00 52.01 C ATOM 1485 CD PRO A 383 -3.851 14.649 3.666 1.00 51.49 C ATOM 1486 N LEU A 384 -3.798 11.446 4.111 1.00 57.07 N ATOM 1487 CA LEU A 384 -3.372 10.164 3.543 1.00 57.78 C ATOM 1488 C LEU A 384 -2.903 9.184 4.611 1.00 57.99 C ATOM 1489 O LEU A 384 -2.863 7.972 4.368 1.00 58.72 O ATOM 1490 CB LEU A 384 -2.265 10.388 2.504 1.00 57.60 C ATOM 1491 CG LEU A 384 -2.716 11.105 1.222 1.00 57.73 C ATOM 1492 CD1 LEU A 384 -1.524 11.655 0.453 1.00 57.86 C ATOM 1493 CD2 LEU A 384 -3.544 10.177 0.343 1.00 57.44 C ATOM 1494 H LEU A 384 -3.079 12.162 4.339 1.00 0.00 H TER 1495 LEU A 384 ATOM 1496 N SER A 387 -4.567 5.326 10.292 1.00 48.24 N ATOM 1497 CA SER A 387 -4.894 4.489 11.442 1.00 47.38 C ATOM 1498 C SER A 387 -3.722 3.579 11.810 1.00 47.11 C ATOM 1499 O SER A 387 -3.872 2.619 12.562 1.00 46.49 O ATOM 1500 CB SER A 387 -6.132 3.651 11.134 1.00 48.33 C ATOM 1501 OG SER A 387 -6.996 4.346 10.248 1.00 49.67 O ATOM 1502 HG SER A 387 -7.792 3.788 10.060 1.00 0.00 H ATOM 1503 HN3 SER A 387 -4.346 4.721 9.476 1.00 0.00 H ATOM 1504 HN2 SER A 387 -3.743 5.919 10.519 1.00 0.00 H ATOM 1505 HN1 SER A 387 -5.380 5.933 10.064 1.00 0.00 H ATOM 1506 N ARG A 388 -2.541 3.950 11.333 1.00 43.73 N ATOM 1507 CA ARG A 388 -1.385 3.062 11.262 1.00 42.55 C ATOM 1508 C ARG A 388 -0.295 3.494 12.252 1.00 38.08 C ATOM 1509 O ARG A 388 0.851 3.074 12.133 1.00 36.97 O ATOM 1510 CB ARG A 388 -0.825 3.088 9.831 1.00 46.03 C ATOM 1511 CG ARG A 388 -0.874 4.475 9.197 1.00 48.78 C ATOM 1512 CD ARG A 388 -0.114 4.579 7.889 1.00 51.12 C ATOM 1513 NE ARG A 388 0.070 5.988 7.534 1.00 54.16 N ATOM 1514 CZ ARG A 388 1.235 6.637 7.513 1.00 55.93 C ATOM 1515 NH1 ARG A 388 2.385 6.019 7.797 1.00 56.90 N ATOM 1516 NH2 ARG A 388 1.256 7.926 7.182 1.00 57.91 N ATOM 1517 HE ARG A 388 -0.780 6.529 7.276 1.00 0.00 H ATOM 1518 HH12 ARG A 388 3.280 6.549 7.773 1.00 0.00 H ATOM 1519 HH11 ARG A 388 2.386 5.008 8.042 1.00 0.00 H ATOM 1520 HH22 ARG A 388 2.158 8.443 7.162 1.00 0.00 H ATOM 1521 HH21 ARG A 388 0.370 8.416 6.943 1.00 0.00 H ATOM 1522 H ARG A 388 -2.433 4.926 10.991 1.00 0.00 H ATOM 1523 N HIS A 389 -0.656 4.337 13.222 1.00 34.15 N ATOM 1524 CA HIS A 389 0.314 4.866 14.188 1.00 33.67 C ATOM 1525 C HIS A 389 -0.059 4.503 15.625 1.00 31.60 C ATOM 1526 O HIS A 389 -1.173 4.073 15.895 1.00 30.66 O ATOM 1527 CB HIS A 389 0.402 6.383 14.089 1.00 33.67 C ATOM 1528 CG HIS A 389 0.614 6.893 12.699 1.00 37.04 C ATOM 1529 ND1 HIS A 389 1.786 6.693 12.004 1.00 37.64 N ATOM 1530 CD2 HIS A 389 -0.197 7.600 11.876 1.00 39.71 C ATOM 1531 CE1 HIS A 389 1.689 7.256 10.813 1.00 38.74 C ATOM 1532 NE2 HIS A 389 0.494 7.807 10.708 1.00 39.37 N ATOM 1533 H HIS A 389 -1.652 4.627 13.295 1.00 0.00 H ATOM 1534 N VAL A 390 0.865 4.745 16.551 1.00 30.37 N ATOM 1535 CA VAL A 390 0.624 4.439 17.961 1.00 27.11 C ATOM 1536 C VAL A 390 -0.596 5.172 18.514 1.00 26.33 C ATOM 1537 O VAL A 390 -1.374 4.605 19.282 1.00 25.40 O ATOM 1538 CB VAL A 390 1.891 4.692 18.828 1.00 27.39 C ATOM 1539 CG1 VAL A 390 1.586 4.561 20.321 1.00 28.54 C ATOM 1540 CG2 VAL A 390 2.984 3.717 18.422 1.00 28.51 C ATOM 1541 H VAL A 390 1.776 5.159 16.267 1.00 0.00 H ATOM 1542 N MET A 391 -0.801 6.413 18.082 1.00 26.66 N ATOM 1543 CA MET A 391 -1.874 7.240 18.640 1.00 27.86 C ATOM 1544 C MET A 391 -3.173 7.185 17.815 1.00 28.78 C ATOM 1545 O MET A 391 -4.018 8.065 17.928 1.00 29.47 O ATOM 1546 CB MET A 391 -1.394 8.686 18.851 1.00 27.24 C ATOM 1547 CG MET A 391 -0.199 8.821 19.814 1.00 27.81 C ATOM 1548 SD MET A 391 -0.377 7.916 21.390 1.00 26.88 S ATOM 1549 CE MET A 391 -1.793 8.755 22.132 1.00 28.58 C ATOM 1550 H MET A 391 -0.190 6.803 17.336 1.00 0.00 H ATOM 1551 N ALA A 392 -3.350 6.122 17.031 1.00 29.44 N ATOM 1552 CA ALA A 392 -4.670 5.782 16.519 1.00 30.93 C ATOM 1553 C ALA A 392 -5.616 5.584 17.716 1.00 31.70 C ATOM 1554 O ALA A 392 -5.171 5.174 18.792 1.00 31.28 O ATOM 1555 CB ALA A 392 -4.601 4.516 15.690 1.00 30.64 C ATOM 1556 H ALA A 392 -2.534 5.527 16.781 1.00 0.00 H ATOM 1557 N PRO A 393 -6.917 5.881 17.538 1.00 34.06 N ATOM 1558 CA PRO A 393 -7.853 5.781 18.660 1.00 35.86 C ATOM 1559 C PRO A 393 -8.091 4.344 19.117 1.00 36.99 C ATOM 1560 O PRO A 393 -8.436 4.113 20.280 1.00 38.11 O ATOM 1561 CB PRO A 393 -9.138 6.417 18.096 1.00 36.31 C ATOM 1562 CG PRO A 393 -9.055 6.200 16.633 1.00 35.55 C ATOM 1563 CD PRO A 393 -7.591 6.328 16.302 1.00 35.39 C ATOM 1564 N VAL A 394 -7.896 3.396 18.202 1.00 38.17 N ATOM 1565 CA VAL A 394 -7.960 1.974 18.511 1.00 39.10 C ATOM 1566 C VAL A 394 -6.728 1.295 17.945 1.00 39.08 C ATOM 1567 O VAL A 394 -6.127 1.776 16.980 1.00 38.43 O ATOM 1568 CB VAL A 394 -9.227 1.314 17.929 1.00 40.84 C ATOM 1569 CG1 VAL A 394 -10.474 2.065 18.381 1.00 41.38 C ATOM 1570 CG2 VAL A 394 -9.159 1.242 16.408 1.00 41.98 C ATOM 1571 H VAL A 394 -7.689 3.684 17.224 1.00 0.00 H ATOM 1572 N MET A 395 -6.342 0.177 18.540 1.00 38.99 N ATOM 1573 CA MET A 395 -5.154 -0.516 18.065 1.00 40.56 C ATOM 1574 C MET A 395 -5.398 -1.045 16.667 1.00 42.26 C ATOM 1575 O MET A 395 -6.413 -1.686 16.397 1.00 42.01 O ATOM 1576 CB MET A 395 -4.755 -1.665 18.982 1.00 42.20 C ATOM 1577 CG MET A 395 -3.431 -2.290 18.563 1.00 43.98 C ATOM 1578 SD MET A 395 -2.883 -3.617 19.639 1.00 45.76 S ATOM 1579 CE MET A 395 -2.395 -2.696 21.103 1.00 45.02 C ATOM 1580 H MET A 395 -6.884 -0.203 19.342 1.00 0.00 H ATOM 1581 N ALA A 396 -4.459 -0.750 15.782 1.00 43.89 N ATOM 1582 CA ALA A 396 -4.441 -1.332 14.456 1.00 44.56 C ATOM 1583 C ALA A 396 -2.990 -1.693 14.205 1.00 45.50 C ATOM 1584 O ALA A 396 -2.146 -1.548 15.105 1.00 46.86 O ATOM 1585 CB ALA A 396 -4.957 -0.339 13.427 1.00 44.74 C ATOM 1586 H ALA A 396 -3.710 -0.079 16.047 1.00 0.00 H ATOM 1587 N HIS A 397 -2.677 -2.157 13.007 1.00 43.07 N ATOM 1588 CA HIS A 397 -1.303 -2.521 12.729 1.00 43.12 C ATOM 1589 C HIS A 397 -0.444 -1.261 12.552 1.00 42.25 C ATOM 1590 O HIS A 397 -0.747 -0.391 11.730 1.00 41.68 O ATOM 1591 CB HIS A 397 -1.196 -3.457 11.534 1.00 45.07 C ATOM 1592 CG HIS A 397 0.191 -3.956 11.321 1.00 45.02 C ATOM 1593 ND1 HIS A 397 1.064 -3.345 10.449 1.00 47.21 N ATOM 1594 CD2 HIS A 397 0.884 -4.955 11.917 1.00 45.76 C ATOM 1595 CE1 HIS A 397 2.225 -3.967 10.491 1.00 47.20 C ATOM 1596 NE2 HIS A 397 2.145 -4.948 11.374 1.00 46.88 N ATOM 1597 H HIS A 397 -3.408 -2.259 12.274 1.00 0.00 H ATOM 1598 N VAL A 398 0.607 -1.170 13.366 1.00 38.29 N ATOM 1599 CA VAL A 398 1.434 0.028 13.462 1.00 37.46 C ATOM 1600 C VAL A 398 2.531 0.002 12.405 1.00 36.37 C ATOM 1601 O VAL A 398 3.269 -0.976 12.295 1.00 39.24 O ATOM 1602 CB VAL A 398 2.075 0.155 14.861 1.00 36.37 C ATOM 1603 CG1 VAL A 398 3.065 1.315 14.906 1.00 36.39 C ATOM 1604 CG2 VAL A 398 0.987 0.352 15.912 1.00 36.89 C ATOM 1605 H VAL A 398 0.848 -1.989 13.959 1.00 0.00 H ATOM 1606 N ASP A 399 2.638 1.095 11.655 1.00 35.86 N ATOM 1607 CA ASP A 399 3.648 1.234 10.608 1.00 36.18 C ATOM 1608 C ASP A 399 5.065 1.228 11.200 1.00 34.78 C ATOM 1609 O ASP A 399 5.425 2.129 11.959 1.00 33.55 O ATOM 1610 CB ASP A 399 3.402 2.534 9.834 1.00 36.53 C ATOM 1611 CG ASP A 399 4.269 2.663 8.589 1.00 38.05 C ATOM 1612 OD1 ASP A 399 5.322 2.005 8.516 1.00 40.97 O ATOM 1613 OD2 ASP A 399 3.883 3.440 7.686 1.00 40.82 O ATOM 1614 H ASP A 399 1.977 1.881 11.820 1.00 0.00 H ATOM 1615 N PRO A 400 5.888 0.221 10.840 1.00 34.36 N ATOM 1616 CA PRO A 400 7.234 0.172 11.417 1.00 33.95 C ATOM 1617 C PRO A 400 8.136 1.353 11.029 1.00 33.50 C ATOM 1618 O PRO A 400 9.057 1.678 11.768 1.00 33.05 O ATOM 1619 CB PRO A 400 7.813 -1.150 10.896 1.00 34.42 C ATOM 1620 CG PRO A 400 6.957 -1.564 9.755 1.00 34.51 C ATOM 1621 CD PRO A 400 5.618 -0.906 9.927 1.00 34.79 C ATOM 1622 N GLU A 401 7.868 1.974 9.878 1.00 31.67 N ATOM 1623 CA GLU A 401 8.622 3.160 9.427 1.00 33.47 C ATOM 1624 C GLU A 401 8.081 4.467 9.994 1.00 33.72 C ATOM 1625 O GLU A 401 8.663 5.531 9.780 1.00 35.56 O ATOM 1626 CB GLU A 401 8.609 3.250 7.891 1.00 33.21 C ATOM 1627 CG GLU A 401 9.707 2.441 7.232 1.00 32.60 C ATOM 1628 CD GLU A 401 9.514 0.956 7.426 1.00 30.80 C ATOM 1629 OE1 GLU A 401 8.606 0.393 6.782 1.00 31.98 O ATOM 1630 OE2 GLU A 401 10.276 0.345 8.208 1.00 32.08 O ATOM 1631 H GLU A 401 7.101 1.609 9.278 1.00 0.00 H ATOM 1632 N GLU A 402 6.949 4.414 10.681 1.00 32.98 N ATOM 1633 CA GLU A 402 6.362 5.633 11.209 1.00 33.37 C ATOM 1634 C GLU A 402 5.408 5.309 12.352 1.00 32.38 C ATOM 1635 O GLU A 402 4.197 5.493 12.225 1.00 34.36 O ATOM 1636 CB GLU A 402 5.637 6.419 10.095 1.00 35.44 C ATOM 1637 CG GLU A 402 5.340 7.866 10.476 1.00 37.54 C ATOM 1638 CD GLU A 402 4.647 8.666 9.380 1.00 41.78 C ATOM 1639 OE1 GLU A 402 4.197 8.076 8.373 1.00 43.23 O ATOM 1640 OE2 GLU A 402 4.528 9.900 9.533 1.00 42.04 O ATOM 1641 H GLU A 402 6.481 3.499 10.842 1.00 0.00 H ATOM 1642 N PRO A 403 5.956 4.816 13.481 1.00 31.83 N ATOM 1643 CA PRO A 403 5.063 4.541 14.619 1.00 30.30 C ATOM 1644 C PRO A 403 4.350 5.794 15.132 1.00 30.14 C ATOM 1645 O PRO A 403 3.234 5.681 15.640 1.00 31.41 O ATOM 1646 CB PRO A 403 6.009 3.960 15.688 1.00 29.84 C ATOM 1647 CG PRO A 403 7.374 4.420 15.298 1.00 31.15 C ATOM 1648 CD PRO A 403 7.360 4.498 13.798 1.00 31.13 C ATOM 1649 N TRP A 404 4.982 6.960 14.982 1.00 27.91 N ATOM 1650 CA TRP A 404 4.442 8.227 15.453 1.00 28.71 C ATOM 1651 C TRP A 404 4.071 9.117 14.275 1.00 29.84 C ATOM 1652 O TRP A 404 4.886 9.367 13.386 1.00 32.21 O ATOM 1653 CB TRP A 404 5.452 8.967 16.328 1.00 29.10 C ATOM 1654 CG TRP A 404 5.944 8.136 17.461 1.00 27.63 C ATOM 1655 CD1 TRP A 404 7.147 7.503 17.544 1.00 28.10 C ATOM 1656 CD2 TRP A 404 5.234 7.806 18.663 1.00 26.72 C ATOM 1657 NE1 TRP A 404 7.244 6.816 18.729 1.00 27.98 N ATOM 1658 CE2 TRP A 404 6.075 6.962 19.425 1.00 27.26 C ATOM 1659 CE3 TRP A 404 3.965 8.119 19.162 1.00 26.30 C ATOM 1660 CZ2 TRP A 404 5.710 6.473 20.666 1.00 28.02 C ATOM 1661 CZ3 TRP A 404 3.596 7.616 20.391 1.00 26.93 C ATOM 1662 CH2 TRP A 404 4.472 6.819 21.143 1.00 26.80 C ATOM 1663 HE1 TRP A 404 8.072 6.273 19.046 1.00 0.00 H ATOM 1664 H TRP A 404 5.906 6.963 14.505 1.00 0.00 H ATOM 1665 N SER A 405 2.843 9.603 14.285 1.00 31.20 N ATOM 1666 CA SER A 405 2.381 10.540 13.266 1.00 31.66 C ATOM 1667 C SER A 405 3.041 11.906 13.424 1.00 31.11 C ATOM 1668 O SER A 405 3.597 12.222 14.477 1.00 30.70 O ATOM 1669 CB SER A 405 0.881 10.727 13.412 1.00 30.96 C ATOM 1670 OG SER A 405 0.621 11.359 14.648 1.00 31.64 O ATOM 1671 HG SER A 405 -0.355 11.486 14.754 1.00 0.00 H ATOM 1672 H SER A 405 2.188 9.310 15.038 1.00 0.00 H ATOM 1673 N PRO A 406 2.949 12.759 12.380 1.00 32.37 N ATOM 1674 CA PRO A 406 3.424 14.131 12.571 1.00 32.26 C ATOM 1675 C PRO A 406 2.747 14.887 13.716 1.00 30.48 C ATOM 1676 O PRO A 406 3.379 15.725 14.361 1.00 30.70 O ATOM 1677 CB PRO A 406 3.128 14.796 11.211 1.00 31.78 C ATOM 1678 CG PRO A 406 3.152 13.672 10.234 1.00 32.22 C ATOM 1679 CD PRO A 406 2.602 12.480 10.974 1.00 33.38 C ATOM 1680 N CYS A 407 1.472 14.606 13.957 1.00 30.61 N ATOM 1681 CA CYS A 407 0.765 15.189 15.076 1.00 33.06 C