Browse entries in the PDBbind-CN Database
HEADER 4NCM_COMPLEX COMPND 4NCM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 163 SER SER PHE SER PHE GLY GLY PHE THR PHE LYS ARG THR SEQRES 2 A 163 SER GLY SER SER ILE LYS ARG GLU GLU GLU VAL LEU THR SEQRES 3 A 163 GLY ASN LEU GLN THR LEU LYS ILE ARG VAL HIS GLU GLY SEQRES 4 A 163 TYR GLU GLU PHE THR MET VAL GLY LYS ARG ALA THR ALA SEQRES 5 A 163 ILE LEU ARG LYS ALA THR ARG ARG LEU VAL GLN LEU ILE SEQRES 6 A 163 VAL SER GLY LYS ASP GLU GLN SER ILE ALA GLU ALA ILE SEQRES 7 A 163 ILE VAL ALA MET VAL PHE SER GLN GLU ASP CYS MET ILE SEQRES 8 A 163 LYS ALA VAL ARG GLY ASP LEU ASN PHE VAL ASN ARG ALA SEQRES 9 A 163 ASN GLN ARG LEU ASN PRO MET HIS GLN LEU LEU ARG HIS SEQRES 10 A 163 PHE GLN LYS ASP ALA LYS VAL LEU PHE GLN ASN TRP GLY SEQRES 11 A 163 ILE GLU HIS ILE ASP ASN VAL MET GLY MET VAL GLY VAL SEQRES 12 A 163 LEU PRO ASP MET THR PRO SER THR GLU MET SER MET ARG SEQRES 13 A 163 GLY ILE ARG VAL SER LYS MET HET UNN A 189 41 ATOM 1 N SER A 321 -54.713 0.330 0.991 1.00 71.01 N ATOM 2 CA SER A 321 -55.857 0.853 1.751 1.00 71.06 C ATOM 3 C SER A 321 -55.339 1.868 2.800 1.00 71.63 C ATOM 4 O SER A 321 -54.667 2.840 2.427 1.00 70.85 O ATOM 5 CB SER A 321 -56.647 -0.307 2.381 1.00 76.45 C ATOM 6 OG SER A 321 -55.818 -1.326 2.932 1.00 84.80 O ATOM 7 HG SER A 321 -56.386 -2.038 3.319 1.00 0.00 H ATOM 8 HN3 SER A 321 -54.053 -0.141 1.642 1.00 0.00 H ATOM 9 HN2 SER A 321 -54.228 1.116 0.512 1.00 0.00 H ATOM 10 HN1 SER A 321 -55.051 -0.353 0.284 1.00 0.00 H ATOM 11 N SER A 322 -55.672 1.647 4.092 1.00 64.75 N ATOM 12 CA SER A 322 -55.152 2.386 5.232 1.00 62.54 C ATOM 13 C SER A 322 -54.746 1.344 6.280 1.00 59.53 C ATOM 14 O SER A 322 -55.606 0.622 6.811 1.00 60.48 O ATOM 15 CB SER A 322 -56.149 3.395 5.790 1.00 66.05 C ATOM 16 OG SER A 322 -55.586 4.028 6.934 1.00 70.29 O ATOM 17 HG SER A 322 -56.232 4.684 7.298 1.00 0.00 H ATOM 18 H SER A 322 -56.355 0.887 4.286 1.00 0.00 H ATOM 19 N PHE A 323 -53.429 1.254 6.555 1.00 46.75 N ATOM 20 CA PHE A 323 -52.885 0.237 7.455 1.00 41.86 C ATOM 21 C PHE A 323 -51.624 0.695 8.151 1.00 42.52 C ATOM 22 O PHE A 323 -51.088 1.768 7.851 1.00 42.07 O ATOM 23 CB PHE A 323 -52.627 -1.079 6.679 1.00 41.30 C ATOM 24 CG PHE A 323 -51.624 -0.930 5.559 1.00 39.87 C ATOM 25 CD1 PHE A 323 -50.255 -1.103 5.798 1.00 40.43 C ATOM 26 CD2 PHE A 323 -52.036 -0.562 4.282 1.00 39.20 C ATOM 27 CE1 PHE A 323 -49.322 -0.932 4.778 1.00 39.92 C ATOM 28 CE2 PHE A 323 -51.104 -0.386 3.261 1.00 41.43 C ATOM 29 CZ PHE A 323 -49.750 -0.574 3.518 1.00 39.57 C ATOM 30 H PHE A 323 -52.777 1.932 6.111 1.00 0.00 H ATOM 31 N SER A 324 -51.147 -0.110 9.086 1.00 37.61 N ATOM 32 CA SER A 324 -49.944 0.271 9.807 1.00 37.46 C ATOM 33 C SER A 324 -48.780 -0.772 9.758 1.00 40.33 C ATOM 34 O SER A 324 -49.006 -1.987 9.706 1.00 39.14 O ATOM 35 CB SER A 324 -50.257 0.809 11.196 1.00 37.96 C ATOM 36 OG SER A 324 -50.385 -0.270 12.097 1.00 49.98 O ATOM 37 HG SER A 324 -50.589 0.079 13.001 1.00 0.00 H ATOM 38 H SER A 324 -51.628 -1.006 9.303 1.00 0.00 H ATOM 39 N PHE A 325 -47.545 -0.266 9.744 1.00 34.18 N ATOM 40 CA PHE A 325 -46.366 -1.109 9.658 1.00 33.49 C ATOM 41 C PHE A 325 -45.174 -0.362 10.169 1.00 36.61 C ATOM 42 O PHE A 325 -44.903 0.749 9.719 1.00 37.04 O ATOM 43 CB PHE A 325 -46.134 -1.575 8.199 1.00 35.26 C ATOM 44 CG PHE A 325 -44.963 -2.497 7.978 1.00 36.61 C ATOM 45 CD1 PHE A 325 -44.903 -3.743 8.615 1.00 40.49 C ATOM 46 CD2 PHE A 325 -43.929 -2.135 7.122 1.00 38.22 C ATOM 47 CE1 PHE A 325 -43.827 -4.617 8.389 1.00 41.57 C ATOM 48 CE2 PHE A 325 -42.869 -3.003 6.876 1.00 42.03 C ATOM 49 CZ PHE A 325 -42.826 -4.250 7.506 1.00 41.35 C ATOM 50 H PHE A 325 -47.423 0.766 9.796 1.00 0.00 H ATOM 51 N GLY A 326 -44.455 -0.982 11.100 1.00 32.79 N ATOM 52 CA GLY A 326 -43.254 -0.406 11.697 1.00 31.92 C ATOM 53 C GLY A 326 -43.492 0.939 12.343 1.00 37.09 C ATOM 54 O GLY A 326 -42.598 1.786 12.347 1.00 37.38 O ATOM 55 H GLY A 326 -44.763 -1.923 11.418 1.00 0.00 H ATOM 56 N GLY A 327 -44.698 1.132 12.875 1.00 34.23 N ATOM 57 CA GLY A 327 -45.050 2.357 13.577 1.00 34.20 C ATOM 58 C GLY A 327 -45.549 3.474 12.686 1.00 37.66 C ATOM 59 O GLY A 327 -45.822 4.577 13.178 1.00 38.51 O ATOM 60 H GLY A 327 -45.412 0.381 12.786 1.00 0.00 H ATOM 61 N PHE A 328 -45.689 3.195 11.380 1.00 30.80 N ATOM 62 CA PHE A 328 -46.179 4.158 10.395 1.00 28.56 C ATOM 63 C PHE A 328 -47.559 3.802 9.869 1.00 34.14 C ATOM 64 O PHE A 328 -47.871 2.620 9.586 1.00 30.82 O ATOM 65 CB PHE A 328 -45.217 4.286 9.188 1.00 29.21 C ATOM 66 CG PHE A 328 -43.907 4.899 9.578 1.00 30.56 C ATOM 67 CD1 PHE A 328 -43.735 6.272 9.556 1.00 33.67 C ATOM 68 CD2 PHE A 328 -42.852 4.108 10.008 1.00 32.03 C ATOM 69 CE1 PHE A 328 -42.544 6.844 9.969 1.00 34.34 C ATOM 70 CE2 PHE A 328 -41.655 4.678 10.408 1.00 33.98 C ATOM 71 CZ PHE A 328 -41.516 6.038 10.407 1.00 32.85 C ATOM 72 H PHE A 328 -45.435 2.242 11.051 1.00 0.00 H ATOM 73 N THR A 329 -48.374 4.862 9.663 1.00 33.93 N ATOM 74 CA THR A 329 -49.669 4.697 9.027 1.00 34.95 C ATOM 75 C THR A 329 -49.480 4.887 7.536 1.00 42.47 C ATOM 76 O THR A 329 -48.970 5.922 7.085 1.00 44.03 O ATOM 77 CB THR A 329 -50.718 5.619 9.602 1.00 42.29 C ATOM 78 OG1 THR A 329 -50.797 5.448 11.032 1.00 44.41 O ATOM 79 CG2 THR A 329 -52.065 5.365 8.961 1.00 31.74 C ATOM 80 HG1 THR A 329 -51.487 6.056 11.398 1.00 0.00 H ATOM 81 H THR A 329 -48.068 5.809 9.965 1.00 0.00 H ATOM 82 N PHE A 330 -49.836 3.865 6.775 1.00 37.95 N ATOM 83 CA PHE A 330 -49.708 3.888 5.330 1.00 35.39 C ATOM 84 C PHE A 330 -51.078 4.171 4.746 1.00 44.54 C ATOM 85 O PHE A 330 -52.077 3.572 5.179 1.00 45.07 O ATOM 86 CB PHE A 330 -49.242 2.526 4.840 1.00 33.77 C ATOM 87 CG PHE A 330 -47.769 2.279 4.944 1.00 31.38 C ATOM 88 CD1 PHE A 330 -47.190 1.916 6.159 1.00 31.01 C ATOM 89 CD2 PHE A 330 -46.962 2.323 3.813 1.00 29.73 C ATOM 90 CE1 PHE A 330 -45.819 1.643 6.242 1.00 30.21 C ATOM 91 CE2 PHE A 330 -45.595 2.045 3.897 1.00 29.86 C ATOM 92 CZ PHE A 330 -45.032 1.726 5.111 1.00 27.57 C ATOM 93 H PHE A 330 -50.222 3.013 7.230 1.00 0.00 H ATOM 94 N LYS A 331 -51.129 5.091 3.771 1.00 41.83 N ATOM 95 CA LYS A 331 -52.367 5.460 3.088 1.00 41.13 C ATOM 96 C LYS A 331 -52.035 5.500 1.649 1.00 45.85 C ATOM 97 O LYS A 331 -51.144 6.261 1.230 1.00 42.97 O ATOM 98 CB LYS A 331 -52.902 6.840 3.543 1.00 43.63 C ATOM 99 CG LYS A 331 -53.370 6.869 4.984 1.00 58.26 C ATOM 100 CD LYS A 331 -53.634 8.278 5.490 1.00 70.28 C ATOM 101 CE LYS A 331 -54.024 8.293 6.957 1.00 82.12 C ATOM 102 NZ LYS A 331 -55.395 7.739 7.202 1.00 91.56 N ATOM 103 HZ1 LYS A 331 -56.095 8.306 6.682 1.00 0.00 H ATOM 104 HZ2 LYS A 331 -55.433 6.753 6.874 1.00 0.00 H ATOM 105 HZ3 LYS A 331 -55.605 7.775 8.220 1.00 0.00 H ATOM 106 H LYS A 331 -50.247 5.563 3.488 1.00 0.00 H ATOM 107 N ARG A 332 -52.745 4.673 0.870 1.00 47.13 N ATOM 108 CA ARG A 332 -52.509 4.609 -0.572 1.00 48.22 C ATOM 109 C ARG A 332 -53.157 5.790 -1.285 1.00 54.36 C ATOM 110 O ARG A 332 -54.348 6.071 -1.087 1.00 54.93 O ATOM 111 CB ARG A 332 -52.985 3.284 -1.151 1.00 45.79 C ATOM 112 CG ARG A 332 -52.489 3.078 -2.572 1.00 57.25 C ATOM 113 CD ARG A 332 -52.685 1.658 -3.009 1.00 67.86 C ATOM 114 NE ARG A 332 -54.092 1.271 -3.023 1.00 70.37 N ATOM 115 CZ ARG A 332 -54.517 0.013 -2.948 1.00 89.70 C ATOM 116 NH1 ARG A 332 -53.645 -0.988 -2.840 1.00 68.64 N ATOM 117 NH2 ARG A 332 -55.814 -0.258 -2.992 1.00 90.21 N ATOM 118 HE ARG A 332 -54.805 2.024 -3.096 1.00 0.00 H ATOM 119 HH12 ARG A 332 -53.984 -1.969 -2.782 1.00 0.00 H ATOM 120 HH11 ARG A 332 -52.625 -0.788 -2.814 1.00 0.00 H ATOM 121 HH22 ARG A 332 -56.142 -1.243 -2.933 1.00 0.00 H ATOM 122 HH21 ARG A 332 -56.504 0.515 -3.086 1.00 0.00 H ATOM 123 H ARG A 332 -53.475 4.068 1.297 1.00 0.00 H ATOM 124 N THR A 333 -52.367 6.479 -2.105 1.00 50.16 N ATOM 125 CA THR A 333 -52.854 7.645 -2.824 1.00 50.18 C ATOM 126 C THR A 333 -53.091 7.391 -4.315 1.00 57.71 C ATOM 127 O THR A 333 -53.916 8.068 -4.933 1.00 58.84 O ATOM 128 CB THR A 333 -51.966 8.850 -2.552 1.00 43.75 C ATOM 129 OG1 THR A 333 -50.630 8.569 -2.984 1.00 41.93 O ATOM 130 CG2 THR A 333 -51.996 9.257 -1.101 1.00 34.97 C ATOM 131 HG1 THR A 333 -50.282 7.785 -2.489 1.00 0.00 H ATOM 132 H THR A 333 -51.380 6.177 -2.234 1.00 0.00 H ATOM 133 N SER A 334 -52.355 6.434 -4.892 1.00 55.01 N ATOM 134 CA SER A 334 -52.409 6.071 -6.321 1.00 53.58 C ATOM 135 C SER A 334 -52.095 4.587 -6.478 1.00 55.18 C ATOM 136 O SER A 334 -51.432 3.999 -5.627 1.00 53.44 O ATOM 137 CB SER A 334 -51.407 6.894 -7.142 1.00 55.96 C ATOM 138 OG SER A 334 -51.016 8.155 -6.602 1.00 64.00 O ATOM 139 HG SER A 334 -50.372 8.590 -7.215 1.00 0.00 H ATOM 140 H SER A 334 -51.694 5.906 -4.287 1.00 0.00 H ATOM 141 N GLY A 335 -52.566 3.997 -7.566 1.00 52.73 N ATOM 142 CA GLY A 335 -52.327 2.588 -7.865 1.00 52.53 C ATOM 143 C GLY A 335 -53.101 1.562 -7.053 1.00 55.28 C ATOM 144 O GLY A 335 -54.051 1.894 -6.324 1.00 