ATOM 1682 C CYS A 407 1.386 14.769 16.413 1.00 32.42 C ATOM 1683 O CYS A 407 1.595 15.600 17.300 1.00 32.00 O ATOM 1684 CB CYS A 407 -0.693 14.791 15.037 1.00 32.95 C ATOM 1685 SG CYS A 407 -1.660 15.659 16.268 1.00 33.00 S ATOM 1686 H CYS A 407 0.969 13.950 13.325 1.00 0.00 H ATOM 1687 N SER A 408 1.672 13.477 16.548 1.00 31.50 N ATOM 1688 CA SER A 408 2.339 12.976 17.749 1.00 29.70 C ATOM 1689 C SER A 408 3.680 13.677 17.998 1.00 29.05 C ATOM 1690 O SER A 408 3.913 14.205 19.076 1.00 28.63 O ATOM 1691 CB SER A 408 2.513 11.450 17.700 1.00 29.33 C ATOM 1692 OG SER A 408 1.272 10.788 17.890 1.00 29.06 O ATOM 1693 HG SER A 408 1.413 9.809 17.854 1.00 0.00 H ATOM 1694 H SER A 408 1.418 12.814 15.789 1.00 0.00 H ATOM 1695 N ALA A 409 4.536 13.726 16.986 1.00 30.23 N ATOM 1696 CA ALA A 409 5.841 14.384 17.123 1.00 30.75 C ATOM 1697 C ALA A 409 5.717 15.865 17.505 1.00 29.65 C ATOM 1698 O ALA A 409 6.485 16.374 18.329 1.00 30.59 O ATOM 1699 CB ALA A 409 6.647 14.233 15.843 1.00 29.82 C ATOM 1700 H ALA A 409 4.278 13.290 16.078 1.00 0.00 H ATOM 1701 N ARG A 410 4.759 16.556 16.889 1.00 32.63 N ATOM 1702 CA ARG A 410 4.523 17.970 17.195 1.00 32.34 C ATOM 1703 C ARG A 410 4.122 18.180 18.644 1.00 31.57 C ATOM 1704 O ARG A 410 4.643 19.050 19.329 1.00 30.97 O ATOM 1705 CB ARG A 410 3.439 18.551 16.275 1.00 32.90 C ATOM 1706 CG ARG A 410 3.085 20.013 16.535 1.00 34.08 C ATOM 1707 CD ARG A 410 4.297 20.936 16.460 1.00 34.11 C ATOM 1708 NE ARG A 410 3.933 22.347 16.630 1.00 33.68 N ATOM 1709 CZ ARG A 410 3.473 23.140 15.664 1.00 34.19 C ATOM 1710 NH1 ARG A 410 3.308 22.684 14.428 1.00 34.89 N ATOM 1711 NH2 ARG A 410 3.171 24.407 15.949 1.00 35.38 N ATOM 1712 HE ARG A 410 4.043 22.760 17.578 1.00 0.00 H ATOM 1713 HH12 ARG A 410 2.948 23.316 13.684 1.00 0.00 H ATOM 1714 HH11 ARG A 410 3.539 21.695 14.203 1.00 0.00 H ATOM 1715 HH22 ARG A 410 2.811 25.036 15.203 1.00 0.00 H ATOM 1716 HH21 ARG A 410 3.295 24.766 16.917 1.00 0.00 H ATOM 1717 H ARG A 410 4.167 16.083 16.177 1.00 0.00 H ATOM 1718 N PHE A 411 3.176 17.378 19.113 1.00 30.24 N ATOM 1719 CA PHE A 411 2.682 17.547 20.459 1.00 30.77 C ATOM 1720 C PHE A 411 3.744 17.223 21.510 1.00 29.26 C ATOM 1721 O PHE A 411 3.875 17.967 22.470 1.00 28.38 O ATOM 1722 CB PHE A 411 1.376 16.776 20.665 1.00 30.79 C ATOM 1723 CG PHE A 411 0.167 17.584 20.299 1.00 32.27 C ATOM 1724 CD1 PHE A 411 -0.103 17.872 18.964 1.00 33.21 C ATOM 1725 CD2 PHE A 411 -0.664 18.098 21.277 1.00 33.32 C ATOM 1726 CE1 PHE A 411 -1.201 18.639 18.612 1.00 33.99 C ATOM 1727 CE2 PHE A 411 -1.763 18.874 20.931 1.00 33.68 C ATOM 1728 CZ PHE A 411 -2.030 19.137 19.598 1.00 32.83 C ATOM 1729 H PHE A 411 2.789 16.625 18.509 1.00 0.00 H ATOM 1730 N ILE A 412 4.536 16.158 21.315 1.00 29.51 N ATOM 1731 CA ILE A 412 5.620 15.901 22.272 1.00 30.08 C ATOM 1732 C ILE A 412 6.715 16.973 22.165 1.00 31.17 C ATOM 1733 O ILE A 412 7.265 17.397 23.183 1.00 31.62 O ATOM 1734 CB ILE A 412 6.230 14.476 22.178 1.00 30.06 C ATOM 1735 CG1 ILE A 412 7.169 14.234 23.380 1.00 31.00 C ATOM 1736 CG2 ILE A 412 6.947 14.260 20.854 1.00 30.98 C ATOM 1737 CD1 ILE A 412 7.695 12.815 23.492 1.00 31.54 C ATOM 1738 H ILE A 412 4.385 15.527 20.502 1.00 0.00 H ATOM 1739 N THR A 413 6.989 17.438 20.943 1.00 31.81 N ATOM 1740 CA THR A 413 8.043 18.429 20.726 1.00 34.61 C ATOM 1741 C THR A 413 7.671 19.743 21.440 1.00 34.55 C ATOM 1742 O THR A 413 8.478 20.292 22.189 1.00 33.44 O ATOM 1743 CB THR A 413 8.339 18.649 19.211 1.00 36.27 C ATOM 1744 OG1 THR A 413 8.860 17.445 18.627 1.00 37.34 O ATOM 1745 CG2 THR A 413 9.349 19.762 19.002 1.00 37.69 C ATOM 1746 HG1 THR A 413 8.196 16.718 18.725 1.00 0.00 H ATOM 1747 H THR A 413 6.442 17.089 20.130 1.00 0.00 H ATOM 1748 N ASP A 414 6.434 20.205 21.248 1.00 36.07 N ATOM 1749 CA ASP A 414 5.947 21.412 21.928 1.00 35.96 C ATOM 1750 C ASP A 414 5.964 21.269 23.450 1.00 34.22 C ATOM 1751 O ASP A 414 6.281 22.214 24.177 1.00 34.99 O ATOM 1752 CB ASP A 414 4.507 21.743 21.497 1.00 36.30 C ATOM 1753 CG ASP A 414 4.410 22.282 20.075 1.00 38.19 C ATOM 1754 OD1 ASP A 414 5.437 22.686 19.487 1.00 38.48 O ATOM 1755 OD2 ASP A 414 3.284 22.301 19.537 1.00 38.17 O ATOM 1756 H ASP A 414 5.798 19.697 20.600 1.00 0.00 H ATOM 1757 N PHE A 415 5.584 20.083 23.923 1.00 33.70 N ATOM 1758 CA PHE A 415 5.493 19.795 25.348 1.00 33.69 C ATOM 1759 C PHE A 415 6.867 19.985 25.979 1.00 33.00 C ATOM 1760 O PHE A 415 7.011 20.666 26.996 1.00 31.03 O ATOM 1761 CB PHE A 415 4.981 18.360 25.525 1.00 33.34 C ATOM 1762 CG PHE A 415 4.549 18.012 26.918 1.00 33.57 C ATOM 1763 CD1 PHE A 415 3.542 18.717 27.557 1.00 32.92 C ATOM 1764 CD2 PHE A 415 5.120 16.921 27.573 1.00 33.86 C ATOM 1765 CE1 PHE A 415 3.127 18.376 28.835 1.00 34.69 C ATOM 1766 CE2 PHE A 415 4.714 16.574 28.850 1.00 33.40 C ATOM 1767 CZ PHE A 415 3.715 17.291 29.485 1.00 33.54 C ATOM 1768 H PHE A 415 5.342 19.331 23.246 1.00 0.00 H ATOM 1769 N LEU A 416 7.878 19.405 25.336 1.00 32.77 N ATOM 1770 CA LEU A 416 9.259 19.545 25.790 1.00 34.07 C ATOM 1771 C LEU A 416 9.787 20.958 25.581 1.00 35.74 C ATOM 1772 O LEU A 416 10.446 21.492 26.467 1.00 34.01 O ATOM 1773 CB LEU A 416 10.162 18.522 25.104 1.00 33.78 C ATOM 1774 CG LEU A 416 9.776 17.060 25.388 1.00 34.79 C ATOM 1775 CD1 LEU A 416 10.661 16.098 24.618 1.00 34.31 C ATOM 1776 CD2 LEU A 416 9.817 16.753 26.877 1.00 33.85 C ATOM 1777 H LEU A 416 7.679 18.837 24.488 1.00 0.00 H ATOM 1778 N ASP A 417 9.480 21.566 24.437 1.00 39.99 N ATOM 1779 CA