54.61 O ATOM 145 H GLY A 335 -53.129 4.560 -8.235 1.00 0.00 H ATOM 146 N SER A 336 -52.692 0.291 -7.210 1.00 51.37 N ATOM 147 CA SER A 336 -53.323 -0.900 -6.612 1.00 51.49 C ATOM 148 C SER A 336 -52.371 -2.071 -6.733 1.00 54.33 C ATOM 149 O SER A 336 -51.436 -2.035 -7.556 1.00 55.70 O ATOM 150 CB SER A 336 -54.615 -1.251 -7.354 1.00 57.36 C ATOM 151 OG SER A 336 -54.410 -1.410 -8.753 1.00 68.18 O ATOM 152 HG SER A 336 -55.270 -1.635 -9.188 1.00 0.00 H ATOM 153 H SER A 336 -51.855 0.134 -7.807 1.00 0.00 H ATOM 154 N SER A 337 -52.600 -3.113 -5.924 1.00 47.45 N ATOM 155 CA SER A 337 -51.769 -4.312 -5.980 1.00 46.01 C ATOM 156 C SER A 337 -52.545 -5.572 -5.682 1.00 50.36 C ATOM 157 O SER A 337 -53.674 -5.518 -5.177 1.00 51.02 O ATOM 158 CB SER A 337 -50.547 -4.195 -5.069 1.00 47.82 C ATOM 159 OG SER A 337 -50.849 -4.123 -3.686 1.00 53.00 O ATOM 160 HG SER A 337 -51.414 -3.329 -3.514 1.00 0.00 H ATOM 161 H SER A 337 -53.385 -3.067 -5.243 1.00 0.00 H ATOM 162 N ILE A 338 -51.960 -6.716 -6.053 1.00 45.26 N ATOM 163 CA ILE A 338 -52.504 -8.051 -5.770 1.00 43.18 C ATOM 164 C ILE A 338 -51.422 -8.828 -5.066 1.00 48.28 C ATOM 165 O ILE A 338 -50.232 -8.512 -5.253 1.00 49.96 O ATOM 166 CB ILE A 338 -53.004 -8.792 -7.013 1.00 44.53 C ATOM 167 CG1 ILE A 338 -51.899 -8.969 -8.057 1.00 44.28 C ATOM 168 CG2 ILE A 338 -54.207 -8.097 -7.567 1.00 46.19 C ATOM 169 CD1 ILE A 338 -51.992 -10.211 -8.891 1.00 50.92 C ATOM 170 H ILE A 338 -51.063 -6.657 -6.575 1.00 0.00 H ATOM 171 N LYS A 339 -51.809 -9.855 -4.297 1.00 42.81 N ATOM 172 CA LYS A 339 -50.848 -10.689 -3.571 1.00 41.91 C ATOM 173 C LYS A 339 -50.557 -12.020 -4.261 1.00 46.77 C ATOM 174 O LYS A 339 -51.476 -12.707 -4.700 1.00 48.20 O ATOM 175 CB LYS A 339 -51.384 -10.992 -2.181 1.00 43.32 C ATOM 176 CG LYS A 339 -51.266 -9.858 -1.210 1.00 49.53 C ATOM 177 CD LYS A 339 -51.709 -10.294 0.172 1.00 52.62 C ATOM 178 CE LYS A 339 -53.151 -9.972 0.457 1.00 70.78 C ATOM 179 NZ LYS A 339 -53.274 -8.642 1.161 1.00 87.14 N ATOM 180 HZ1 LYS A 339 -52.754 -8.678 2.061 1.00 0.00 H ATOM 181 HZ2 LYS A 339 -52.875 -7.894 0.558 1.00 0.00 H ATOM 182 HZ3 LYS A 339 -54.277 -8.441 1.347 1.00 0.00 H ATOM 183 H LYS A 339 -52.824 -10.067 -4.213 1.00 0.00 H ATOM 184 N ARG A 340 -49.291 -12.406 -4.323 1.00 42.57 N ATOM 185 CA ARG A 340 -48.889 -13.731 -4.808 1.00 42.16 C ATOM 186 C ARG A 340 -47.793 -14.238 -3.870 1.00 46.15 C ATOM 187 O ARG A 340 -46.806 -13.537 -3.680 1.00 48.61 O ATOM 188 CB ARG A 340 -48.439 -13.730 -6.297 1.00 41.68 C ATOM 189 CG ARG A 340 -47.991 -15.114 -6.829 1.00 48.23 C ATOM 190 CD ARG A 340 -47.545 -15.120 -8.290 1.00 57.91 C ATOM 191 NE ARG A 340 -46.570 -14.065 -8.561 1.00 79.21 N ATOM 192 CZ ARG A 340 -45.250 -14.201 -8.450 1.00 95.75 C ATOM 193 NH1 ARG A 340 -44.721 -15.372 -8.110 1.00 89.40 N ATOM 194 NH2 ARG A 340 -44.448 -13.164 -8.675 1.00 72.65 N ATOM 195 HE ARG A 340 -46.935 -13.139 -8.863 1.00 0.00 H ATOM 196 HH12 ARG A 340 -43.689 -15.471 -8.025 1.00 0.00 H ATOM 197 HH11 ARG A 340 -45.339 -16.189 -7.929 1.00 0.00 H ATOM 198 HH22 ARG A 340 -43.418 -13.275 -8.587 1.00 0.00 H ATOM 199 HH21 ARG A 340 -44.851 -12.242 -8.939 1.00 0.00 H ATOM 200 H ARG A 340 -48.552 -11.742 -4.015 1.00 0.00 H ATOM 201 N GLU A 341 -47.967 -15.424 -3.266 1.00 41.12 N ATOM 202 CA GLU A 341 -46.942 -16.018 -2.406 1.00 40.06 C ATOM 203 C GLU A 341 -45.748 -16.415 -3.237 1.00 45.77 C ATOM 204 O GLU A 341 -45.892 -16.992 -4.310 1.00 46.96 O ATOM 205 CB GLU A 341 -47.444 -17.187 -1.574 1.00 41.11 C ATOM 206 CG GLU A 341 -46.663 -17.318 -0.271 1.00 61.48 C ATOM 207 CD GLU A 341 -46.950 -18.543 0.580 1.00 97.64 C ATOM 208 OE1 GLU A 341 -48.128 -18.969 0.635 1.00 89.11 O ATOM 209 OE2 GLU A 341 -46.014 -19.023 1.264 1.00 95.09 O ATOM 210 H GLU A 341 -48.859 -15.938 -3.414 1.00 0.00 H ATOM 211 N GLU A 342 -44.572 -16.034 -2.781 1.00 43.49 N ATOM 212 CA GLU A 342 -43.354 -16.238 -3.531 1.00 44.22 C ATOM 213 C GLU A 342 -42.236 -16.624 -2.594 1.00 48.48 C ATOM 214 O GLU A 342 -42.193 -16.165 -1.458 1.00 48.88 O ATOM 215 CB GLU A 342 -42.993 -14.931 -4.291 1.00 46.06 C ATOM 216 CG GLU A 342 -41.899 -15.054 -5.346 1.00 61.35 C ATOM 217 CD GLU A 342 -41.798 -13.901 -6.331 1.00102.61 C ATOM 218 OE1 GLU A 342 -42.831 -13.258 -6.622 1.00108.83 O ATOM 219 OE2 GLU A 342 -40.665 -13.593 -6.767 1.00109.60 O ATOM 220 H GLU A 342 -44.519 -15.571 -1.851 1.00 0.00 H ATOM 221 N GLU A 343 -41.348 -17.488 -3.065 1.00 45.42 N ATOM 222 CA GLU A 343 -40.184 -17.864 -2.313 1.00 45.94 C ATOM 223 C GLU A 343 -39.059 -16.952 -2.717 1.00 49.57 C ATOM 224 O GLU A 343 -38.845 -16.718 -3.904 1.00 50.74 O ATOM 225 CB GLU A 343 -39.819 -19.328 -2.539 1.00 47.72 C ATOM 226 CG GLU A 343 -40.739 -20.264 -1.785 1.00 60.79 C ATOM 227 CD GLU A 343 -40.459 -21.738 -1.979 1.00 98.49 C ATOM 228 OE1 GLU A 343 -40.395 -22.196 -3.144 1.00102.68 O ATOM 229 OE2 GLU A 343 -40.335 -22.445 -0.955 1.00102.77 O ATOM 230 H GLU A 343 -41.499 -17.905 -4.006 1.00 0.00 H ATOM 231 N VAL A 344 -38.363 -16.402 -1.723 1.00 44.41 N ATOM 232 CA VAL A 344 -37.216 -15.514 -1.926 1.00 42.88 C ATOM 233 C VAL A 344 -35.984 -16.078 -1.202 1.00 42.85 C ATOM 234 O VAL A 344 -36.140 -16.812 -0.212 1.00 41.94 O ATOM 235 CB VAL A 344 -37.521 -14.020 -1.551 1.00 46.49 C ATOM 236 CG1 VAL A 344 -38.624 -13.437 -2.442 1.00 46.13 C ATOM 237 CG2 VAL A 344 -37.883 -13.859 -0.068 1.00 46.02 C ATOM 238 H VAL A 344 -38.651 -16.615 -0.747 1.00 0.00 H ATOM 239 N LEU A 345 -34.784 -15.749 -1.696 1.00 37.11 N ATOM 240 CA LEU A 345 -33.559 -16.194 -1.064 1.00 37.67 C ATOM 241 C LEU A 345 -32.838 -15.031 -0.389 1.00 42.27 C ATOM 242 O LEU A 345 -32.601 -14.006 -1.014 1.00 42.40 O ATOM 243 CB LEU A 345 -32.614 -16.882 -2.071 1.00 37.84 C ATOM 244 CG LEU A 345 -32.869 -18.329 -2.472 1.00 41.58 C ATOM 245 CD1 LEU A 345 -31.820 -18.759 -3.471 1.00 39.92 C ATOM 246 CD2 LEU A 345 -32.723 -19.270 -1.299 1.00 45.35 C ATOM 247 H LEU A 345 -34.730 -15.161 -2.552 1.00 0.00 H ATOM 248 N THR A 346 -32.437 -15.214 0.854 1.00 39.92 N ATOM 249 CA THR A 346 -31.687 -14.185 1.566 1.00 40.89 C ATOM 250 C THR A 346 -30.224 -14.248 1.158 1.00 43.67 C ATOM 251 O THR A 346 -29.808 -15.205 0.503 1.00 41.64 O ATOM 252 CB THR A 346 -31.821 -14.366 3.098 1.00 49.85 C ATOM 253 OG1 THR A 346 -31.061 -15.503 3.519 1.00 50.75 O ATOM 254 CG2 THR A 346 -33.271 -14.518 3.544 1.00 46.17 C ATOM 255 HG1 THR A 346 -31.150 -15.614 4.499 1.00 0.00 H ATOM 256 H THR A 346 -32.660 -16.109 1.336 1.00 0.00 H ATOM 257 N GLY A 347 -29.440 -13.271 1.616 1.00 41.23 N ATOM 258 CA GLY A 347 -27.994 -13.275 1.423 1.00 41.10 C ATOM 259 C GLY A 347 -27.320 -14.463 2.101 1.00 44.10 C ATOM 260 O GLY A 347 -26.160 -14.752 1.831 1.00 44.99 O ATOM 261 H GLY A 347 -29.875 -12.478 2.129 1.00 0.00 H ATOM 262 N ASN A 348 -28.032 -15.162 2.970 1.00 39.57 N ATOM 263 CA ASN A 348 -27.545 -16.354 3.663 1.00 40.45 C ATOM 264 C ASN A 348 -28.158 -17.636 3.013 1.00 46.69 C ATOM 265 O ASN A 348 -28.067 -18.743 3.557 1.00 46.73 O ATOM 266 CB ASN A 348 -27.901 -16.250 5.161 1.00 43.05 C ATOM 267 CG ASN A 348 -27.309 -17.325 6.005 1.00 57.34 C ATOM 268 OD1 ASN A 348 -26.130 -17.676 5.854 1.00 57.72 O ATOM 269 ND2 ASN A 348 -28.126 -17.892 6.887 1.00 44.09 N ATOM 270 HD22 ASN A 348 -29.108 -17.560 6.975 1.00 0.00 H ATOM 271 HD21 ASN A 348 -27.784 -18.668 7.489 1.00 0.00 H ATOM 272 H ASN A 348 -29.001 -14.843 3.173 1.00 0.00 H ATOM 273 N LEU A 349 -28.776 -17.462 1.823 1.00 42.32 N ATOM 274 CA LEU A 349 -29.410 -18.512 1.038 1.00 39.82 C ATOM 275 C LEU A 349 -30.447 -19.252 1.820 1.00 45.88 C ATOM 276 O LEU A 349 -30.636 -20.458 1.649 1.00 47.94 O ATOM 277 CB LEU A 349 -28.404 -19.437 0.331 1.00 38.91 C ATOM 278 CG LEU A 349 -27.445 -18.772 -0.636 1.00 43.10 C ATOM 279 CD1 LEU A 349 -26.615 -19.761 -1.334 1.00 43.79 C ATOM 280 CD2 LEU A 349 -28.159 -18.007 -1.685 1.00 45.31 C ATOM 281 H LEU A 349 -28.801 -16.497 1.436 1.00 0.00 H ATOM 282 N GLN A 350 -31.140 -18.519 2.687 1.00 42.30 N ATOM 283 CA GLN A 350 -32.292 -19.034 3.420 1.00 41.80 C ATOM 284 C GLN A 350 -33.538 -18.708 2.557 1.00 44.60 C ATOM 285 O GLN A 350 -33.650 -17.603 2.011 1.00 41.38 O ATOM 286 CB GLN A 350 -32.398 -18.386 4.813 1.00 43.14 C ATOM 287 CG GLN A 350 -33.606 -18.850 5.642 1.00 54.41 C ATOM 288 CD GLN A 350 -33.778 -18.091 6.932 1.00 63.10 C ATOM 289 OE1 GLN A 350 -33.191 -17.038 7.145 1.00 59.38 O ATOM 290 NE2 GLN A 350 -34.594 -18.609 7.827 1.00 59.21 N ATOM 291 HE22 GLN A 350 -35.084 -19.505 7.628 1.00 0.00 H ATOM 292 HE21 GLN A 350 -34.749 -18.122 8.733 1.00 0.00 H ATOM 293 H GLN A 350 -30.848 -17.534 2.850 1.00 0.00 H ATOM 294 N THR A 351 -34.451 -19.675 2.430 1.00 42.34 N ATOM 295 CA THR A 351 -35.674 -19.425 1.699 1.00 43.31 C ATOM 296 C THR A 351 -36.736 -18.859 2.643 1.00 51.41 C ATOM 297 O THR A 351 -37.054 -19.473 3.672 1.00 52.21 O ATOM 298 CB THR A 351 -36.214 -20.703 0.999 1.00 49.47 C ATOM 299 OG1 THR A 351 -35.257 -21.208 0.073 1.00 47.19 O ATOM 300 CG2 THR A 351 -37.549 -20.459 0.273 1.00 46.85 C ATOM 301 HG1 THR A 351 -35.618 -22.021 -0.362 1.00 0.00 H ATOM 302 H THR A 351 -34.282 -20.608 2.857 1.00 0.00 H ATOM 303 N LEU A 352 -37.333 -17.725 2.245 1.00 48.13 N ATOM 304 CA LEU A 352 -38.467 -17.116 2.940 1.00 46.14 C ATOM 305 C LEU A 352 -39.665 -17.167 2.010 1.00 45.07 C ATOM 306 O LEU A 352 -39.549 -16.913 0.799 1.00 41.51 O ATOM 307 CB LEU A 352 -38.203 -15.642 3.291 1.00 46.31 C ATOM 308 CG LEU A 352 -36.982 -15.295 4.117 1.00 52.10 C ATOM 309 CD1 LEU A 352 -36.862 -13.797 4.284 1.00 52.45 C ATOM 310 CD2 LEU A 352 -37.024 -15.968 5.480 1.00 56.11 C ATOM 311 H LEU A 352 -36.969 -17.252 1.394 1.00 0.00 H ATOM 312 N LYS A 353 -40.824 -17.450 2.581 1.00 41.55 N ATOM 313 CA LYS A 353 -42.053 -17.424 1.806 1.00 42.23 C ATOM 314 C LYS A 353 -42.788 -16.132 2.171 1.00 45.16 C ATOM 315 O LYS A 353 -43.254 -15.979 3.311 1.00 41.58 O ATOM 316 CB LYS A 353 -42.909 -18.671 2.069 1.00 45.44 C ATOM 317 CG LYS A 353 -42.243 -19.966 1.642 1.00 58.19 C ATOM 318 CD LYS A 353 -42.804 -21.164 2.391 1.00 71.41 C ATOM 319 CE LYS A 353 -42.457 -22.510 1.778 1.00 74.83 C ATOM 320 NZ LYS A 353 -41.008 -22.813 1.799 1.00 87.48 N ATOM 321 HZ1 LYS A 353 -40.495 -22.085 1.263 1.00 0.00 H ATOM 322 HZ2 LYS A 353 -40.671 -22.822 2.783 1.00 0.00 H ATOM 323 HZ3 LYS A 353 -40.843 -23.744 1.366 1.00 0.00 H ATOM 324 H LYS A 353 -40.856 -17.693 3.592 1.00 0.00 H ATOM 325 N ILE A 354 -42.819 -15.171 1.214 1.00 43.07 N ATOM 326 CA ILE A 354 -43.457 -13.871 1.421 1.00 42.97 C ATOM 327 C ILE A 354 -44.613 -13.671 0.462 1.00 45.88 C ATOM 328 O ILE A 354 -44.622 -14.248 -0.624 1.00 43.31 O ATOM 329 CB ILE A 354 -42.450 -12.699 1.339 1.00 46.70 C ATOM 330 CG1 ILE A 354 -41.884 -12.508 -0.088 1.00 47.53 C ATOM 331 CG2 ILE A 354 -41.327 -12.831 2.383 1.00 46.75 C ATOM 332 CD1 ILE A 354 -41.265 -11.103 -0.337 1.00 60.03 C ATOM 333 H ILE A 354 -42.371 -15.366 0.296 1.00 0.00 H ATOM 334 N ARG A 355 -45.584 -12.842 0.865 1.00 43.58 N ATOM 335 CA ARG A 355 -46.681 -12.477 -0.027 1.00 42.85 C ATOM 336 C ARG A 355 -46.204 -11.229 -0.768 1.00 46.22 C ATOM 337 O ARG A 355 -46.077 -10.164 -0.162 1.00 46.64 O ATOM 338 CB ARG A 355 -47.993 -12.213 0.733 1.00 40.56 C ATOM 339 CG ARG A 355 -48.464 -13.430 1.521 1.00 59.10 C ATOM 340 CD ARG A 355 -49.901 -13.321 2.010 1.00 83.77 C ATOM 341 NE ARG A 355 -50.869 -13.816 1.020 1.00100.41 N ATOM 342 CZ ARG A 355 -52.194 -13.819 1.181 1.00109.13 C ATOM 343 NH1 ARG A 355 -52.737 -13.373 2.310 1.00 81.79 N ATOM 344 NH2 ARG A 355 -52.984 -14.268 0.214 1.00 97.72 N ATOM 345 HE ARG A 355 -50.493 -14.192 0.127 1.00 0.00 H ATOM 346 HH12 ARG A 355 -53.770 -13.379 2.428 1.00 0.00 H ATOM 347 HH11 ARG A 355 -52.128 -13.019 3.075 1.00 0.00 H ATOM 348 HH22 ARG A 355 -54.016 -14.269 0.344 1.00 0.00 H ATOM 349 HH21 ARG A 355 -52.571 -14.619 -0.674 1.00 0.00 H ATOM 350 H ARG A 355 -45.557 -12.452 1.829 1.00 0.00 H ATOM 351 N VAL A 356 -45.844 -11.393 -2.043 1.00 41.03 N ATOM 352 CA VAL A 356 -45.386 -10.300 -2.887 1.00 40.29 C ATOM 353 C VAL A 356 -46.593 -9.503 -3.345 1.00 43.19 C ATOM 354 O VAL A 356 -47.580 -10.079 -3.803 1.00 41.64 O ATOM 355 CB VAL A 356 -44.578 -10.803 -4.113 1.00 43.53 C ATOM 356 CG1 VAL A 356 -44.329 -9.677 -5.126 1.00 42.20 C ATOM 357 CG2 VAL A 356 -43.265 -11.434 -3.670 1.00 43.18 C ATOM 358 H VAL A 356 -45.893 -12.348 -2.453 1.00 0.00 H ATOM 359 N HIS A 357 -46.506 -8.174 -3.212 1.00 38.94 N ATOM 360 CA HIS A 357 -47.538 -7.268 -3.665 1.00 36.41 C ATOM 361 C HIS A 357 -47.141 -6.830 -5.036 1.00 44.36 C ATOM 362 O HIS A 357 -46.051 -6.285 -5.242 1.00 44.86 O ATOM 363 CB HIS A 357 -47.741 -6.105 -2.705 1.00 35.02 C ATOM 364 CG HIS A 357 -48.555 -6.494 -1.513 1.00 37.45 C ATOM 365 ND1 HIS A 357 -47.979 -7.117 -0.416 1.00 39.14 N ATOM 366 CD2 HIS A 357 -49.877 -6.347 -1.277 1.00 37.99 C ATOM 367 CE1 HIS A 357 -48.968 -7.342 0.435 1.00 37.51 C ATOM 368 NE2 HIS A 357 -50.122 -6.877 -0.030 1.00 37.50 N ATOM 369 H HIS A 357 -45.657 -7.775 -2.762 1.00 0.00 H ATOM 370 N GLU A 358 -48.007 -7.139 -5.998 1.00 43.01 N ATOM 371 CA GLU A 358 -47.742 -6.842 -7.395 1.00 43.65 C ATOM 372 C GLU A 358 -48.588 -5.706 -7.899 1.00 45.76 C ATOM 373 O GLU A 358 -49.823 -5.781 -7.869 1.00 43.12 O ATOM 374 CB GLU A 358 -48.012 -8.081 -8.229 1.00 45.61 C ATOM 375 CG GLU A 358 -47.121 -9.251 -7.893 1.00 53.02 C ATOM 376 CD GLU A 358 -47.469 -10.434 -8.743 1.00 58.93 C ATOM 377 OE1 GLU A 358 -48.667 -10.593 -9.069 1.00 53.22 O ATOM 378 OE2 GLU A 358 -46.530 -11.148 -9.156 1.00 52.99 O ATOM 379 H GLU A 358 -48.900 -7.607 -5.742 1.00 0.00 H ATOM 380 N GLY A 359 -47.911 -4.691 -8.409 1.00 43.29 N ATOM 381 CA GLY A 359 -48.528 -3.481 -8.927 1.00 43.89 C ATOM 382 C GLY A 359 -47.835 -2.228 -8.440 1.00 51.85 C ATOM 383 O GLY A 359 -47.184 -2.221 -7.388 1.00 55.89 O ATOM 384 H GLY A 359 -46.874 -4.763 -8.441 1.00 0.00 H ATOM 385 N TYR A 360 -47.957 -1.166 -9.212 1.00 47.46 N ATOM 386 CA TYR A 360 -47.387 0.128 -8.870 1.00 46.18 C ATOM 387 C TYR A 360 -48.341 0.872 -7.932 1.00 49.61 C ATOM 388 O TYR A 360 -49.544 0.990 -8.222 1.00 48.13 O ATOM 389 CB TYR A 360 -47.123 0.961 -10.124 1.00 44.95 C ATOM 390 CG TYR A 360 -46.514 2.307 -9.819 1.00 43.67 C ATOM 391 CD1 TYR A 360 -45.138 2.455 -9.686 1.00 43.49 C ATOM 392 CD2 TYR A 360 -47.317 3.438 -9.656 1.00 44.37 C ATOM 393 CE1 TYR A 360 -44.571 3.697 -9.414 1.00 42.65 C ATOM 394 CE2 TYR A 360 -46.761 4.683 -9.387 1.00 44.40 C ATOM 395 CZ TYR A 360 -45.385 4.810 -9.277 1.00 49.72 C ATOM 396 OH TYR A 360 -44.824 6.042 -9.037 1.00 53.66 O ATOM 397 HH TYR A 360 -45.167 6.398 -8.179 1.00 0.00 H ATOM 398 H TYR A 360 -48.484 -1.257 -10.104 1.00 0.00 H ATOM 399 N GLU A 361 -47.784 1.384 -6.810 1.00 44.01 N ATOM 400 CA GLU A 361 -48.560 2.116 -5.831 1.00 42.46 C ATOM 401 C GLU A 361 -47.789 3.293 -5.285 1.00 47.65 C ATOM 402 O GLU A 361 -46.554 3.253 -5.168 1.00 47.11 O ATOM 403 CB GLU A 361 -48.929 1.211 -4.651 1.00 43.46 C ATOM 404 CG GLU A 361 -49.752 -0.026 -4.952 1.00 49.34 C ATOM 405 CD GLU A 361 -49.726 -1.020 -3.800 1.00 71.92 C ATOM 406 OE1 GLU A 361 -48.627 -1.530 -3.460 1.00 62.86 O ATOM 407 OE2 GLU A 361 -50.816 -1.305 -3.246 1.00 58.86 O ATOM 408 H GLU A 361 -46.766 1.247 -6.646 1.00 0.00 H ATOM 409 N GLU A 362 -48.534 4.324 -4.874 1.00 45.30 N ATOM 410 CA GLU A 362 -47.977 5.478 -4.180 1.00 44.73 C ATOM 411 C GLU A 362 -48.673 5.578 -2.823 1.00 47.29 C ATOM 412 O GLU A 362 -49.899 5.365 -2.716 1.00 44.62 O ATOM 413 CB GLU A 362 -48.135 6.765 -4.976 1.00 46.14 C ATOM 414 CG GLU A 362 -47.730 6.617 -6.431 1.00 57.79 C ATOM 415 CD GLU A 362 -47.493 7.904 -7.184 1.00 72.07 C ATOM 416 OE1 GLU A 362 -48.113 8.937 -6.840 1.00 71.69 O ATOM 417 OE2 GLU A 362 -46.695 7.868 -8.144 1.00 61.97 O ATOM 418 H GLU A 362 -49.557 4.302 -5.058 1.00 0.00 H ATOM 419 N PHE A 363 -47.861 5.842 -1.773 1.00 43.06 N ATOM 420 CA PHE A 363 -48.338 5.930 -0.401 1.00 41.42 C ATOM 421 C PHE A 363 -47.814 7.125 0.326 1.00 46.36 C ATOM 422 O PHE A 363 -46.739 7.621 0.010 1.00 47.21 O ATOM 423 CB PHE A 363 -47.833 4.730 0.402 1.00 41.68 C ATOM 424 CG PHE A 363 -48.328 3.381 -0.025 1.00 41.05 C ATOM 425 CD1 PHE A 363 -49.490 2.845 0.525 1.00 40.54 C ATOM 426 CD2 PHE A 363 -47.595 2.610 -0.931 1.00 42.38 C ATOM 427 CE1 PHE A 363 -49.947 1.585 0.139 1.00 40.63 C ATOM 428 CE2 PHE A 363 -48.039 1.346 -1.307 1.00 43.92 C ATOM 429 CZ PHE A 363 -49.216 0.843 -0.770 1.00 41.15 C ATOM 430 H PHE A 363 -46.848 5.989 -1.955 1.00 0.00 H ATOM 431 N THR A 364 -48.530 7.534 1.370 1.00 42.59 N ATOM 432 CA THR A 364 -47.994 8.485 2.331 1.00 41.83 C ATOM 433 C THR A 364 -47.777 7.608 3.559 1.00 45.30 C ATOM 434 O THR A 364 -48.623 6.744 3.887 1.00 44.45 O ATOM 435 CB THR A 364 -48.903 9.687 2.634 1.00 46.21 C ATOM 436 OG1 THR A 364 -50.141 9.246 3.225 1.00 57.84 O ATOM 437 CG2 THR A 364 -49.159 10.535 1.419 1.00 34.32 C ATOM 438 HG1 THR A 364 -49.950 8.766 4.069 1.00 0.00 H ATOM 439 H THR A 364 -49.494 7.166 1.502 1.00 0.00 H ATOM 440 N MET A 365 -46.608 7.781 4.188 1.00 40.87 N ATOM 441 CA MET A 365 -46.252 7.081 5.418 1.00 40.32 C ATOM 442 C MET A 365 -46.261 8.157 6.475 1.00 41.84 C ATOM 443 O MET A 365 -45.558 9.158 6.344 1.00 44.17 O ATOM 444 CB MET A 365 -44.849 6.494 5.354 1.00 42.89 C ATOM 445 CG MET A 365 -44.713 5.273 4.525 1.00 46.93 C ATOM 446 SD MET A 365 -42.966 4.828 4.321 1.00 52.13 S ATOM 447 CE MET A 365 -42.424 4.664 5.994 1.00 48.35 C ATOM 448 H MET A 365 -45.920 8.446 3.780 1.00 0.00 H ATOM 449 N VAL A 366 -47.059 7.975 7.504 1.00 33.05 N ATOM 450 CA VAL A 366 -47.170 8.980 8.529 1.00 31.30 C ATOM 451 C VAL A 366 -46.832 8.378 9.838 1.00 35.32 C ATOM 452 O VAL A 366 -47.503 7.429 10.281 1.00 35.53 O ATOM 453 CB VAL A 366 -48.603 9.614 8.522 1.00 34.10 C ATOM 454 CG1 VAL A 366 -48.896 10.408 9.807 1.00 31.62 C ATOM 455 CG2 VAL A 366 -48.803 10.474 7.270 1.00 33.46 C ATOM 456 H VAL A 366 -47.614 