ASP A 417 9.915 22.948 24.160 1.00 40.56 C ATOM 1780 C ASP A 417 9.350 23.961 25.156 1.00 41.62 C ATOM 1781 O ASP A 417 10.001 24.969 25.441 1.00 41.01 O ATOM 1782 CB ASP A 417 9.554 23.360 22.725 1.00 42.32 C ATOM 1783 CG ASP A 417 10.438 22.696 21.683 1.00 42.01 C ATOM 1784 OD1 ASP A 417 11.499 22.148 22.054 1.00 43.70 O ATOM 1785 OD2 ASP A 417 10.075 22.716 20.492 1.00 45.12 O ATOM 1786 H ASP A 417 8.922 21.056 23.723 1.00 0.00 H ATOM 1787 N ASN A 418 8.155 23.685 25.687 1.00 40.61 N ATOM 1788 CA ASN A 418 7.512 24.525 26.705 1.00 41.18 C ATOM 1789 C ASN A 418 7.973 24.250 28.143 1.00 40.04 C ATOM 1790 O ASN A 418 7.460 24.859 29.089 1.00 41.23 O ATOM 1791 CB ASN A 418 5.986 24.363 26.633 1.00 41.07 C ATOM 1792 CG ASN A 418 5.393 24.914 25.355 1.00 43.24 C ATOM 1793 OD1 ASN A 418 5.942 25.828 24.733 1.00 43.81 O ATOM 1794 ND2 ASN A 418 4.258 24.359 24.950 1.00 43.34 N ATOM 1795 HD22 ASN A 418 3.828 23.591 25.504 1.00 0.00 H ATOM 1796 HD21 ASN A 418 3.798 24.692 24.079 1.00 0.00 H ATOM 1797 H ASN A 418 7.656 22.832 25.363 1.00 0.00 H ATOM 1798 N GLY A 419 8.908 23.312 28.311 1.00 38.74 N ATOM 1799 CA GLY A 419 9.541 23.055 29.595 1.00 38.82 C ATOM 1800 C GLY A 419 8.838 22.037 30.476 1.00 37.90 C ATOM 1801 O GLY A 419 9.160 21.919 31.651 1.00 37.79 O ATOM 1802 H GLY A 419 9.196 22.742 27.490 1.00 0.00 H ATOM 1803 N TYR A 420 7.891 21.290 29.905 1.00 36.88 N ATOM 1804 CA TYR A 420 7.114 20.312 30.669 1.00 37.82 C ATOM 1805 C TYR A 420 7.834 18.977 30.857 1.00 35.29 C ATOM 1806 O TYR A 420 7.320 18.100 31.546 1.00 34.57 O ATOM 1807 CB TYR A 420 5.746 20.083 30.022 1.00 38.40 C ATOM 1808 CG TYR A 420 4.896 21.325 30.001 1.00 41.21 C ATOM 1809 CD1 TYR A 420 4.550 21.942 28.803 1.00 41.29 C ATOM 1810 CD2 TYR A 420 4.463 21.905 31.185 1.00 43.12 C ATOM 1811 CE1 TYR A 420 3.776 23.096 28.787 1.00 42.63 C ATOM 1812 CE2 TYR A 420 3.695 23.064 31.180 1.00 44.62 C ATOM 1813 CZ TYR A 420 3.355 23.653 29.978 1.00 43.88 C ATOM 1814 OH TYR A 420 2.588 24.802 29.973 1.00 45.24 O ATOM 1815 HH TYR A 420 2.436 25.092 29.039 1.00 0.00 H ATOM 1816 H TYR A 420 7.700 21.406 28.889 1.00 0.00 H ATOM 1817 N GLY A 421 9.007 18.834 30.242 1.00 33.73 N ATOM 1818 CA GLY A 421 9.870 17.669 30.451 1.00 33.59 C ATOM 1819 C GLY A 421 11.112 17.979 31.272 1.00 32.44 C ATOM 1820 O GLY A 421 12.131 17.310 31.142 1.00 32.14 O ATOM 1821 H GLY A 421 9.322 19.579 29.588 1.00 0.00 H ATOM 1822 N HIS A 422 11.011 18.976 32.143 1.00 32.69 N ATOM 1823 CA HIS A 422 12.119 19.431 32.975 1.00 34.19 C ATOM 1824 C HIS A 422 12.657 18.369 33.948 1.00 33.92 C ATOM 1825 O HIS A 422 13.804 18.461 34.382 1.00 34.31 O ATOM 1826 CB HIS A 422 11.679 20.678 33.762 1.00 34.85 C ATOM 1827 CG HIS A 422 10.512 20.431 34.669 1.00 35.46 C ATOM 1828 ND1 HIS A 422 10.650 19.893 35.930 1.00 36.91 N ATOM 1829 CD2 HIS A 422 9.185 20.629 34.491 1.00 36.83 C ATOM 1830 CE1 HIS A 422 9.460 19.776 36.492 1.00 36.68 C ATOM 1831 NE2 HIS A 422 8.554 20.213 35.638 1.00 37.27 N ATOM 1832 H HIS A 422 10.094 19.458 32.237 1.00 0.00 H ATOM 1833 N CYS A 423 11.835 17.368 34.277 1.00 32.70 N ATOM 1834 CA CYS A 423 12.232 16.280 35.166 1.00 32.47 C ATOM 1835 C CYS A 423 12.876 15.107 34.412 1.00 32.47 C ATOM 1836 O CYS A 423 13.215 14.110 35.025 1.00 34.89 O ATOM 1837 CB CYS A 423 11.020 15.780 35.943 1.00 32.56 C ATOM 1838 SG CYS A 423 9.906 14.735 34.968 1.00 32.71 S ATOM 1839 H CYS A 423 10.872 17.364 33.883 1.00 0.00 H ATOM 1840 N LEU A 424 13.036 15.240 33.101 1.00 31.46 N ATOM 1841 CA LEU A 424 13.566 14.163 32.262 1.00 32.29 C ATOM 1842 C LEU A 424 15.037 14.379 31.930 1.00 33.38 C ATOM 1843 O LEU A 424 15.585 13.715 31.058 1.00 33.59 O ATOM 1844 CB LEU A 424 12.748 14.035 30.977 1.00 32.66 C ATOM 1845 CG LEU A 424 11.239 13.862 31.184 1.00 33.27 C ATOM 1846 CD1 LEU A 424 10.537 13.893 29.842 1.00 32.11 C ATOM 1847 CD2 LEU A 424 10.936 12.567 31.913 1.00 32.73 C ATOM 1848 H LEU A 424 12.775 16.142 32.653 1.00 0.00 H ATOM 1849 N LEU A 425 15.693 15.301 32.630 1.00 33.27 N ATOM 1850 CA LEU A 425 17.029 15.710 32.218 1.00 35.01 C ATOM 1851 C LEU A 425 18.161 15.001 32.943 1.00 36.74 C ATOM 1852 O LEU A 425 19.278 14.962 32.427 1.00 36.10 O ATOM 1853 CB LEU A 425 17.166 17.233 32.333 1.00 34.89 C ATOM 1854 CG LEU A 425 16.280 17.971 31.332 1.00 35.96 C ATOM 1855 CD1 LEU A 425 16.328 19.464 31.587 1.00 36.87 C ATOM 1856 CD2 LEU A 425 16.689 17.641 29.902 1.00 36.37 C ATOM 1857 H LEU A 425 15.253 15.729 33.470 1.00 0.00 H ATOM 1858 N ASP A 426 17.870 14.441 34.114 1.00 36.93 N ATOM 1859 CA ASP A 426 18.847 13.678 34.882 1.00 37.16 C ATOM 1860 C ASP A 426 18.932 12.223 34.392 1.00 38.45 C ATOM 1861 O ASP A 426 17.947 11.638 33.938 1.00 36.17 O ATOM 1862 CB ASP A 426 18.570 13.770 36.394 1.00 38.01 C ATOM 1863 CG ASP A 426 17.221 13.193 36.805 1.00 38.13 C ATOM 1864 OD1 ASP A 426 16.199 13.464 36.137 1.00 38.36 O ATOM 1865 OD2 ASP A 426 17.198 12.502 37.841 1.00 40.81 O ATOM 1866 H ASP A 426 16.909 14.552 34.496 1.00 0.00 H ATOM 1867 N LYS A 427 20.129 11.655 34.453 1.00 39.44 N ATOM 1868 CA LYS A 427 20.365 10.340 33.896 1.00 41.55 C ATOM 1869 C LYS A 427 20.209 9.317 35.005 1.00 41.72 C ATOM 1870 O LYS A 427 20.792 9.470 36.080 1.00 42.96 O ATOM 1871 CB LYS A 427 21.757 10.263 33.264 1.00 43.11 C ATOM 1872 CG LYS A 427 21.890 9.179 32.212 1.00 45.44 C ATOM 1873 CD LYS A 427 23.233 9.269 31.495 1.00 47.22 C ATOM 1874 CE LYS A 427 23.565 7.988 30.738 1.00 49.77 C ATOM 1875 NZ LYS A 427 23.143 8.028 29.310 