7.099 7.578 1.00 0.00 H ATOM 457 N GLY A 367 -45.798 8.932 10.450 1.00 31.34 N ATOM 458 CA GLY A 367 -45.388 8.533 11.778 1.00 31.65 C ATOM 459 C GLY A 367 -45.444 9.697 12.739 1.00 38.27 C ATOM 460 O GLY A 367 -45.758 10.828 12.364 1.00 37.49 O ATOM 461 H GLY A 367 -45.263 9.678 9.961 1.00 0.00 H ATOM 462 N LYS A 368 -45.088 9.422 13.986 1.00 38.11 N ATOM 463 CA LYS A 368 -45.039 10.426 15.037 1.00 38.22 C ATOM 464 C LYS A 368 -43.829 11.348 14.895 1.00 41.36 C ATOM 465 O LYS A 368 -43.908 12.498 15.309 1.00 43.46 O ATOM 466 CB LYS A 368 -45.068 9.750 16.417 1.00 40.10 C ATOM 467 CG LYS A 368 -46.428 9.129 16.776 1.00 57.29 C ATOM 468 CD LYS A 368 -47.403 10.153 17.427 1.00 75.56 C ATOM 469 CE LYS A 368 -47.065 10.511 18.870 1.00 80.43 C ATOM 470 NZ LYS A 368 -47.921 11.603 19.420 1.00 80.22 N ATOM 471 HZ1 LYS A 368 -47.798 12.461 18.845 1.00 0.00 H ATOM 472 HZ2 LYS A 368 -48.918 11.307 19.394 1.00 0.00 H ATOM 473 HZ3 LYS A 368 -47.642 11.799 20.402 1.00 0.00 H ATOM 474 H LYS A 368 -44.832 8.443 14.224 1.00 0.00 H ATOM 475 N ARG A 369 -42.729 10.864 14.307 1.00 33.88 N ATOM 476 CA ARG A 369 -41.499 11.645 14.223 1.00 31.90 C ATOM 477 C ARG A 369 -40.965 11.802 12.794 1.00 31.02 C ATOM 478 O ARG A 369 -39.914 12.410 12.576 1.00 29.55 O ATOM 479 CB ARG A 369 -40.421 11.004 15.107 1.00 32.52 C ATOM 480 CG ARG A 369 -40.617 11.147 16.581 1.00 42.12 C ATOM 481 CD ARG A 369 -39.803 10.121 17.334 1.00 41.50 C ATOM 482 NE ARG A 369 -40.075 8.776 16.837 1.00 55.26 N ATOM 483 CZ ARG A 369 -41.164 8.063 17.134 1.00 82.34 C ATOM 484 NH1 ARG A 369 -42.102 8.565 17.935 1.00 80.57 N ATOM 485 NH2 ARG A 369 -41.324 6.843 16.633 1.00 63.24 N ATOM 486 HE ARG A 369 -39.371 8.342 16.207 1.00 0.00 H ATOM 487 HH12 ARG A 369 -42.947 8.003 18.162 1.00 0.00 H ATOM 488 HH11 ARG A 369 -41.989 9.519 18.334 1.00 0.00 H ATOM 489 HH22 ARG A 369 -42.174 6.292 16.868 1.00 0.00 H ATOM 490 HH21 ARG A 369 -40.599 6.439 16.006 1.00 0.00 H ATOM 491 H ARG A 369 -42.751 9.907 13.900 1.00 0.00 H ATOM 492 N ALA A 370 -41.664 11.230 11.834 1.00 26.41 N ATOM 493 CA ALA A 370 -41.276 11.298 10.425 1.00 26.08 C ATOM 494 C ALA A 370 -42.478 11.049 9.567 1.00 33.37 C ATOM 495 O ALA A 370 -43.409 10.338 9.982 1.00 31.99 O ATOM 496 CB ALA A 370 -40.200 10.264 10.092 1.00 26.61 C ATOM 497 H ALA A 370 -42.527 10.709 12.089 1.00 0.00 H ATOM 498 N THR A 371 -42.490 11.677 8.377 1.00 32.92 N ATOM 499 CA THR A 371 -43.510 11.433 7.356 1.00 33.61 C ATOM 500 C THR A 371 -42.773 11.247 6.043 1.00 36.85 C ATOM 501 O THR A 371 -41.670 11.785 5.864 1.00 36.50 O ATOM 502 CB THR A 371 -44.592 12.540 7.256 1.00 46.25 C ATOM 503 OG1 THR A 371 -44.029 13.724 6.692 1.00 50.87 O ATOM 504 CG2 THR A 371 -45.269 12.837 8.575 1.00 42.41 C ATOM 505 HG1 THR A 371 -44.727 14.424 6.632 1.00 0.00 H ATOM 506 H THR A 371 -41.740 12.368 8.173 1.00 0.00 H ATOM 507 N ALA A 372 -43.389 10.509 5.113 1.00 33.45 N ATOM 508 CA ALA A 372 -42.799 10.286 3.787 1.00 33.25 C ATOM 509 C ALA A 372 -43.832 10.053 2.729 1.00 36.68 C ATOM 510 O ALA A 372 -44.989 9.720 3.033 1.00 33.76 O ATOM 511 CB ALA A 372 -41.811 9.111 3.809 1.00 33.56 C ATOM 512 H ALA A 372 -44.311 10.082 5.335 1.00 0.00 H ATOM 513 N ILE A 373 -43.397 10.243 1.468 1.00 35.72 N ATOM 514 CA ILE A 373 -44.150 9.879 0.280 1.00 37.23 C ATOM 515 C ILE A 373 -43.325 8.790 -0.379 1.00 39.19 C ATOM 516 O ILE A 373 -42.129 8.983 -0.676 1.00 36.30 O ATOM 517 CB ILE A 373 -44.444 11.041 -0.682 1.00 42.02 C ATOM 518 CG1 ILE A 373 -45.520 11.951 -0.127 1.00 43.58 C ATOM 519 CG2 ILE A 373 -44.822 10.521 -2.079 1.00 44.80 C ATOM 520 CD1 ILE A 373 -45.340 13.453 -0.668 1.00 62.18 C ATOM 521 H ILE A 373 -42.462 10.678 1.337 1.00 0.00 H ATOM 522 N LEU A 374 -43.968 7.634 -0.564 1.00 37.14 N ATOM 523 CA LEU A 374 -43.374 6.470 -1.163 1.00 38.02 C ATOM 524 C LEU A 374 -44.017 6.120 -2.481 1.00 44.73 C ATOM 525 O LEU A 374 -45.236 5.917 -2.537 1.00 45.79 O ATOM 526 CB LEU A 374 -43.511 5.286 -0.182 1.00 38.40 C ATOM 527 CG LEU A 374 -43.094 3.886 -0.668 1.00 42.84 C ATOM 528 CD1 LEU A 374 -41.641 3.862 -1.203 1.00 42.69 C ATOM 529 CD2 LEU A 374 -43.272 2.908 0.439 1.00 46.38 C ATOM 530 H LEU A 374 -44.959 7.572 -0.256 1.00 0.00 H ATOM 531 N ARG A 375 -43.183 5.978 -3.524 1.00 42.22 N ATOM 532 CA ARG A 375 -43.607 5.447 -4.818 1.00 42.82 C ATOM 533 C ARG A 375 -42.902 4.105 -4.994 1.00 44.41 C ATOM 534 O ARG A 375 -41.670 4.045 -4.951 1.00 40.91 O ATOM 535 CB ARG A 375 -43.286 6.380 -5.994 1.00 43.70 C ATOM 536 CG ARG A 375 -43.943 7.735 -5.909 1.00 56.07 C ATOM 537 CD ARG A 375 -43.396 8.711 -6.930 1.00 67.44 C ATOM 538 NE ARG A 375 -44.077 10.002 -6.841 1.00 80.85 N ATOM 539 CZ ARG A 375 -43.973 10.979 -7.735 1.00 94.07 C ATOM 540 NH1 ARG A 375 -43.194 10.835 -8.801 1.00 77.51 N ATOM 541 NH2 ARG A 375 -44.657 12.104 -7.578 1.00 84.20 N ATOM 542 HE ARG A 375 -44.688 10.168 -6.016 1.00 0.00 H ATOM 543 HH12 ARG A 375 -43.117 11.604 -9.497 1.00 0.00 H ATOM 544 HH11 ARG A 375 -42.661 9.953 -8.940 1.00 0.00 H ATOM 545 HH22 ARG A 375 -44.573 12.866 -8.280 1.00 0.00 H ATOM 546 HH21 ARG A 375 -45.278 12.224 -6.752 1.00 0.00 H ATOM 547 H ARG A 375 -42.189 6.259 -3.405 1.00 0.00 H ATOM 548 N LYS A 376 -43.689 3.032 -5.171 1.00 41.93 N ATOM 549 CA LYS A 376 -43.130 1.706 -5.374 1.00 41.21 C ATOM 550 C LYS A 376 -43.821 0.914 -6.451 1.00 42.75 C ATOM 551 O LYS A 376 -45.064 0.927 -6.556 1.00 37.58 O ATOM 552 CB LYS A 376 -43.084 0.896 -4.057 1.00 43.34 C ATOM 553 CG LYS A 376 -44.378 0.138 -3.703 1.00 47.12 C ATOM 554 CD LYS A 376 -44.216 -0.738 -2.468 1.00 48.58 C ATOM 555 CE LYS A 376 -43.752 -2.165 -2.728 1.00 28.12 C ATOM 556 NZ LYS A 376 -44.875 -3.033 -3.159 1.00 41.52 N ATOM 557 HZ1 LYS A 376 -45.601 -3.053 -2.415 1.00 0.00 H ATOM 558 HZ2 LYS A 376 -45.286 -2.655 -4.036 1.00 0.00 H ATOM 559 HZ3 LYS A 376 -44.522 -3.997 -3.327 1.00 0.00 H ATOM 560 H LYS A 376 -44.722 3.152 -5.163 1.00 0.00 H ATOM 561 N ALA A 377 -42.987 0.183 -7.227 1.00 42.89 N ATOM 562 CA ALA A 377 -43.410 -0.789 -8.234 1.00 43.30 C ATOM 563 C ALA A 377 -43.242 -2.160 -7.559 1.00 48.07 C ATOM 564 O ALA A 377 -42.797 -2.218 -6.410 1.00 49.41 O ATOM 565 CB ALA A 377 -42.544 -0.682 -9.488 1.00 43.85 C ATOM 566 H ALA A 377 -41.965 0.324 -7.097 1.00 0.00 H ATOM 567 N THR A 378 -43.622 -3.251 -8.232 1.00 43.22 N ATOM 568 CA THR A 378 -43.489 -4.592 -7.667 1.00 41.52 C ATOM 569 C THR A 378 -42.056 -4.838 -7.260 1.00 41.47 C ATOM 570 O THR A 378 -41.146 -4.673 -8.077 1.00 40.95 O ATOM 571 CB THR A 378 -43.985 -5.627 -8.640 1.00 48.43 C ATOM 572 OG1 THR A 378 -45.304 -5.244 -9.066 1.00 61.04 O ATOM 573 CG2 THR A 378 -43.977 -7.025 -8.039 1.00 33.48 C ATOM 574 HG1 THR A 378 -45.649 -5.913 -9.708 1.00 0.00 H ATOM 575 H THR A 378 -44.024 -3.142 -9.185 1.00 0.00 H ATOM 576 N ARG A 379 -41.853 -5.106 -5.965 1.00 35.54 N ATOM 577 CA ARG A 379 -40.530 -5.363 -5.383 1.00 34.94 C ATOM 578 C ARG A 379 -39.468 -4.334 -5.784 1.00 42.81 C ATOM 579 O ARG A 379 -38.301 -4.687 -5.965 1.00 42.29 O ATOM 580 CB ARG A 379 -40.038 -6.798 -5.686 1.00 29.43 C ATOM 581 CG ARG A 379 -41.021 -7.902 -5.277 1.00 35.88 C ATOM 582 CD ARG A 379 -40.394 -9.274 -5.231 1.00 35.45 C ATOM 583 NE ARG A 379 -39.327 -9.314 -4.242 1.00 44.82 N ATOM 584 CZ ARG A 379 -38.343 -10.197 -4.216 1.00 56.35 C ATOM 585 NH1 ARG A 379 -38.288 -11.165 -5.117 1.00 50.92 N ATOM 586 NH2 ARG A 379 -37.393 -10.107 -3.300 1.00 49.18 N ATOM 587 HE ARG A 379 -39.339 -8.590 -3.496 1.00 0.00 H ATOM 588 HH12 ARG A 379 -37.511 -11.856 -5.091 1.00 0.00 H ATOM 589 HH11 ARG A 379 -39.021 -11.234 -5.851 1.00 0.00 H ATOM 590 HH22 ARG A 379 -36.620 -10.803 -3.282 1.00 0.00 H ATOM 591 HH21 ARG A 379 -37.419 -9.340 -2.598 1.00 0.00 H ATOM 592 H ARG A 379 -42.680 -5.134 -5.335 1.00 0.00 H ATOM 593 N ARG A 380 -39.860 -3.065 -5.903 1.00 43.26 N ATOM 594 CA ARG A 380 -38.929 -2.020 -6.313 1.00 44.92 C ATOM 595 C ARG A 380 -39.355 -0.636 -5.804 1.00 51.28 C ATOM 596 O ARG A 380 -40.379 -0.090 -6.219 1.00 52.45 O ATOM 597 CB ARG A 380 -38.778 -2.033 -7.855 1.00 44.63 C ATOM 598 CG ARG A 380 -37.752 -1.054 -8.437 1.00 39.07 C ATOM 599 CD ARG A 380 -37.525 -1.297 -9.929 1.00 36.35 C ATOM 600 NE ARG A 380 -38.736 -1.077 -10.730 1.00 43.54 N ATOM 601 CZ ARG A 380 -39.040 0.065 -11.354 1.00 54.52 C ATOM 602 NH1 ARG A 380 -38.207 1.105 -11.304 1.00 36.30 N ATOM 603 NH2 ARG A 380 -40.175 0.176 -12.032 1.00 32.20 N ATOM 604 HE ARG A 380 -39.406 -1.868 -10.818 1.00 0.00 H ATOM 605 HH12 ARG A 380 -38.451 1.990 -11.792 1.00 0.00 H ATOM 606 HH11 ARG A 380 -37.314 1.031 -10.777 1.00 0.00 H ATOM 607 HH22 ARG A 380 -40.407 1.067 -12.516 1.00 0.00 H ATOM 608 HH21 ARG A 380 -40.833 -0.628 -12.080 1.00 0.00 H ATOM 609 H ARG A 380 -40.849 -2.816 -5.699 1.00 0.00 H ATOM 610 N LEU A 381 -38.561 -0.071 -4.910 1.00 46.79 N ATOM 611 CA LEU A 381 -38.820 1.283 -4.441 1.00 46.33 C ATOM 612 C LEU A 381 -38.409 2.223 -5.589 1.00 48.30 C ATOM 613 O LEU A 381 -37.287 