1.00 50.82 N ATOM 1876 HZ1 LYS A 427 22.114 8.168 29.258 1.00 0.00 H ATOM 1877 HZ2 LYS A 427 23.626 8.813 28.829 1.00 0.00 H ATOM 1878 HZ3 LYS A 427 23.396 7.130 28.850 1.00 0.00 H ATOM 1879 H LYS A 427 20.913 12.164 34.910 1.00 0.00 H ATOM 1880 N PRO A 428 19.401 8.270 34.768 1.00 40.48 N ATOM 1881 CA PRO A 428 19.262 7.284 35.831 1.00 39.96 C ATOM 1882 C PRO A 428 20.566 6.556 36.174 1.00 42.68 C ATOM 1883 O PRO A 428 21.420 6.333 35.320 1.00 45.30 O ATOM 1884 CB PRO A 428 18.219 6.300 35.294 1.00 39.99 C ATOM 1885 CG PRO A 428 18.147 6.545 33.835 1.00 40.27 C ATOM 1886 CD PRO A 428 18.557 7.966 33.599 1.00 40.47 C ATOM 1887 N GLU A 429 20.628 6.160 37.434 1.00 45.23 N ATOM 1888 CA GLU A 429 21.765 5.542 38.094 1.00 44.83 C ATOM 1889 C GLU A 429 21.920 4.072 37.677 1.00 44.59 C ATOM 1890 O GLU A 429 22.962 3.620 37.182 1.00 46.24 O ATOM 1891 CB GLU A 429 21.453 5.616 39.602 1.00 45.16 C ATOM 1892 CG GLU A 429 22.555 5.251 40.572 1.00 44.42 C ATOM 1893 CD GLU A 429 22.889 6.398 41.508 1.00 44.04 C ATOM 1894 OE1 GLU A 429 22.673 6.253 42.727 1.00 42.81 O ATOM 1895 OE2 GLU A 429 23.346 7.452 41.023 1.00 43.18 O ATOM 1896 H GLU A 429 19.776 6.306 38.012 1.00 0.00 H ATOM 1897 N ALA A 430 20.841 3.337 37.918 1.00 40.58 N ATOM 1898 CA ALA A 430 20.865 1.890 37.890 1.00 39.93 C ATOM 1899 C ALA A 430 19.670 1.353 37.122 1.00 37.85 C ATOM 1900 O ALA A 430 18.787 0.725 37.709 1.00 38.02 O ATOM 1901 CB ALA A 430 20.851 1.365 39.320 1.00 38.89 C ATOM 1902 H ALA A 430 19.945 3.819 38.135 1.00 0.00 H ATOM 1903 N PRO A 431 19.637 1.602 35.804 1.00 37.71 N ATOM 1904 CA PRO A 431 18.541 1.066 35.002 1.00 36.28 C ATOM 1905 C PRO A 431 18.470 -0.451 35.103 1.00 37.98 C ATOM 1906 O PRO A 431 19.500 -1.114 35.292 1.00 37.26 O ATOM 1907 CB PRO A 431 18.889 1.490 33.570 1.00 38.04 C ATOM 1908 CG PRO A 431 20.306 1.938 33.602 1.00 39.73 C ATOM 1909 CD PRO A 431 20.608 2.364 34.994 1.00 37.49 C ATOM 1910 N LEU A 432 17.265 -0.995 34.995 1.00 37.84 N ATOM 1911 CA LEU A 432 17.092 -2.439 34.930 1.00 39.01 C ATOM 1912 C LEU A 432 17.244 -2.865 33.476 1.00 43.21 C ATOM 1913 O LEU A 432 16.566 -2.336 32.592 1.00 45.00 O ATOM 1914 CB LEU A 432 15.741 -2.864 35.519 1.00 39.40 C ATOM 1915 CG LEU A 432 15.535 -2.646 37.028 1.00 41.35 C ATOM 1916 CD1 LEU A 432 14.174 -3.183 37.439 1.00 43.59 C ATOM 1917 CD2 LEU A 432 16.623 -3.305 37.876 1.00 42.54 C ATOM 1918 H LEU A 432 16.428 -0.378 34.956 1.00 0.00 H ATOM 1919 N HIS A 433 18.178 -3.785 33.236 1.00 44.92 N ATOM 1920 CA HIS A 433 18.531 -4.238 31.882 1.00 47.88 C ATOM 1921 C HIS A 433 18.103 -5.693 31.672 1.00 46.20 C ATOM 1922 O HIS A 433 18.235 -6.504 32.582 1.00 49.89 O ATOM 1923 CB HIS A 433 20.053 -4.179 31.678 1.00 48.33 C ATOM 1924 CG HIS A 433 20.615 -2.794 31.595 1.00 48.14 C ATOM 1925 ND1 HIS A 433 20.406 -1.972 30.509 1.00 48.98 N ATOM 1926 CD2 HIS A 433 21.410 -2.101 32.444 1.00 46.74 C ATOM 1927 CE1 HIS A 433 21.030 -0.824 30.702 1.00 46.49 C ATOM 1928 NE2 HIS A 433 21.644 -0.875 31.869 1.00 46.19 N ATOM 1929 H HIS A 433 18.681 -4.202 34.045 1.00 0.00 H ATOM 1930 N LEU A 434 17.619 -6.029 30.478 1.00 48.98 N ATOM 1931 CA LEU A 434 17.500 -7.446 30.098 1.00 50.42 C ATOM 1932 C LEU A 434 18.895 -8.072 29.934 1.00 51.02 C ATOM 1933 O LEU A 434 19.802 -7.423 29.396 1.00 51.83 O ATOM 1934 CB LEU A 434 16.713 -7.635 28.791 1.00 50.37 C ATOM 1935 CG LEU A 434 15.198 -7.853 28.856 1.00 50.95 C ATOM 1936 CD1 LEU A 434 14.627 -7.863 27.447 1.00 51.93 C ATOM 1937 CD2 LEU A 434 14.842 -9.145 29.575 1.00 50.96 C ATOM 1938 H LEU A 434 17.324 -5.287 29.811 1.00 0.00 H ATOM 1939 N PRO A 435 19.076 -9.323 30.413 1.00 52.09 N ATOM 1940 CA PRO A 435 20.247 -10.121 30.013 1.00 55.09 C ATOM 1941 C PRO A 435 20.445 -10.188 28.493 1.00 53.33 C ATOM 1942 O PRO A 435 19.571 -10.686 27.776 1.00 54.88 O ATOM 1943 CB PRO A 435 19.935 -11.528 30.573 1.00 52.78 C ATOM 1944 CG PRO A 435 18.624 -11.424 31.298 1.00 54.13 C ATOM 1945 CD PRO A 435 18.362 -9.966 31.532 1.00 54.24 C TER 1946 PRO A 435 HETATM 1947 ZN ZN A 1 -5.879 6.955 23.680 1.00 28.57 ZN HETATM 1948 CA CA A 2 14.022 12.300 36.318 1.00 29.25 CA HETATM 1949 CA CA A 3 16.305 10.948 39.058 1.00 32.11 CA HETATM 1950 CA CA A 4 -10.617 -4.231 28.019 1.00 30.01 CA HETATM 1951 O HOH 5 -4.179 16.766 31.443 1.00 36.92 O HETATM 1952 O HOH 6 1.635 18.147 41.288 1.00 39.69 O HETATM 1953 O HOH 7 4.514 -3.084 12.772 1.00 42.58 O HETATM 1954 O HOH 8 12.734 19.480 37.386 1.00 53.71 O HETATM 1955 O HOH 9 3.073 -4.780 14.654 1.00 48.43 O HETATM 1956 O HOH 10 1.312 20.956 20.598 1.00 36.82 O HETATM 1957 O HOH 11 15.159 -0.838 41.158 1.00 43.79 O HETATM 1958 O HOH 12 12.490 -11.652 26.259 1.00 52.56 O HETATM 1959 O HOH 13 -0.152 17.831 35.105 1.00 39.08 O HETATM 1960 O HOH 14 5.789 0.251 6.622 1.00 51.06 O HETATM 1961 O HOH 15 2.459 21.149 38.475 1.00 45.57 O HETATM 1962 O HOH 16 24.690 6.005 28.580 1.00 42.12 O HETATM 1963 O HOH 17 -10.477 5.006 42.214 1.00 48.57 O HETATM 1964 O HOH 18 -5.856 11.712 46.176 1.00 45.07 O HETATM 1965 O HOH 19 -16.297 20.696 12.482 1.00 50.39 O HETATM 1966 O HOH 20 14.756 -1.178 23.842 1.00 34.32 O HETATM 1967 O HOH 21 19.857 10.040 41.852 1.00 51.14 O HETATM 1968 O HOH 22 15.763 2.591 27.317 1.00 38.04 O HETATM 1969 O HOH 23 13.598 20.439 43.163 1.00 42.88 O HETATM 1970 O HOH 24 23.515 0.321 33.423 1.00 42.50 O HETATM 1971 O HOH 25 2.784 18.440 9.879 1.00 47.26 O HETATM 1972 O HOH 26 7.328 1.945 4.948 1.00 35.59 O HETATM 1973 O HOH 27 9.630 3.740 47.946 1.00 45.66 O HETATM 1974 O HOH 28 15.147 20.682 35.268 1.00 54.61 O HETATM 1975 O HOH 29 8.973 -14.292 30.412 1.00 36.43 O HETATM 1976 O HOH 30 15.126 2.300 43.674 1.00 46.60 O HETATM 1977 O HOH 31 2.373 18.617 33.010 1.00 41.33 O HETATM 1978 O HOH 32 12.494 0.993 9.713 1.00 46.30 O HETATM 1979 O HOH 33 -3.880 21.490 13.939 1.00 47.82 O HETATM 1980 O HOH 34 13.871 18.945 49.032 1.00 53.60 O HETATM 1981 O HOH 35 13.959 -3.186 13.855 1.00 53.11 O HETATM 1982 O HOH 36 -12.071 -4.887 41.937 1.00 52.07 O HETATM 1983 O HOH 37 5.039 -15.283 30.260 1.00 48.01 O HETATM 1984 O HOH 38 2.609 24.934 18.847 1.00 42.99 O HETATM 1985 O HOH 39 -8.689 13.136 34.623 1.00 45.79 O HETATM 1986 O HOH 40 -23.077 1.448 29.549 1.00 41.45 O HETATM 1987 O HOH 41 2.992 -8.305 24.965 1.00 29.46 O HETATM 1988 O HOH 42 1.900 -1.328 8.634 1.00 56.52 O HETATM 1989 O HOH 43 20.151 15.385 29.458 1.00 41.01 O HETATM 1990 O HOH 44 -2.797 17.479 24.617 1.00 41.97 O HETATM 1991 O HOH 45 -1.110 12.870 4.699 1.00 49.11 O HETATM 1992 O HOH 46 14.970 7.292 48.970 1.00 59.23 O HETATM 1993 O HOH 47 12.368 -5.320 41.776 1.00 45.75 O HETATM 1994 O HOH 48 12.098 4.918 49.021 1.00 48.19 O HETATM 1995 O HOH 49 22.294 -0.664 35.871 1.00 38.05 O HETATM 1996 O HOH 50 11.432 5.708 8.971 1.00 50.28 O HETATM 1997 O HOH 51 15.336 0.026 31.205 1.00 34.09 O HETATM 1998 O HOH 52 -3.689 11.548 39.939 1.00 43.24 O HETATM 1999 O HOH 53 -13.524 3.817 32.690 1.00 36.41 O HETATM 2000 O HOH 54 15.547 16.241 35.501 1.00 36.80 O HETATM 2001 O HOH 55 -15.852 3.139 33.894 1.00 37.68 O HETATM 2002 O HOH 56 8.631 -6.490 43.436 1.00 44.83 O HETATM 2003 O HOH 57 -22.296 -1.899 28.664 1.00 58.54 O HETATM 2004 O HOH 58 -17.104 -5.023 25.349 1.00 44.67 O HETATM 2005 O HOH 59 3.091 16.384 42.517 1.00 49.58 O HETATM 2006 O HOH 60 -6.515 9.975 27.535 1.00 51.41 O HETATM 2007 O HOH 61 13.111 17.411 41.584 1.00 40.89 O HETATM 2008 O HOH 62 4.790 20.344 13.173 1.00 48.44 O HETATM 2009 O HOH 63 6.146 -17.106 31.898 1.00 44.27 O HETATM 2010 O HOH 64 15.633 1.303 22.723 1.00 40.79 O HETATM 2011 O HOH 65 16.226 13.494 47.392 1.00 46.71 O HETATM 2012 O HOH 66 4.720 28.676 24.788 1.00 56.27 O HETATM 2013 O HOH 67 -4.305 -6.274 22.004 1.00 57.22 O HETATM 2014 O HOH 68 6.828 -20.044 37.128 1.00 50.91 O HETATM 2015 O HOH 69 -1.681 21.234 25.849 1.00 39.00 O HETATM 2016 O HOH 70 12.771 17.059 38.600 1.00 52.75 O HETATM 2017 O HOH 71 16.155 -4.364 27.929 1.00 50.40 O HETATM 2018 O HOH 72 9.886 -12.538 28.427 1.00 55.82 O HETATM 2019 O HOH 73 5.311 -9.303 46.874 1.00 53.59 O HETATM 2020 O HOH 74 20.570 11.621 46.899 1.00 57.28 O HETATM 2021 O HOH 75 -6.831 12.614 43.636 1.00 41.67 O HETATM 2022 O HOH 76 -6.441 24.546 12.083 1.00 52.40 O HETATM 2023 O HOH 77 -6.823 11.887 23.350 1.00 45.03 O HETATM 2024 O HOH 78 6.205 -1.975 14.561 1.00 52.08 O HETATM 2025 O HOH 79 21.484 7.224 25.913 1.00 52.07 O HETATM 2026 O HOH 80 -4.434 -17.367 28.883 1.00 53.77 O HETATM 2027 O HOH 81 10.204 16.150 39.198 1.00 46.71 O HETATM 2028 O HOH 82 17.881 -1.756 40.686 1.00 59.42 O HETATM 2029 O HOH 83 -12.868 7.809 29.256 1.00 58.35 O HETATM 2030 O HOH 84 -13.871 5.612 30.876 1.00 52.04 O HETATM 2031 O HOH 85 11.464 -2.480 12.966 1.00 47.25 O HETATM 2032 O HOH 86 -8.336 15.601 5.372 1.00 49.20 O HETATM 2033 O HOH 87 -24.701 -0.414 26.877 1.00 38.57 O HETATM 2034 O HOH 88 6.672 26.376 13.635 1.00 51.55 O HETATM 2035 O HOH 89 -4.301 19.480 24.059 1.00 47.76 O HETATM 2036 O HOH 90 -9.181 -12.793 35.761 1.00 57.47 O HETATM 2037 O HOH 91 1.160 -11.671 14.919 1.00 55.34 O HETATM 2038 O HOH 92 27.387 8.502 32.018 1.00 59.24 O HETATM 2039 O HOH 93 15.132 1.813 9.489 1.00 42.16 O HETATM 2040 O HOH 94 0.928 8.587 16.366 1.00 28.36 O HETATM 2041 O HOH 95 10.939 20.168 28.875 1.00 37.21 O HETATM 2042 O HOH 96 -7.836 10.068 31.296 1.00 58.74 O HETATM 2043 O HOH 97 13.192 4.892 24.669 1.00 27.61 O HETATM 2044 O HOH 98 -6.193 7.288 28.141 1.00 34.18 O HETATM 2045 O HOH 99 9.735 13.475 38.166 1.00 28.67 O HETATM 2046 O HOH 100 18.248 4.322 38.411 1.00 39.43 O HETATM 2047 O HOH 101 -2.869 6.721 13.416 1.00 36.64 O HETATM 2048 O HOH 102 -2.746 -4.300 25.584 1.00 28.46 O HETATM 2049 O HOH 103 6.611 10.839 39.135 1.00 26.15 O HETATM 2050 O HOH 104 15.163 11.544 34.295 1.00 30.38 O HETATM 2051 O HOH 105 13.430 5.313 40.270 1.00 32.59 O HETATM 2052 O HOH 106 -0.686 14.437 19.315 1.00 32.78 O HETATM 2053 O HOH 107 4.631 9.901 42.154 1.00 30.83 O HETATM 2054 O HOH 108 11.646 -6.319 23.599 1.00 37.11 O HETATM 2055 O HOH 109 15.673 9.279 40.519 1.00 37.25 O HETATM 2056 O HOH 110 -9.886 -4.898 23.214 1.00 46.25 O HETATM 2057 O HOH 111 -10.099 -5.880 26.387 1.00 33.29 O HETATM 2058 O HOH 112 4.250 -6.236 23.078 1.00 41.01 O HETATM 2059 O HOH 113 6.987 13.169 37.413 1.00 27.51 O HETATM 2060 O HOH 114 6.887 -7.106 23.864 1.00 44.16 O HETATM 2061 O HOH 115 -10.991 -9.502 33.908 1.00 37.82 O HETATM 2062 O HOH 116 4.883 17.727 32.984 1.00 36.11 O HETATM 2063 O HOH 117 9.471 -12.662 37.784 1.00 40.59 O HETATM 2064 O HOH 118 4.566 8.975 38.674 1.00 24.91 O HETATM 2065 O HOH 119 9.890 19.399 45.255 1.00 64.36 O HETATM 2066 O HOH 120 -1.125 12.053 17.880 1.00 28.84 O HETATM 2067 O HOH 121 2.049 19.879 23.352 1.00 35.27 O HETATM 2068 O HOH 122 2.959 6.105 32.925 1.00 31.61 O HETATM 2069 O HOH 123 18.588 10.357 39.363 1.00 34.71 O HETATM 2070 O HOH 124 11.574 -13.446 34.882 1.00 37.68 O HETATM 2071 O HOH 125 12.177 -15.617 32.855 1.00 62.29 O HETATM 2072 O HOH 126 15.389 