2.143 -6.108 1.00 46.69 O ATOM 614 CB LEU A 381 -37.974 1.558 -3.182 1.00 46.77 C ATOM 615 CG LEU A 381 -38.162 2.884 -2.466 1.00 51.22 C ATOM 616 CD1 LEU A 381 -37.838 2.718 -1.039 1.00 52.19 C ATOM 617 CD2 LEU A 381 -37.249 3.946 -3.010 1.00 52.54 C ATOM 618 H LEU A 381 -37.745 -0.598 -4.539 1.00 0.00 H ATOM 619 N VAL A 382 -39.323 3.101 -5.995 1.00 45.22 N ATOM 620 CA VAL A 382 -39.039 4.048 -7.090 1.00 43.32 C ATOM 621 C VAL A 382 -38.578 5.369 -6.517 1.00 46.26 C ATOM 622 O VAL A 382 -37.615 5.964 -7.005 1.00 46.57 O ATOM 623 CB VAL A 382 -40.227 4.229 -8.050 1.00 45.45 C ATOM 624 CG1 VAL A 382 -39.908 5.259 -9.116 1.00 45.01 C ATOM 625 CG2 VAL A 382 -40.625 2.904 -8.693 1.00 44.99 C ATOM 626 H VAL A 382 -40.254 3.120 -5.532 1.00 0.00 H ATOM 627 N GLN A 383 -39.264 5.827 -5.475 1.00 41.91 N ATOM 628 CA GLN A 383 -38.920 7.083 -4.825 1.00 40.88 C ATOM 629 C GLN A 383 -39.397 7.118 -3.388 1.00 42.46 C ATOM 630 O GLN A 383 -40.514 6.697 -3.095 1.00 42.12 O ATOM 631 CB GLN A 383 -39.529 8.267 -5.616 1.00 41.83 C ATOM 632 CG GLN A 383 -39.018 9.651 -5.210 1.00 49.28 C ATOM 633 CD GLN A 383 -39.673 10.749 -5.987 1.00 63.72 C ATOM 634 OE1 GLN A 383 -40.860 11.051 -5.841 1.00 67.13 O ATOM 635 NE2 GLN A 383 -38.883 11.418 -6.765 1.00 53.66 N ATOM 636 HE22 GLN A 383 -37.887 11.134 -6.864 1.00 0.00 H ATOM 637 HE21 GLN A 383 -39.244 12.239 -7.291 1.00 0.00 H ATOM 638 H GLN A 383 -40.067 5.274 -5.115 1.00 0.00 H ATOM 639 N LEU A 384 -38.560 7.669 -2.509 1.00 37.54 N ATOM 640 CA LEU A 384 -38.938 7.952 -1.132 1.00 36.64 C ATOM 641 C LEU A 384 -38.461 9.342 -0.777 1.00 39.49 C ATOM 642 O LEU A 384 -37.244 9.620 -0.762 1.00 38.92 O ATOM 643 CB LEU A 384 -38.385 6.928 -0.128 1.00 36.00 C ATOM 644 CG LEU A 384 -38.787 7.128 1.348 1.00 37.72 C ATOM 645 CD1 LEU A 384 -40.203 6.660 1.612 1.00 34.52 C ATOM 646 CD2 LEU A 384 -37.810 6.422 2.243 1.00 41.21 C ATOM 647 H LEU A 384 -37.596 7.907 -2.820 1.00 0.00 H ATOM 648 N ILE A 385 -39.416 10.217 -0.488 1.00 34.69 N ATOM 649 CA ILE A 385 -39.079 11.568 -0.013 1.00 34.09 C ATOM 650 C ILE A 385 -39.521 11.594 1.444 1.00 39.12 C ATOM 651 O ILE A 385 -40.724 11.438 1.741 1.00 38.50 O ATOM 652 CB ILE A 385 -39.712 12.699 -0.861 1.00 36.00 C ATOM 653 CG1 ILE A 385 -39.389 12.503 -2.352 1.00 36.00 C ATOM 654 CG2 ILE A 385 -39.273 14.057 -0.336 1.00 34.63 C ATOM 655 CD1 ILE A 385 -40.382 13.135 -3.253 1.00 51.06 C ATOM 656 H ILE A 385 -40.414 9.945 -0.599 1.00 0.00 H ATOM 657 N VAL A 386 -38.549 11.716 2.348 1.00 36.46 N ATOM 658 CA VAL A 386 -38.843 11.667 3.769 1.00 36.84 C ATOM 659 C VAL A 386 -38.387 12.907 4.497 1.00 40.68 C ATOM 660 O VAL A 386 -37.343 13.467 4.172 1.00 39.68 O ATOM 661 CB VAL A 386 -38.289 10.336 4.381 1.00 42.07 C ATOM 662 CG1 VAL A 386 -36.852 10.066 3.943 1.00 41.93 C ATOM 663 CG2 VAL A 386 -38.436 10.271 5.923 1.00 42.34 C ATOM 664 H VAL A 386 -37.567 11.848 2.031 1.00 0.00 H ATOM 665 N SER A 387 -39.190 13.343 5.474 1.00 39.78 N ATOM 666 CA SER A 387 -38.856 14.403 6.439 1.00 39.99 C ATOM 667 C SER A 387 -39.180 13.861 7.834 1.00 40.23 C ATOM 668 O SER A 387 -40.035 12.989 7.991 1.00 37.15 O ATOM 669 CB SER A 387 -39.622 15.693 6.162 1.00 47.40 C ATOM 670 OG SER A 387 -41.021 15.460 6.099 1.00 63.83 O ATOM 671 HG SER A 387 -41.489 16.314 5.919 1.00 0.00 H ATOM 672 H SER A 387 -40.126 12.897 5.559 1.00 0.00 H ATOM 673 N GLY A 388 -38.464 14.347 8.821 1.00 37.65 N ATOM 674 CA GLY A 388 -38.643 13.912 10.190 1.00 37.35 C ATOM 675 C GLY A 388 -37.913 14.799 11.163 1.00 43.22 C ATOM 676 O GLY A 388 -37.251 15.765 10.759 1.00 44.63 O ATOM 677 H GLY A 388 -37.744 15.068 8.613 1.00 0.00 H ATOM 678 N LYS A 389 -38.007 14.454 12.449 1.00 38.64 N ATOM 679 CA LYS A 389 -37.435 15.228 13.532 1.00 37.70 C ATOM 680 C LYS A 389 -35.921 15.316 13.519 1.00 41.28 C ATOM 681 O LYS A 389 -35.361 16.344 13.891 1.00 41.00 O ATOM 682 CB LYS A 389 -37.983 14.747 14.892 1.00 39.69 C ATOM 683 CG LYS A 389 -39.446 15.104 15.084 1.00 60.39 C ATOM 684 CD LYS A 389 -39.905 14.908 16.511 1.00 71.98 C ATOM 685 CE LYS A 389 -41.324 15.365 16.723 1.00 79.08 C ATOM 686 NZ LYS A 389 -41.613 15.568 18.161 1.00 83.08 N ATOM 687 HZ1 LYS A 389 -41.473 14.673 18.671 1.00 0.00 H ATOM 688 HZ2 LYS A 389 -40.971 16.291 18.544 1.00 0.00 H ATOM 689 HZ3 LYS A 389 -42.598 15.883 18.274 1.00 0.00 H ATOM 690 H LYS A 389 -38.519 13.581 12.687 1.00 0.00 H ATOM 691 N ASP A 390 -35.258 14.229 13.138 1.00 38.69 N ATOM 692 CA ASP A 390 -33.796 14.139 13.162 1.00 38.53 C ATOM 693 C ASP A 390 -33.322 12.952 12.368 1.00 39.39 C ATOM 694 O ASP A 390 -34.129 12.185 11.847 1.00 37.28 O ATOM 695 CB ASP A 390 -33.302 14.018 14.612 1.00 41.26 C ATOM 696 CG ASP A 390 -33.790 12.800 15.399 1.00 53.39 C ATOM 697 OD1 ASP A 390 -34.587 11.987 14.841 1.00 54.57 O ATOM 698 OD2 ASP A 390 -33.372 12.649 16.552 1.00 57.37 O ATOM 699 H ASP A 390 -35.801 13.406 12.808 1.00 0.00 H ATOM 700 N GLU A 391 -32.020 12.765 12.321 1.00 36.51 N ATOM 701 CA GLU A 391 -31.406 11.689 11.552 1.00 36.58 C ATOM 702 C GLU A 391 -31.966 10.314 11.927 1.00 41.45 C ATOM 703 O GLU A 391 -32.280 9.515 11.047 1.00 41.62 O ATOM 704 CB GLU A 391 -29.879 11.773 11.692 1.00 37.99 C ATOM 705 CG GLU A 391 -29.100 10.624 11.103 1.00 50.80 C ATOM 706 CD GLU A 391 -28.882 9.477 12.068 1.00 86.87 C ATOM 707 OE1 GLU A 391 -28.225 9.703 13.112 1.00 95.75 O ATOM 708 OE2 GLU A 391 -29.373 8.357 11.788 1.00 83.21 O ATOM 709 H GLU A 391 -31.404 13.411 12.854 1.00 0.00 H ATOM 710 N GLN A 392 -32.093 10.035 13.218 1.00 38.21 N ATOM 711 CA GLN A 392 -32.573 8.731 13.675 1.00 38.06 C ATOM 712 C GLN A 392 -34.000 8.450 13.243 1.00 42.01 C ATOM 713 O GLN A 392 -34.276 7.364 12.739 1.00 43.93 O ATOM 714 CB GLN A 392 -32.405 8.597 15.198 1.00 39.75 C ATOM 715 CG GLN A 392 -32.767 7.234 15.769 1.00 52.17 C ATOM 716 CD GLN A 392 -31.937 6.134 15.186 1.00 77.58 C ATOM 717 OE1 GLN A 392 -30.692 6.189 15.188 1.00 77.57 O ATOM 718 NE2 GLN A 392 -32.625 5.111 14.679 1.00 67.70 N ATOM 719 HE22 GLN A 392 -33.665 5.120 14.705 1.00 0.00 H ATOM 720 HE21 GLN A 392 -32.122 4.304 14.257 1.00 0.00 H ATOM 721 H GLN A 392 -31.846 10.760 13.921 1.00 0.00 H ATOM 722 N SER A 393 -34.897 9.423 13.414 1.00 36.60 N ATOM 723 CA SER A 393 -36.292 9.275 13.021 1.00 36.37 C ATOM 724 C SER A 393 -36.439 9.092 11.513 1.00 39.13 C ATOM 725 O SER A 393 -37.297 8.339 11.065 1.00 39.51 O ATOM 726 CB SER A 393 -37.082 10.490 13.493 1.00 42.90 C ATOM 727 OG SER A 393 -37.071 10.557 14.914 1.00 59.25 O ATOM 728 HG SER A 393 -36.137 10.632 15.232 1.00 0.00 H ATOM 729 H SER A 393 -34.589 10.319 13.843 1.00 0.00 H ATOM 730 N ILE A 394 -35.587 9.783 10.730 1.00 33.45 N ATOM 731 CA ILE A 394 -35.561 9.675 9.283 1.00 31.90 C ATOM 732 C ILE A 394 -35.073 8.305 8.894 1.00 34.76 C ATOM 733 O ILE A 394 -35.706 7.669 8.066 1.00 36.09 O ATOM 734 CB ILE A 394 -34.774 10.845 8.589 1.00 35.29 C ATOM 735 CG1 ILE A 394 -35.534 12.194 8.721 1.00 34.99 C ATOM 736 CG2 ILE A 394 -34.533 10.553 7.108 1.00 36.38 C ATOM 737 CD1 ILE A 394 -34.648 13.436 8.699 1.00 34.96 C ATOM 738 H ILE A 394 -34.912 10.428 11.187 1.00 0.00 H ATOM 739 N ALA A 395 -33.984 7.822 9.504 1.00 31.74 N ATOM 740 CA ALA A 395 -33.466 6.488 9.218 1.00 32.22 C ATOM 741 C ALA A 395 -34.510 5.387 9.501 1.00 37.72 C ATOM 742 O ALA A 395 -34.618 4.438 8.715 1.00 38.96 O ATOM 743 CB ALA A 395 -32.215 6.242 10.006 1.00 33.10 C ATOM 744 H ALA A 395 -33.492 8.415 10.203 1.00 0.00 H ATOM 745 N GLU A 396 -35.306 5.539 10.569 1.00 33.05 N ATOM 746 CA GLU A 396 -36.391 4.596 10.881 1.00 34.61 C ATOM 747 C GLU A 396 -37.403 4.490 9.741 1.00 41.49 C ATOM 748 O GLU A 396 -37.759 3.366 9.339 1.00 43.88 O ATOM 749 CB GLU A 396 -37.102 4.915 12.200 1.00 36.03 C ATOM 750 CG GLU A 396 -36.251 4.584 13.418 1.00 61.58 C ATOM 751 CD GLU A 396 -36.733 5.072 14.780 1.00101.07 C ATOM 752 OE1 GLU A 396 -37.875 5.581 14.875 1.00112.82 O ATOM 753 OE2 GLU A 396 -35.951 4.965 15.754 1.00 90.42 O ATOM 754 H GLU A 396 -35.151 6.352 11.199 1.00 0.00 H ATOM 755 N ALA A 397 -37.825 5.647 9.188 1.00 34.83 N ATOM 756 CA ALA A 397 -38.768 5.655 8.086 1.00 34.80 C ATOM 757 C ALA A 397 -38.146 5.016 6.851 1.00 37.47 C ATOM 758 O ALA A 397 -38.808 4.254 6.146 1.00 37.31 O ATOM 759 CB ALA A 397 -39.218 7.071 7.784 1.00 35.89 C ATOM 760 H ALA A 397 -37.467 6.550 9.559 1.00 0.00 H ATOM 761 N ILE A 398 -36.870 5.311 6.594 1.00 32.81 N ATOM 762 CA ILE A 398 -36.154 4.741 5.446 1.00 31.60 C ATOM 763 C ILE A 398 -36.120 3.193 5.539 1.00 35.81 C ATOM 764 O ILE A 398 -36.409 2.532 4.555 1.00 32.60 O ATOM 765 CB ILE A 398 -34.746 5.363 5.293 1.00 32.93 C ATOM 766 CG1 ILE A 398 -34.842 6.835 4.896 1.00 32.82 C ATOM 767 CG2 ILE A 398 -33.940 4.598 4.271 1.00 32.60 C ATOM 768 CD1 ILE A 398 -33.521 7.565 4.925 1.00 39.21 C ATOM 769 H ILE A 398 -36.367 5.965 7.227 1.00 0.00 H ATOM 770 N ILE A 399 -35.784 2.645 6.728 1.00 34.01 N ATOM 771 CA ILE A 399 -35.704 1.212 6.952 1.00 