3.718 41.311 1.00 50.23 O HETATM 2073 O HOH 127 4.816 11.601 44.412 1.00 35.83 O HETATM 2074 O HOH 128 1.552 3.633 48.676 1.00 48.47 O HETATM 2075 O HOH 129 -10.136 8.706 33.906 1.00 58.06 O HETATM 2076 O HOH 130 12.240 -4.517 21.509 1.00 39.35 O HETATM 2077 O HOH 131 7.444 13.109 44.104 1.00 37.18 O HETATM 2078 O HOH 132 -4.553 11.244 10.870 1.00 51.17 O HETATM 2079 O HOH 133 -7.682 12.947 21.092 1.00 39.72 O HETATM 2080 O HOH 134 -2.424 -6.785 43.028 1.00 44.48 O HETATM 2081 O HOH 135 17.266 1.901 39.673 1.00 41.59 O HETATM 2082 O HOH 136 16.973 6.601 39.234 1.00 39.40 O HETATM 2083 O HOH 137 2.799 21.858 25.345 1.00 41.10 O HETATM 2084 O HOH 138 13.979 -7.453 24.451 1.00 51.24 O HETATM 2085 O HOH 139 -5.065 3.807 46.027 1.00 40.13 O HETATM 2086 O HOH 140 5.746 11.226 11.375 1.00 40.06 O HETATM 2087 O HOH 141 -11.056 16.634 18.144 1.00 51.13 O HETATM 2088 O HOH 142 12.206 3.600 10.213 1.00 43.41 O HETATM 2089 O HOH 143 -7.605 -4.182 20.454 1.00 44.57 O HETATM 2090 O HOH 144 13.799 -1.096 28.987 1.00 40.32 O HETATM 2091 O HOH 145 -4.037 -14.324 36.463 1.00 43.03 O HETATM 2092 O HOH 146 -6.142 7.117 13.283 1.00 45.80 O HETATM 2093 O HOH 147 -6.463 -8.610 26.976 1.00 46.86 O HETATM 2094 O HOH 148 -8.263 -4.517 43.535 1.00 56.53 O HETATM 2095 O HOH 149 -3.611 -16.812 35.925 1.00 49.41 O HETATM 2096 O HOH 150 13.329 2.671 17.079 1.00 48.23 O HETATM 2097 O HOH 151 -5.855 -7.036 40.547 1.00 55.29 O HETATM 2098 O HOH 152 -3.755 -4.364 43.902 1.00 56.07 O HETATM 2099 O HOH 153 16.739 11.721 24.092 1.00 46.12 O HETATM 2100 O HOH 154 5.010 11.136 47.337 1.00 43.87 O HETATM 2101 O HOH 155 -4.826 -13.959 33.196 1.00 44.89 O HETATM 2102 O HOH 156 10.693 -4.948 19.518 1.00 49.96 O HETATM 2103 O HOH 157 -0.641 10.224 9.103 1.00 54.22 O HETATM 2104 O HOH 158 -9.923 11.818 19.057 1.00 49.24 O HETATM 2105 O HOH 159 7.490 12.206 48.311 1.00 54.20 O HETATM 2106 O HOH 160 7.706 24.031 20.007 1.00 53.97 O HETATM 2107 O HOH 161 13.988 -3.724 29.518 1.00 42.76 O HETATM 2108 O HOH 162 -8.748 15.504 21.131 1.00 47.69 O HETATM 2109 O HOH 163 12.803 20.150 22.865 1.00 54.69 O HETATM 2110 O HOH 164 -5.688 -10.316 29.439 1.00 56.08 O HETATM 2111 O HOH 165 10.220 -8.034 21.868 1.00 50.90 O HETATM 2112 O HOH 166 6.672 15.345 9.240 1.00 58.74 O HETATM 2113 O HOH 167 -8.629 -1.752 14.326 1.00 43.97 O HETATM 2114 O HOH 168 12.899 15.114 50.170 1.00 48.57 O HETATM 2115 O HOH 169 6.720 15.292 47.478 1.00 53.15 O HETATM 2116 O HOH 170 11.644 17.641 50.177 1.00 51.22 O HETATM 2117 O HOH 171 -13.905 -1.050 38.745 1.00 45.30 O HETATM 2118 O HOH 172 -8.666 3.669 45.607 1.00 44.80 O HETATM 2119 O HOH 173 17.687 9.962 25.518 1.00 51.26 O HETATM 2120 O HOH 174 9.063 -1.699 19.403 1.00 40.69 O HETATM 2121 O HOH 175 7.810 -7.246 21.101 1.00 54.97 O HETATM 2122 O HOH 176 11.771 0.675 29.124 1.00 33.49 O HETATM 2123 O HOH 177 -17.179 -4.531 21.404 1.00 55.20 O HETATM 2124 O HOH 178 5.008 -6.160 16.481 1.00 57.35 O HETATM 2125 O HOH 179 -10.346 -10.171 36.331 1.00 54.05 O HETATM 2126 O HOH 180 5.761 -5.636 20.521 1.00 49.50 O HETATM 2127 O HOH 181 -12.408 8.327 18.293 1.00 47.57 O HETATM 2128 O HOH 182 -12.589 5.778 17.758 1.00 53.01 O HETATM 2129 O HOH 183 -12.459 3.605 16.355 1.00 65.59 O HETATM 2130 O HOH 184 -12.624 -7.498 26.497 1.00 49.73 O HETATM 2131 O HOH 185 2.428 12.768 47.627 1.00 47.75 O HETATM 2132 O HOH 186 7.173 13.097 12.375 1.00 55.13 O HETATM 2133 O HOH 187 16.220 4.822 16.951 1.00 47.01 O HETATM 2134 O HOH 188 10.097 -16.666 30.656 1.00 45.48 O HETATM 2135 O HOH 189 -5.583 11.970 8.400 1.00 50.84 O HETATM 2136 O HOH 190 -10.770 0.390 41.015 1.00 49.04 O HETATM 2137 O HOH 191 -13.284 -10.109 30.515 1.00 45.89 O HETATM 2138 O HOH 192 -10.803 -11.242 31.487 1.00 55.58 O HETATM 2139 O HOH 193 5.636 19.730 35.822 1.00 40.96 O HETATM 2140 O HOH 194 -3.067 10.131 35.521 1.00 49.26 O HETATM 2141 O HOH 195 -1.156 10.396 33.233 1.00 34.60 O HETATM 2142 O HOH 196 -11.402 10.167 28.560 1.00 59.31 O HETATM 2143 O HOH 197 2.910 -7.753 47.416 1.00 59.31 O HETATM 2144 O HOH 198 -3.976 -18.905 34.201 1.00 52.03 O HETATM 2145 O HOH 199 14.756 17.072 24.411 1.00 49.76 O HETATM 2146 O HOH 200 9.109 16.477 51.321 1.00 58.16 O HETATM 2147 O HOH 201 -10.811 5.199 21.179 1.00 54.81 O HETATM 2148 O HOH 202 5.220 17.514 13.394 1.00 45.69 O HETATM 2149 O HOH 203 8.120 21.225 15.850 1.00 58.05 O HETATM 2150 O HOH 204 -0.593 -13.612 42.556 1.00 49.89 O HETATM 2151 O HOH 205 -7.829 -0.568 20.789 1.00 49.15 O HETATM 2152 O HOH 206 -9.388 0.077 22.595 1.00 45.57 O HETATM 2153 O HOH 207 -11.569 0.979 21.844 1.00 53.41 O HETATM 2154 O HOH 208 -12.981 9.120 13.369 1.00 57.79 O HETATM 2155 O HOH 209 -12.858 2.264 23.883 1.00 52.20 O HETATM 2156 O HOH 210 8.900 -0.084 17.345 1.00 56.27 O HETATM 2157 O HOH 211 -2.896 11.286 42.431 1.00 51.00 O HETATM 2158 O HOH 212 5.787 25.384 18.252 1.00 53.52 O HETATM 2159 O HOH 213 17.155 13.105 22.007 1.00 51.50 O HETATM 2160 O HOH 214 15.636 16.148 15.749 1.00 52.95 O HETATM 2161 O HOH 215 2.279 -16.644 41.211 1.00 55.98 O HETATM 2162 O HOH 216 7.975 -13.169 40.229 1.00 55.39 O HETATM 2163 O HOH 217 10.357 1.686 16.290 1.00 52.38 O HETATM 2164 O HOH 218 6.781 0.493 15.277 1.00 58.15 O HETATM 2165 O HOH 219 -16.972 2.579 26.533 1.00 56.52 O HETATM 2166 O HOH 220 5.170 -9.553 21.220 1.00 52.83 O HETATM 2167 O HOH 221 -3.452 8.639 11.252 1.00 51.51 O HETATM 2168 O HOH 222 -7.540 9.134 11.665 1.00 55.46 O HETATM 2169 C4 UNN A 223 -12.331 4.747 26.631 1.00 0.05 C HETATM 2170 C5 UNN A 223 -11.740 5.831 27.236 1.00 0.09 C HETATM 2171 N22 UNN A 223 -10.463 5.844 26.756 1.00 -0.23 N HETATM 2172 C13 UNN A 223 -10.308 4.791 25.891 1.00 0.14 C HETATM 2173 C17 UNN A 223 -9.061 4.461 25.147 1.00 0.17 C HETATM 2174 C8 UNN A 223 -9.196 3.256 24.228 1.00 0.04 C HETATM 2175 N21 UNN A 223 -7.993 3.010 23.464 1.00 -0.29 N HETATM 2176 C16 UNN A 223 -7.101 2.040 23.883 1.00 0.24 C HETATM 2177 C12 UNN A 223 -6.011 1.846 22.976 1.00 0.19 C HETATM 2178 C7 UNN A 223 -4.879 1.057 23.001 1.00 -0.02 C HETATM 2179 C11 UNN A 223 -4.155 1.311 21.799 1.00 -0.00 C HETATM 2180 C6 UNN A 223 -2.974 0.870 21.202 1.00 -0.05 C HETATM 2181 C9 UNN A 223 -2.669 1.428 19.971 1.00 0.03 C HETATM 2182 C2 UNN A 223 -3.474 2.359 19.359 1.00 -0.06 C HETATM 2183 C3 UNN A 223 -4.639 2.812 19.919 1.00 -0.03 C HETATM 2184 C10 UNN A 223 -4.920 2.252 21.135 1.00 0.13 C HETATM 2185 O26 UNN A 223 -6.031 2.577 21.833 1.00 -0.24 O HETATM 2186 H UNN A 223 -5.279 3.546 19.443 1.00 0.06 H HETATM 2187 H UNN A 223 -3.175 2.751 18.394 1.00 0.06 H HETATM 2188 CL2 UNN A 223 -1.252 1.010 19.077 1.00 -0.08 CL HETATM 2189 H UNN A 223 -2.333 0.134 21.673 1.00 0.06 H HETATM 2190 H UNN A 223 -4.591 0.367 23.793 1.00 0.05 H HETATM 2191 O25 UNN A 223 -7.203 1.423 24.935 1.00 -0.38 O HETATM 2192 H UNN A 223 -7.807 3.539 22.636 1.00 0.18 H HETATM 2193 H UNN A 223 -10.027 3.435 23.530 1.00 0.04 H HETATM 2194 H UNN A 223 -9.415 2.368 24.839 1.00 0.04 H HETATM 2195 C14 UNN A 223 -8.670 5.615 24.275 1.00 0.21 C HETATM 2196 N19 UNN A 223 -7.367 5.914 24.563 1.00 -0.19 N HETATM 2197 C15 UNN A 223 -6.874 5.176 25.593 1.00 0.28 C HETATM 2198 N20 UNN A 223 -7.900 4.372 26.015 1.00 -0.29 N HETATM 2199 H UNN A 223 -7.855 3.791 26.827 1.00 0.17 H HETATM 2200 O24 UNN A 223 -5.733 5.249 26.030 1.00 -0.39 O HETATM 2201 H UNN A 223 -6.834 6.601 24.069 1.00 0.22 H HETATM 2202 O23 UNN A 223 -9.398 6.150 23.455 1.00 -0.36 O HETATM 2203 N18 UNN A 223 -11.438 4.116 25.801 1.00 -0.27 N HETATM 2204 C1 UNN A 223 -9.505 6.862 27.155 1.00 0.06 C HETATM 2205 H UNN A 223 -9.979 7.552 27.869 1.00 0.06 H HETATM 2206 H UNN A 223 -9.174 7.422 26.268 1.00 0.06 H HETATM 2207 H UNN A 223 -8.637 6.382 27.630 1.00 0.06 H HETATM 2208 H UNN A 223 -12.192 6.526 27.942 1.00 0.13 H HETATM 2209 H UNN A 223 -13.362 4.433 26.788 1.00 0.08 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 72 71 1948 1949 CONECT 73 71 1949 CONECT 544 545 548 549 550 CONECT 548 544 CONECT 549 544 CONECT 550 544 CONECT 682 681 1150 CONECT 789 788 1949 CONECT 792 791 1949 CONECT 793 791 1948 CONECT 857 856 1948 CONECT 858 856 1948 CONECT 949 948 1950 CONECT 955 954 1950 CONECT 966 965 1003 CONECT 1001 1000 1950 CONECT 1003 966 1002 CONECT 1017 1016 1950 CONECT 1096 1095 1838 CONECT 1150 682 1149 CONECT 1285 1283 1284 1947 CONECT 1320 1318 1319 1947 CONECT 1380 1378 1379 1947 CONECT 1435 1434 1685 CONECT 1496 1497 1503 1504 1505 CONECT 1503 1496 CONECT 1504 1496 CONECT 1505 1496 CONECT 1685 1435 1684 CONECT 1838 1096 1837 CONECT 1947 1285 1320 1380 CONECT 1948 72 793 857 858 CONECT 1949 72 73 789 792 CONECT 1950 949 955 1001 1017 CONECT 2169 2170 2203 2209 CONECT 2170 2169 2171 2208 CONECT 2171 2170 2172 2204 CONECT 2172 2171 2173 2203 CONECT 2173 2172 2174 2195 2198 CONECT 2174 2173 2175 2193 2194 CONECT 2175 2174 2176 2192 CONECT 2176 2175 2177 2191 CONECT 2177 2176 2178 2185 CONECT 2178 2177 2179 2190 CONECT 2179 2178 2180 2184 CONECT 2180 2179 2181 2189 CONECT 2181 2180 2182 2188 CONECT 2182 2181 2183 2187 CONECT 2183 2182 2184 2186 CONECT 2184 2179 2183 2185 CONECT 2185 2177 2184 CONECT 2186 2183 CONECT 2187 2182 CONECT 2188 2181 CONECT 2189 2180 CONECT 2190 2178 CONECT 2191 2176 CONECT 2192 2175 CONECT 2193 2174 CONECT 2194 2174 CONECT 2195 2173 2196 2202 CONECT 2196 2195 2197 2201 CONECT 2197 2196 2198 2200 CONECT 2198 2173 2197 2199 CONECT 2199 2198 CONECT 2200 2197 CONECT 2201 2196 CONECT 2202 2195 CONECT 2203 2169 2172 CONECT 2204 2171 2205 2206 2207 CONECT 2205 2204 CONECT 2206 2204 CONECT 2207 2204 CONECT 2208 2170 CONECT 2209 2169 MASTER 0 0 0 0 0 0 0 0 2206 3 79 18 END
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Related entries of code: 4wki
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2rjp
RCSB PDB
PDBbind
316aa, >2RJP_1|Chains... *
4wk7
RCSB PDB
PDBbind
235aa, >4WK7_1|Chain... at 96%
4wke
RCSB PDB
PDBbind
235aa, >4WKE_1|Chain... at 96%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4wki
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
A disintegrin and metalloproteinase with thrombospondin motifs 4 ADAMTS-4
Ligand Name
3PW
EC.Number
E.C.3.4.24.82
Resolution
1.6(Å)
Affinity (Kd/Ki/IC50)
IC50=5nM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Med.Chem. Vol. 57: pp. 10476-10485
Ligand Properties
Formula
C
1
7
H
1
4
ClN
5
O
4
Molecular Weight
387.777
Exact Mass
387.073
No. of atoms
41
No. of bonds
44
Polar Surface Area
118.26
LOGP Value
1.49 (
Computed with XLOGP3
)
2.33 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 4
Canonical SMILES
O=C1NC(=O)[C@](N1)(CNC(=O)c1cc2c(o1)ccc(c2)Cl)c1nccn1C
InChI String
InChI=1S/C17H14ClN5O4/c1-23-5-4-19-14(23)17(15(25)21-16(26)22-17)8-20-13(24)12-7-9-6-10(18)2-3-11(9)27-12/h2-7H,8H2,1H3,(H,20,24)(H2,21,22,25,26)/t17-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O75173
Entrez Gene ID
NCBI Entrez Gene ID:
9507
ASD
Information of known allosteric effects of PDB entries
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