33.77 C ATOM 772 C ILE A 399 -37.063 0.579 6.690 1.00 37.64 C ATOM 773 O ILE A 399 -37.128 -0.419 5.975 1.00 38.54 O ATOM 774 CB ILE A 399 -35.186 0.898 8.380 1.00 37.10 C ATOM 775 CG1 ILE A 399 -33.701 1.306 8.515 1.00 37.41 C ATOM 776 CG2 ILE A 399 -35.395 -0.589 8.764 1.00 36.97 C ATOM 777 CD1 ILE A 399 -33.207 1.489 10.010 1.00 32.54 C ATOM 778 H ILE A 399 -35.572 3.282 7.523 1.00 0.00 H ATOM 779 N VAL A 400 -38.145 1.161 7.259 1.00 32.17 N ATOM 780 CA VAL A 400 -39.504 0.655 7.100 1.00 29.69 C ATOM 781 C VAL A 400 -39.858 0.628 5.607 1.00 37.04 C ATOM 782 O VAL A 400 -40.361 -0.379 5.111 1.00 39.18 O ATOM 783 CB VAL A 400 -40.521 1.429 7.967 1.00 32.47 C ATOM 784 CG1 VAL A 400 -41.963 1.062 7.603 1.00 32.57 C ATOM 785 CG2 VAL A 400 -40.283 1.179 9.445 1.00 31.95 C ATOM 786 H VAL A 400 -38.000 2.012 7.839 1.00 0.00 H ATOM 787 N ALA A 401 -39.500 1.677 4.877 1.00 35.17 N ATOM 788 CA ALA A 401 -39.770 1.773 3.442 1.00 35.66 C ATOM 789 C ALA A 401 -39.014 0.717 2.633 1.00 40.12 C ATOM 790 O ALA A 401 -39.597 0.053 1.793 1.00 41.48 O ATOM 791 CB ALA A 401 -39.424 3.168 2.936 1.00 36.25 C ATOM 792 H ALA A 401 -39.007 2.464 5.345 1.00 0.00 H ATOM 793 N MET A 402 -37.726 0.561 2.893 1.00 35.58 N ATOM 794 CA MET A 402 -36.873 -0.399 2.203 1.00 34.12 C ATOM 795 C MET A 402 -37.384 -1.813 2.419 1.00 38.78 C ATOM 796 O MET A 402 -37.413 -2.598 1.463 1.00 40.63 O ATOM 797 CB MET A 402 -35.420 -0.257 2.666 1.00 35.27 C ATOM 798 CG MET A 402 -34.759 0.978 2.117 1.00 37.49 C ATOM 799 SD MET A 402 -33.073 1.069 2.713 1.00 42.38 S ATOM 800 CE MET A 402 -32.455 2.466 1.801 1.00 38.10 C ATOM 801 H MET A 402 -37.298 1.156 3.631 1.00 0.00 H ATOM 802 N VAL A 403 -37.802 -2.139 3.661 1.00 31.34 N ATOM 803 CA VAL A 403 -38.373 -3.452 3.972 1.00 29.00 C ATOM 804 C VAL A 403 -39.693 -3.602 3.253 1.00 35.03 C ATOM 805 O VAL A 403 -39.906 -4.589 2.556 1.00 34.89 O ATOM 806 CB VAL A 403 -38.488 -3.716 5.491 1.00 31.21 C ATOM 807 CG1 VAL A 403 -39.304 -4.973 5.782 1.00 30.28 C ATOM 808 CG2 VAL A 403 -37.092 -3.847 6.120 1.00 30.89 C ATOM 809 H VAL A 403 -37.716 -1.435 4.422 1.00 0.00 H ATOM 810 N PHE A 404 -40.560 -2.587 3.370 1.00 31.69 N ATOM 811 CA PHE A 404 -41.886 -2.589 2.768 1.00 29.12 C ATOM 812 C PHE A 404 -41.826 -2.813 1.274 1.00 32.55 C ATOM 813 O PHE A 404 -42.672 -3.533 0.750 1.00 33.86 O ATOM 814 CB PHE A 404 -42.610 -1.285 3.133 1.00 29.90 C ATOM 815 CG PHE A 404 -44.002 -1.126 2.578 1.00 28.84 C ATOM 816 CD1 PHE A 404 -45.088 -1.715 3.211 1.00 26.96 C ATOM 817 CD2 PHE A 404 -44.217 -0.434 1.379 1.00 27.93 C ATOM 818 CE1 PHE A 404 -46.369 -1.590 2.670 1.00 28.10 C ATOM 819 CE2 PHE A 404 -45.499 -0.313 0.840 1.00 28.36 C ATOM 820 CZ PHE A 404 -46.567 -0.886 1.486 1.00 26.61 C ATOM 821 H PHE A 404 -40.270 -1.753 3.920 1.00 0.00 H ATOM 822 N SER A 405 -40.824 -2.232 0.596 1.00 29.24 N ATOM 823 CA SER A 405 -40.581 -2.338 -0.871 1.00 29.02 C ATOM 824 C SER A 405 -40.455 -3.754 -1.355 1.00 34.20 C ATOM 825 O SER A 405 -40.705 -3.982 -2.523 1.00 36.13 O ATOM 826 CB SER A 405 -39.290 -1.628 -1.278 1.00 32.72 C ATOM 827 OG SER A 405 -38.139 -2.426 -1.000 1.00 37.62 O ATOM 828 HG SER A 405 -38.098 -2.617 -0.029 1.00 0.00 H ATOM 829 H SER A 405 -40.155 -1.655 1.145 1.00 0.00 H ATOM 830 N GLN A 406 -40.021 -4.695 -0.478 1.00 29.49 N ATOM 831 CA GLN A 406 -39.790 -6.113 -0.774 1.00 27.80 C ATOM 832 C GLN A 406 -38.662 -6.290 -1.797 1.00 36.67 C ATOM 833 O GLN A 406 -38.561 -7.354 -2.399 1.00 37.00 O ATOM 834 CB GLN A 406 -41.066 -6.834 -1.214 1.00 27.20 C ATOM 835 CG GLN A 406 -42.190 -6.797 -0.182 1.00 25.19 C ATOM 836 CD GLN A 406 -43.443 -7.511 -0.640 1.00 38.34 C ATOM 837 OE1 GLN A 406 -43.912 -7.354 -1.767 1.00 36.21 O ATOM 838 NE2 GLN A 406 -44.024 -8.288 0.227 1.00 31.78 N ATOM 839 HE22 GLN A 406 -43.613 -8.409 1.175 1.00 0.00 H ATOM 840 HE21 GLN A 406 -44.899 -8.789 -0.028 1.00 0.00 H ATOM 841 H GLN A 406 -39.835 -4.381 0.496 1.00 0.00 H ATOM 842 N GLU A 407 -37.787 -5.258 -1.973 1.00 36.10 N ATOM 843 CA GLU A 407 -36.670 -5.321 -2.931 1.00 36.82 C ATOM 844 C GLU A 407 -35.753 -6.485 -2.690 1.00 45.32 C ATOM 845 O GLU A 407 -35.536 -6.856 -1.533 1.00 46.35 O ATOM 846 CB GLU A 407 -35.848 -4.033 -2.953 1.00 37.62 C ATOM 847 CG GLU A 407 -36.475 -2.948 -3.803 1.00 49.38 C ATOM 848 CD GLU A 407 -35.488 -2.078 -4.553 1.00 72.93 C ATOM 849 OE1 GLU A 407 -34.347 -2.536 -4.799 1.00 63.20 O ATOM 850 OE2 GLU A 407 -35.857 -0.931 -4.891 1.00 66.00 O ATOM 851 H GLU A 407 -37.914 -4.393 -1.409 1.00 0.00 H ATOM 852 N ASP A 408 -35.191 -7.039 -3.787 1.00 43.38 N ATOM 853 CA ASP A 408 -34.253 -8.130 -3.710 1.00 44.10 C ATOM 854 C ASP A 408 -33.010 -7.696 -2.944 1.00 50.53 C ATOM 855 O ASP A 408 -32.484 -8.491 -2.143 1.00 52.16 O ATOM 856 CB ASP A 408 -33.887 -8.662 -5.096 1.00 46.72 C ATOM 857 CG ASP A 408 -32.798 -9.726 -5.084 1.00 62.43 C ATOM 858 OD1 ASP A 408 -33.051 -10.833 -4.523 1.00 63.50 O ATOM 859 OD2 ASP A 408 -31.666 -9.433 -5.596 1.00 65.65 O ATOM 860 H ASP A 408 -35.445 -6.663 -4.723 1.00 0.00 H ATOM 861 N CYS A 409 -32.544 -6.451 -3.147 1.00 46.20 N ATOM 862 CA CYS A 409 -31.327 -6.064 -2.439 1.00 47.02 C ATOM 863 C CYS A 409 -31.519 -5.990 -0.921 1.00 47.20 C ATOM 864 O CYS A 409 -30.554 -6.182 -0.185 1.00 48.40 O ATOM 865 CB CYS A 409 -30.708 -4.801 -3.013 1.00 49.65 C ATOM 866 SG CYS A 409 -31.740 -3.344 -2.819 1.00 55.69 S ATOM 867 H CYS A 409 -33.032 -5.789 -3.784 1.00 0.00 H ATOM 868 N MET A 410 -32.768 -5.787 -0.452 1.00 37.47 N ATOM 869 CA MET A 410 -33.065 -5.771 0.966 1.00 35.55 C ATOM 870 C MET A 410 -33.053 -7.214 1.485 1.00 41.39 C ATOM 871 O MET A 410 -32.426 -7.489 2.517 1.00 38.61 O ATOM 872 CB MET A 410 -34.405 -5.044 1.227 1.00 36.79 C ATOM 873 CG MET A 410 -34.926 -5.140 2.683 1.00 38.52 C ATOM 874 SD MET A 410 -35.917 -6.613 3.046 1.00 40.55 S ATOM 875 CE MET A 410 -37.240 -6.454 1.792 1.00 35.52 C ATOM 876 H MET A 410 -33.542 -5.637 -1.130 1.00 0.00 H ATOM 877 N ILE A 411 -33.732 -8.146 0.747 1.00 40.73 N ATOM 878 CA ILE A 411 -33.748 -9.582 1.069 1.00 41.18 C ATOM 879 C ILE A 411 -32.306 -10.120 1.085 1.00 44.46 C ATOM 880 O ILE A 411 -31.909 -10.812 2.026 1.00 45.77 O ATOM 881 CB ILE A 411 -34.609 -10.392 0.069 1.00 45.29 C ATOM 882 CG1 ILE A 411 -36.071 -9.912 0.065 1.00 45.50 C ATOM 883 CG2 ILE A 411 -34.544 -11.893 0.400 1.00 48.63 C ATOM 884 CD1 ILE A 411 -36.858 -10.184 1.402 1.00 49.88 C ATOM 885 H ILE A 411 -34.265 -7.822 -0.085 1.00 0.00 H ATOM 886 N LYS A 412 -31.526 -9.775 0.053 1.00 38.37 N ATOM 887 CA LYS A 412 -30.152 -10.218 -0.061 1.00 37.66 C ATOM 888 C LYS A 412 -29.217 -9.603 0.975 1.00 44.08 C ATOM 889 O LYS A 412 -28.105 -10.096 1.144 1.00 44.36 O ATOM 890 CB LYS A 412 -29.642 -9.990 -1.486 1.00 38.93 C ATOM 891 CG LYS A 412 -30.297 -10.908 -2.527 1.00 42.09 C ATOM 892 CD LYS A 412 -29.903 -12.384 -2.381 1.00 33.19 C ATOM 893 CE LYS A 412 -30.441 -13.194 -3.525 1.00 39.00 C ATOM 894 NZ LYS A 412 -31.931 -13.209 -3.587 1.00 49.17 N ATOM 895 HZ1 LYS A 412 -32.309 -13.617 -2.708 1.00 0.00 H ATOM 896 HZ2 LYS A 412 -32.282 -12.236 -3.698 1.00 0.00 H ATOM 897 HZ3 LYS A 412 -32.237 -13.784 -4.397 1.00 0.00 H ATOM 898 H LYS A 412 -31.921 -9.167 -0.693 1.00 0.00 H ATOM 899 N ALA A 413 -29.666 -8.532 1.668 1.00 41.11 N ATOM 900 CA ALA A 413 -28.898 -7.824 2.690 1.00 40.56 C ATOM 901 C ALA A 413 -28.985 -8.530 4.011 1.00 45.15 C ATOM 902 O ALA A 413 -28.256 -8.160 4.934 1.00 45.51 O ATOM 903 CB ALA A 413 -29.356 -6.371 2.825 1.00 41.40 C ATOM 904 H ALA A 413 -30.625 -8.188 1.459 1.00 0.00 H ATOM 905 N VAL A 414 -29.880 -9.546 4.123 1.00 41.63 N ATOM 906 CA VAL A 414 -29.972 -10.392 5.309 1.00 41.45 C ATOM 907 C VAL A 414 -28.765 -11.347 5.210 1.00 52.47 C ATOM 908 O VAL A 414 -28.700 -12.163 4.297 1.00 51.62 O ATOM 909 CB VAL A 414 -31.301 -11.167 5.377 1.00 42.81 C ATOM 910 CG1 VAL A 414 -31.308 -12.117 6.580 1.00 41.33 C ATOM 911 CG2 VAL A 414 -32.485 -10.212 5.428 1.00 42.04 C ATOM 912 H VAL A 414 -30.527 -9.729 3.330 1.00 0.00 H ATOM 913 N ARG A 415 -27.822 -11.290 6.135 1.00 55.70 N ATOM 914 CA ARG A 415 -26.621 -12.097 5.966 1.00 57.86 C ATOM 915 C ARG A 415 -26.401 -13.215 6.979 1.00 66.00 C ATOM 916 O ARG A 415 -25.540 -14.058 6.793 1.00 66.84 O ATOM 917 CB ARG A 415 -25.408 -11.197 5.910 1.00 56.99 C ATOM 918 CG ARG A 415 -25.105 -10.732 4.505 1.00 58.80 C ATOM 919 CD ARG A 415 -24.564 -9.328 4.529 1.00 64.58 C ATOM 920 NE ARG A 415 -23.798 -8.988 3.344 1.00 67.12 N ATOM 921 CZ ARG A 415 -24.278 -9.023 2.112 1.00 81.36 C ATOM 922 NH1 ARG A 415 -25.523 -9.405 1.898 1.00 57.96 N ATOM 923 NH2 ARG A 415 -23.505 -8.685 1.089 1.00 77.12 N ATOM 924 HE ARG A 415 -22.807 -8.698 3.472 1.00 0.00 H ATOM 925 HH12 ARG A 415 -25.899 -9.432 0.929 1.00 0.00 H ATOM 926 HH11 ARG A 415 -26.128 -9.679 2.699 1.00 0.00 H ATOM 927 HH22 ARG A 415 -23.883 -8.713 0.120 1.00 0.00 H ATOM 928 HH21 ARG A 415 -22.521 -8.392 1.255 1.00 0.00 H ATOM 929 H ARG A 415 -27.936 -10.679 6.969 1.00 0.00 H ATOM 930 N GLY A 416 -27.186 -13.219 8.037 1.00 62.82 N ATOM 931 CA GLY A 416 -27.228 -14.324 8.976 1.00 63.28 C ATOM 932 C GLY A 416 -28.575 -15.014 8.927 1.00 69.07 C ATOM 933 O GLY A 416 -29.377 -14.792 8.017 1.00 70.22 O ATOM 934 H GLY A 416 -27.800 -12.397 8.206 1.00 0.00 H ATOM 935 N ASP A 417 -28.850 -15.822 9.924 1.00 65.65 N ATOM 936 CA ASP A 417 -30.092 -16.565 10.003 1.00 65.36 C ATOM 937 C ASP A 417 -31.219 -15.682 10.470 1.00 66.32 C ATOM 938 O ASP A 417 -31.023 -14.842 11.345 1.00 65.89 O ATOM 939 CB ASP A 417 -29.920 -17.747 10.990 1.00 68.49 C ATOM 940 CG ASP A 417 -31.156 -18.617 11.172 1.00 88.21 C ATOM 941 OD1 ASP A 417 -31.713 -19.088 10.144 1.00 89.34 O ATOM 942 OD2 ASP A 417 -31.549 -18.860 12.350 1.00 98.30 O ATOM 943 H ASP A 417 -28.151 -15.933 10.686 1.00 0.00 H ATOM 944 N LEU A 418 -32.406 -15.884 9.901 1.00 61.20 N ATOM 945 CA LEU A 418 -33.617 -15.244 10.373 1.00 60.35 C ATOM 946 C LEU A 418 -34.331 -16.295 11.184 1.00 67.32 C ATOM 947 O LEU A 418 -35.021 -17.154 10.616 1.00 68.50 O ATOM 948 CB LEU A 418 -34.513 -14.742 9.238 1.00 59.48 C ATOM 949 CG LEU A 418 -34.095 -13.448 8.577 1.00 63.15 C ATOM 950 CD1 LEU A 418 -35.089 -13.064 7.515 1.00 62.72 C ATOM 951 CD2 LEU A 418 -33.901 -12.317 9.588 1.00 63.88 C ATOM 952 H LEU A 418 -32.466 -16.527 9.086 1.00 0.00 H ATOM 953 N ASN A 419 -34.137 -16.247 12.509 1.00 64.92 N ATOM 954 CA ASN A 419 -34.695 -17.230 13.432 1.00 66.14 C ATOM 955 C ASN A 419 -36.225 -17.245 13.503 1.00 71.34 C ATOM 956 O ASN A 419 -36.822 -16.297 13.998 1.00 71.29 O ATOM 957 CB ASN A 419 -34.066 -17.062 14.821 1.00 68.75 C ATOM 958 CG ASN A 419 -34.268 -18.218 15.773 1.00 88.40 C ATOM 959 OD1 ASN A 419 -35.209 -19.018 15.681 1.00 78.87 O ATOM 960 ND2 ASN A 419 -33.411 -18.274 16.764 1.00 82.07 N ATOM 961 HD22 ASN A 419 -32.630 -17.589 16.816 1.00 0.00 H ATOM 962 HD21 ASN A 419 -33.512 -19.004 17.498 1.00 0.00 H ATOM 963 H ASN A 419 -33.562 -15.473 12.898 1.00 0.00 H ATOM 964 N PHE A 420 -36.847 -18.315 13.013 1.00 69.03 N ATOM 965 CA PHE A 420 -38.299 -18.495 13.091 1.00 70.37 C ATOM 966 C PHE A 420 -38.610 -19.590 14.126 1.00 76.18 C ATOM 967 O PHE A 420 -39.778 -19.872 14.434 1.00 74.97 O ATOM 968 CB PHE A 420 -38.860 -18.918 11.729 1.00 72.90 C ATOM 969 CG PHE A 420 -39.009 -17.780 10.762 1.00 75.93 C ATOM 970 CD1 PHE A 420 -40.150 -16.978 10.776 1.00 79.86 C ATOM 971 CD2 PHE A 420 -38.009 -17.500 9.833 1.00 78.56 C ATOM 972 CE1 PHE A 420 -40.293 -15.926 9.869 1.00 80.47 C ATOM 973 CE2 PHE A 420 -38.145 -16.439 8.939 1.00 81.63 C ATOM 974 CZ PHE A 420 -39.287 -15.661 8.961 1.00 79.98 C ATOM 975 H PHE A 420 -36.278 -19.055 12.555 1.00 0.00 H ATOM 976 N VAL A 421 -37.545 -20.220 14.633 1.00 74.25 N ATOM 977 CA VAL A 421 -37.618 -21.319 15.570 1.00 74.75 C ATOM 978 C VAL A 421 -37.978 -20.870 17.002 1.00 83.83 C ATOM 979 O VAL A 421 -38.919 -21.426 17.587 1.00 83.86 O ATOM 980 CB VAL A 421 -36.329 -22.152 15.483 1.00 76.81 C ATOM 981 CG1 VAL A 421 -36.123 -23.025 16.713 1.00 76.40 C ATOM 982 CG2 VAL A 421 -36.337 -22.992 14.224 1.00 76.15 C ATOM 983 H VAL A 421 -36.602 -19.898 14.334 1.00 0.00 H ATOM 984 N ASN A 422 -37.250 -19.865 17.543 1.00 82.12 N ATOM 985 CA ASN A 422 -37.428 -19.391 18.913 1.00 83.12 C ATOM 986 C ASN A 422 -38.841 -18.919 19.278 1.00 91.73 C ATOM 987 O ASN A 422 -39.546 -18.333 18.445 1.00 91.33 O ATOM 988 CB ASN A 422 -36.353 -18.379 19.311 1.00 80.43 C ATOM 989 H ASN A 422 -36.527 -19.407 16.953 1.00 0.00 H ATOM 990 N ARG A 423 -39.241 -19.191 20.539 1.00 91.18 N ATOM 991 CA ARG A 423 -40.549 -18.881 21.112 1.00 92.05 C ATOM 992 C ARG A 423 -41.056 -17.481 20.779 1.00 97.52 C ATOM 993 O ARG A 423 -42.226 -17.330 20.423 1.00 98.08 O ATOM 994 CB ARG A 423 -40.513 -19.093 22.629 1.00 94.15 C ATOM 995 CG ARG A 423 -41.849 -18.839 23.279 1.00107.87 C ATOM 996 CD ARG A 423 -42.442 -20.083 23.865 1.00119.76 C ATOM 997 NE ARG A 423 -42.384 -20.026 25.325 1.00128.09 N ATOM 998 CZ ARG A 423 -42.881 -20.952 26.137 1.00141.18 C ATOM 999 NH1 ARG A 423 -43.473 -22.030 25.641 1.00127.09 N ATOM 1000 NH2 ARG A 423 -42.785 -20.810 27.452 1.00128.99 N ATOM 1001 HE ARG A 423 -41.921 -19.202 25.758 1.00 0.00 H ATOM 1002 HH12 ARG A 423 -43.860 -22.752 26.282 1.00 0.00 H ATOM 1003 HH11 ARG A 423 -43.550 -22.154 24.611 1.00 0.00 H ATOM 1004 HH22 ARG A 423 -43.176 -21.538 28.084 1.00 0.00 H ATOM 1005 HH21 ARG A 423 -42.319 -19.971 27.852 1.00 0.00 H ATOM 1006 H ARG A 423 -38.554 -19.665 21.160 1.00 0.00 H ATOM 1007 N ALA A 424 -40.169 -16.473 20.879 1.00 94.35 N ATOM 1008 CA ALA A 424 -40.468 -15.049 20.665 1.00 93.94 C ATOM 1009 C ALA A 424 -40.719 -14.591 19.217 1.00 96.16 C ATOM 1010 O ALA A 424 -41.263 -13.506 19.014 1.00 94.52 O ATOM 1011 CB ALA A 424 -39.385 -14.200 21.308 1.00 94.65 C ATOM 1012 H ALA A 424 -39.191 -16.722 21.128 1.00 0.00 H ATOM 1013 N ASN A 425 -40.348 -15.413 18.220 1.00 93.57 N ATOM 1014 CA ASN A 425 -40.480 -15.066 16.790 1.00 93.44 C ATOM 1015 C ASN A 425 -41.618 -15.785 16.054 1.00 97.14 C ATOM 1016 O ASN A 425 -41.783 -15.609 14.844 1.00 95.11 O ATOM 1017 CB ASN A 425 -39.138 -15.277 16.069 1.00 90.53 C ATOM 1018 CG ASN A 425 -37.970 -14.552 16.707 1.00 90.36 C ATOM 1019 OD1 ASN A 425 -38.116 -13.513 17.354 1.00 89.14 O ATOM 1020 ND2 ASN A 425 -36.781 -15.088 16.543 1.00 70.60 N ATOM 1021 HD22 ASN A 425 -36.677 -15.965 15.994 1.00 0.00 H ATOM 1022 HD21 ASN A 425 -35.944 -14.635 16.962 1.00 0.00 H ATOM 1023 H ASN A 425 -39.948 -16.340 18.468 1.00 0.00 H ATOM 1024 N GLN A 426 -42.408 -16.574 16.800 1.00 95.29 N ATOM 1025 CA GLN A 426 -43.523 -17.381 16.299 1.00 95.17 C ATOM 1026 C GLN A 426 -44.642 -16.554 15.670 1.00 98.08 C ATOM 1027 O GLN A 426 -45.189 -16.939 14.629 1.00 98.12 O ATOM 1028 CB GLN A 426 -44.066 -18.288 17.416 1.00 96.66 C ATOM 1029 CG GLN A 426 -43.097 -19.406 17.838 1.00113.04 C ATOM 1030 CD GLN A 426 -43.164 -20.671 16.998 1.00133.24 C ATOM 1031 OE1 GLN A 426 -43.831 -20.623 15.845 1.00124.19 O ATOM 1032 NE2 GLN A 426 -42.621 -21.716 17.381 1.00130.64 N ATOM 1033 HE22 GLN A 426 -42.105 -21.733 18.284 1.00 0.00 H ATOM 1034 HE21 GLN A 426 -42.681 -22.576 16.800 1.00 0.00 H ATOM 1035 H GLN A 426 -42.211 -16.616 17.820 1.00 0.00 H ATOM 1036 N ARG A 427 -44.924 -15.417 16.286 1.00 92.98 N ATOM 1037 CA ARG A 427 -46.004 -14.537 15.876 1.00 91.46 C ATOM 1038 C ARG A 427 -45.543 -13.548 14.800 1.00 89.08 C ATOM 1039 O ARG A 427 -46.299 -12.684 14.371 1.00 88.89 O ATOM 1040 CB ARG A 427 -46.522 -13.798 17.118 1.00 93.50 C ATOM 1041 CG ARG A 427 -47.357 -12.557 16.855 1.00107.11 C ATOM 1042 CD ARG A 427 -46.508 -11.304 16.717 1.00118.64 C ATOM 1043 NE ARG A 427 -47.224 -10.257 15.989 1.00125.14 N ATOM 1044 CZ ARG A 427 -46.657 -9.166 15.483 1.00133.84 C ATOM 1045 NH1 ARG A 427 -45.355 -8.966 15.614 1.00123.20 N ATOM 1046 NH2 ARG A 427 -47.395 -8.273 14.843 1.00108.97 N ATOM 1047 HE ARG A 427 -48.249 -10.374 15.858 1.00 0.00 H ATOM 1048 HH12 ARG A 427 -44.918 -8.111 15.216 1.00 0.00 H ATOM 1049 HH11 ARG A 427 -44.769 -9.664 16.115 1.00 0.00 H ATOM 1050 HH22 ARG A 427 -46.952 -7.420 14.447 1.00 0.00 H ATOM 1051 HH21 ARG A 427 -48.418 -8.425 14.736 1.00 0.00 H ATOM 1052 H ARG A 427 -44.344 -15.140 17.104 1.00 0.00 H ATOM 1053 N LEU A 428 -44.306 -13.696 14.345 1.00 79.23 N ATOM 1054 CA LEU A 428 -43.720 -12.755 13.407 1.00 75.30 C ATOM 1055 C LEU A 428 -43.802 -13.310 12.005 1.00 70.94 C ATOM 1056 O LEU A 428 -43.202 -14.333 11.710 1.00 70.03 O ATOM 1057 CB LEU A 428 -42.260 -12.492 13.755 1.00 74.94 C ATOM 1058 CG LEU A 428 -41.936 -11.294 14.637 1.00 78.76 C ATOM 1059 CD1 LEU A 428 -40.462 -10.975 14.495 1.00 77.89 C ATOM 1060 CD2 LEU A 428 -42.789 -10.086 14.300 1.00 80.50 C ATOM 1061 H LEU A 428 -43.741 -14.507 14.668 1.00 0.00 H ATOM 1062 N ASN A 429 -44.546 -12.630 11.145 1.00 61.21 N ATOM 1063 CA ASN A 429 -44.605 -12.994 9.748 1.00 57.00 C ATOM 1064 C ASN A 429 -43.293 -12.596 9.111 1.00 54.69 C ATOM 1065 O ASN A 429 -42.572 -11.783 9.650 1.00 52.77 O ATOM 1066 CB ASN A 429 -45.807 -12.336 9.065 1.00 55.97 C ATOM 1067 CG ASN A 429 -45.542 -10.910 8.628 1.00 78.49 C ATOM 1068 OD1 ASN A 429 -44.647 -10.246 9.128 1.00 65.02 O ATOM 1069 ND2 ASN A 429 -46.322 -10.441 7.684 1.00 75.45 N ATOM 1070 HD22 ASN A 429 -47.073 -11.040 7.285 1.00 0.00 H ATOM 1071 HD21 ASN A 429 -46.190 -9.470 7.335 1.00 0.00 H ATOM 1072 H ASN A 429 -45.099 -11.817 11.483 1.00 0.00 H ATOM 1073 N PRO A 430 -42.965 -13.169 7.973 1.00 49.40 N ATOM 1074 CA PRO A 430 -41.659 -12.830 7.368 1.00 47.50 C ATOM 1075 C PRO A 430 -41.346 -11.338 7.254 1.00 46.43 C ATOM 1076 O PRO A 430 -40.210 -10.948 7.526 1.00 46.12 O ATOM 1077 CB PRO A 430 -41.702 -13.506 5.991 1.00 49.67 C ATOM 1078 CG PRO A 430 -43.119 -13.948 5.799 1.00 55.73 C ATOM 1079 CD PRO A 430 -43.721 -14.126 7.139 1.00 51.27 C ATOM 1080 N MET A 431 -42.306 -10.532 6.857 1.00 39.05 N ATOM 1081 CA MET A 431 -42.052 -9.125 6.652 1.00 37.08 C ATOM 1082 C MET A 431 -41.694 -8.473 7.958 1.00 44.54 C ATOM 1083 O MET A 431 -40.901 -7.560 8.008 1.00 44.44 O ATOM 1084 CB MET A 431 -43.274 -8.440 6.067 1.00 38.01 C ATOM 1085 CG MET A 431 -43.590 -8.854 4.659 1.00 39.03 C ATOM 1086 SD MET A 431 -42.218 -8.573 3.565 1.00 41.20 S ATOM 1087 CE MET A 431 -42.023 -6.829 3.767 1.00 37.71 C ATOM 1088 H MET A 431 -43.259 -10.912 6.689 1.00 0.00 H ATOM 1089 N HIS A 432 -42.298 -8.954 9.024 1.00 42.30 N ATOM 1090 CA HIS A 432 -42.062 -8.393 10.330 1.00 43.27 C ATOM 1091 C HIS A 432 -40.759 -8.892 10.892 1.00 45.94 C ATOM 1092 O HIS A 432 -40.176 -8.272 11.744 1.00 46.48 O ATOM 1093 CB HIS A 432 -43.196 -8.760 11.258 1.00 46.36 C ATOM 1094 CG HIS A 432 -44.271 -7.726 11.333 1.00 51.86 C ATOM 1095 ND1 HIS A 432 -45.492 -7.878 10.720 1.00 54.19 N ATOM 1096 CD2 HIS A 432 -44.311 -6.528 11.957 1.00 54.48 C ATOM 1097 CE1 HIS A 432 -46.239 -6.820 10.963 1.00 54.12 C ATOM 1098 NE2 HIS A 432 -45.545 -5.985 11.712 1.00 54.70 N ATOM 1099 H HIS A 432 -42.957 -9.752 8.922 1.00 0.00 H ATOM 1100 N GLN A 433 -40.297 -10.020 10.393 1.00 41.90 N ATOM 1101 CA GLN A 433 -39.042 -10.573 10.834 1.00 41.32 C ATOM 1102 C GLN A 433 -37.927 -9.841 10.153 1.00 42.99 C ATOM 1103 O GLN A 433 -36.903 -9.565 10.751 1.00 42.55 O ATOM 1104 CB GLN A 433 -38.969 -12.049 10.489 1.00 43.71 C ATOM 1105 CG GLN A 433 -39.564 -12.945 11.549 1.00 73.98 C ATOM 1106 CD GLN A 433 -38.952 -12.699 12.900 1.00 95.55 C ATOM 1107 OE1 GLN A 433 -39.551 -12.058 13.765 1.00 91.29 O ATOM 1108 NE2 GLN A 433 -37.743 -13.199 13.089 1.00 90.93 N ATOM 1109 HE22 GLN A 433 -37.277 -13.734 12.329 1.00 0.00 H ATOM 1110 HE21 GLN A 433 -37.258 -13.058 13.998 1.00 0.00 H ATOM 1111 H GLN A 433 -40.848 -10.521 9.667 1.00 0.00 H ATOM 1112 N LEU A 434 -38.132 -9.534 8.884 1.00 37.06 N ATOM 1113 CA LEU A 434 -37.195 -8.714 8.131 1.00 35.82 C ATOM 1114 C LEU A 434 -37.069 -7.369 8.770 1.00 35.40 C ATOM 1115 O LEU A 434 -35.966 -6.894 8.943 1.00 34.69 O ATOM 1116 CB LEU A 434 -37.665 -8.565 6.687 1.00 36.76 C ATOM 1117 CG LEU A 434 -37.561 -9.843 5.845 1.00 40.84 C ATOM 1118 CD1 LEU A 434 -38.411 -9.754 4.628 1.00 39.38 C ATOM 1119 CD2 LEU A 434 -36.127 -10.108 5.471 1.00 43.68 C ATOM 1120 H LEU A 434 -38.987 -9.889 8.410 1.00 0.00 H ATOM 1121 N LEU A 435 -38.182 -6.770 9.160 1.00 33.53 N ATOM 1122 CA LEU A 435 -38.169 -5.460 9.795 1.00 35.16 C ATOM 1123 C LEU A 435 -37.353 -5.452 11.085 1.00 40.25 C ATOM 1124 O LEU A 435 -36.450 -4.626 11.224 1.00 42.05 O ATOM 1125 CB LEU A 435 -39.593 -4.920 10.018 1.00 35.23 C ATOM 1126 CG LEU A 435 -39.680 -3.518 10.614 1.00 37.97 C ATOM 1127 CD1 LEU A 435 -39.110 -2.451 9.671 1.00 37.05 C ATOM 1128 CD2 LEU A 435 -41.094 -3.230 11.010 1.00 34.85 C ATOM 1129 H LEU A 435 -39.093 -7.249 9.009 1.00 0.00 H ATOM 1130 N ARG A 436 -37.634 -6.390 11.994 1.00 35.96 N ATOM 1131 CA ARG A 436 -36.906 -6.542 13.257 1.00 35.57 C ATOM 1132 C ARG A 436 -35.432 -6.709 13.019 1.00 40.01 C ATOM 1133 O ARG A 436 -34.650 -6.062 13.710 1.00 39.84 O ATOM 1134 CB ARG A 436 -37.442 -7.721 14.049 1.00 38.81 C ATOM 1135 CG ARG A 436 -36.592 -8.120 15.261 1.00 52.30 C ATOM 1136 CD ARG A 436 -37.086 -9.417 15.886 1.00 66.96 C ATOM 1137 NE ARG A 436 -36.319 -9.750 17.081 1.00 86.66 N ATOM 1138 CZ ARG A 436 -35.427 -10.733 17.152 1.00118.56 C ATOM 1139 NH1 ARG A 436 -35.188 -11.500 16.096 1.00117.90 N ATOM 1140 NH2 ARG A 436 -34.763 -10.956 18.280 1.00109.29 N ATOM 1141 HE ARG A 436 -36.481 -9.180 17.935 1.00 0.00 H ATOM 1142 HH12 ARG A 436 -34.489 -12.267 16.158 1.00 0.00 H ATOM 1143 HH11 ARG A 436 -35.700 -11.334 15.206 1.00 0.00 H ATOM 1144 HH22 ARG A 436 -34.066 -11.727 18.330 1.00 0.00 H ATOM 1145 HH21 ARG A 436 -34.940 -10.360 19.114 1.00 0.00 H ATOM 1146 H ARG A 436 -38.413 -7.049 11.794 1.00 0.00 H ATOM 1147 N HIS A 437 -35.046 -7.552 12.024 1.00 37.45 N ATOM 1148 CA HIS A 437 -33.652 -7.755 11.658 1.00 37.43 C ATOM 1149 C HIS A 437 -32.974 -6.429 11.313 1.00 43.50 C ATOM 1150 O HIS A 437 -31.926 -6.158 11.871 1.00 45.33 O ATOM 1151 CB HIS A 437 -33.533 -8.733 10.475 1.00 38.45 C ATOM 1152 CG HIS A 437 -32.116 -9.026 10.063 1.00 42.09 C ATOM 1153 ND1 HIS A 437 -31.547 -8.438 8.942 1.00 44.24 N ATOM 1154 CD2 HIS A 437 -31.183 -9.797 10.665 1.00 43.72 C ATOM 1155 CE1 HIS A 437 -30.292 -8.881 8.891 1.00 43.78 C ATOM 1156 NE2 HIS A 437 -30.022 -9.693 9.905 1.00 43.63 N ATOM 1157 H HIS A 437 -35.779 -8.074 11.502 1.00 0.00 H ATOM 1158 N PHE A 438 -33.566 -5.601 10.420 1.00 39.82 N ATOM 1159 CA PHE A 438 -32.930 -4.362 9.984 1.00 38.65 C ATOM 1160 C PHE A 438 -32.973 -3.252 10.967 1.00 42.77 C ATOM 1161 O PHE A 438 -32.036 -2.445 11.000 1.00 41.06 O ATOM 1162 CB PHE A 438 -33.379 -3.931 8.595 1.00 39.78 C ATOM 1163 CG PHE A 438 -32.946 -4.897 7.523 1.00 40.93 C ATOM 1164 CD1 PHE A 438 -31.594 -5.083 7.231 1.00 43.70 C ATOM 1165 CD2 PHE A 438 -33.880 -5.634 6.812 1.00 42.26 C ATOM 1166 CE1 PHE A 438 -31.188 -5.987 6.235 1.00 43.93 C ATOM 1167 CE2 PHE A 438 -33.473 -6.522 5.807 1.00 45.44 C ATOM 1168 CZ PHE A 438 -32.124 -6.708 5.542 1.00 42.90 C ATOM 1169 H PHE A 438 -34.498 -5.855 10.035 1.00 0.00 H ATOM 1170 N GLN A 439 -34.027 -3.229 11.815 1.00 40.20 N ATOM 1171 CA GLN A 439 -34.150 -2.232 12.895 1.00 40.04 C ATOM 1172 C GLN A 439 -33.033 -2.409 13.929 1.00 45.05 C ATOM 1173 O GLN A 439 -32.543 -1.413 14.457 1.00 44.56 O ATOM 1174 CB GLN A 439 -35.537 -2.259 13.542 1.00 41.05 C ATOM 1175 CG GLN A 439 -36.605 -1.727 12.609 1.00 45.16 C ATOM 1176 CD GLN A 439 -37.982 -1.528 13.220 1.00 69.48 C ATOM 1177 OE1 GLN A 439 -38.495 -2.333 14.031 1.00 51.74 O ATOM 1178 NE2 GLN A 439 -38.651 -0.460 12.769 1.00 73.29 N ATOM 1179 HE22 GLN A 439 -38.198 0.191 12.096 1.00 0.00 H ATOM 1180 HE21 GLN A 439 -39.623 -0.281 13.092 1.00 0.00 H ATOM 1181 H GLN A 439 -34.778 -3.940 11.701 1.00 0.00 H ATOM 1182 N LYS A 440 -32.563 -3.669 14.140 1.00 42.94 N ATOM 1183 CA LYS A 440 -31.430 -3.988 15.021 1.00 42.31 C ATOM 1184 C LYS A 440 -30.128 -3.410 14.474 1.00 51.59 C ATOM 1185 O LYS A 440 -29.325 -2.899 15.255 1.00 53.12 O ATOM 1186 CB LYS A 440 -31.278 -5.487 15.209 1.00 41.91 C ATOM 1187 CG LYS A 440 -32.212 -6.038 16.247 1.00 43.65 C ATOM 1188 CD LYS A 440 -31.880 -7.463 16.583 1.00 50.20 C ATOM 1189 CE LYS A 440 -32.660 -8.442 15.746 1.00 69.50 C ATOM 1190 NZ LYS A 440 -32.504 -9.828 16.255 1.00 77.07 N ATOM 1191 HZ1 LYS A 440 -31.499 -10.095 16.228 1.00 0.00 H ATOM 1192 HZ2 LYS A 440 -32.851 -9.878 17.234 1.00 0.00 H ATOM 1193 HZ3 LYS A 440 -33.053 -10.479 15.658 1.00 0.00 H ATOM 1194 H LYS A 440 -33.034 -4.454 13.648 1.00 0.00 H ATOM 1195 N ASP A 441 -29.904 -3.505 13.145 1.00 49.58 N ATOM 1196 CA ASP A 441 -28.718 -2.957 12.487 1.00 50.22 C ATOM 1197 C ASP A 441 -28.936 -2.833 10.997 1.00 52.39 C ATOM 1198 O ASP A 441 -29.001 -3.844 10.297 1.00 53.42 O ATOM 1199 CB ASP A 441 -27.447 -3.760 12.797 1.00 53.50 C ATOM 1200 CG ASP A 441 -26.162 -3.005 12.507 1.00 73.81 C ATOM 1201 OD1 ASP A 441 -26.049 -2.436 11.412 1.00 72.89 O ATOM 1202 OD2 ASP A 441 -25.266 -2.990 13.387 1.00 87.99 O ATOM 1203 H ASP A 441 -30.611 -3.993 12.559 1.00 0.00 H ATOM 1204 N ALA A 442 -29.029 -1.593 10.515 1.00 45.38 N ATOM 1205 CA ALA A 442 -29.315 -1.327 9.118 1.00 44.79 C ATOM 1206 C ALA A 442 -28.087 -1.025 8.269 1.00 51.22 C ATOM 1207 O ALA A 442 -28.238 -0.624 7.106 1.00 50.69 O ATOM 1208 CB ALA A 442 -30.308 -0.196 9.010 1.00 45.06 C ATOM 1209 H ALA A 442 -28.892 -0.790 11.162 1.00 0.00 H ATOM 1210 N LYS A 443 -26.875 -1.207 8.832 1.00 48.67 N ATOM 1211 CA LYS A 443 -25.612 -0.944 8.133 1.00 48.68 C ATOM 1212 C LYS A 443 -25.511 -1.667 6.802 1.00 52.48 C ATOM 1213 O LYS A 443 -25.292 -1.018 5.778 1.00 53.92 O ATOM 1214 CB LYS A 443 -24.393 -1.290 9.005 1.00 53.07 C ATOM 1215 CG LYS A 443 -24.031 -0.246 10.061 1.00 76.83 C ATOM 1216 CD LYS A 443 -22.602 -0.428 10.607 1.00 88.45 C ATOM 1217 CE LYS A 443 -21.515 -0.078 9.582 1.00 98.97 C ATOM 1218 NZ LYS A 443 -20.287 0.517 10.192 1.00104.14 N ATOM 1219 HZ1 LYS A 443 -20.539 1.394 10.690 1.00 0.00 H ATOM 1220 HZ2 LYS A 443 -19.874 -0.159 10.866 1.00 0.00 H ATOM 1221 HZ3 LYS A 443 -19.597 0.728 9.443 1.00 0.00 H ATOM 1222 H LYS A 443 -26.833 -1.552 9.812 1.00 0.00 H ATOM 1223 N VAL A 444 -25.682 -2.997 6.794 1.00 46.90 N ATOM 1224 CA VAL A 444 -25.571 -3.741 5.540 1.00 46.17 C ATOM 1225 C VAL A 444 -26.714 -3.436 4.606 1.00 50.19 C ATOM 1226 O VAL A 444 -26.497 -3.354 3.406 1.00 51.13 O ATOM 1227 CB VAL A 444 -25.128 -5.243 5.668 1.00 50.26 C ATOM 1228 CG1 VAL A 444 -25.344 -5.782 7.083 1.00 50.41 C ATOM 1229 CG2 VAL A 444 -25.776 -6.153 4.628 1.00 49.66 C ATOM 1230 H VAL A 444 -25.894 -3.499 7.680 1.00 0.00 H ATOM 1231 N LEU A 445 -27.911 -3.184 5.152 1.00 47.48 N ATOM 1232 CA LEU A 445 -29.061 -2.770 4.343 1.00 46.72 C ATOM 1233 C LEU A 445 -28.717 -1.502 3.577 1.00 49.53 C ATOM 1234 O LEU A 445 -28.847 -1.482 2.350 1.00 48.49 O ATOM 1235 CB LEU A 445 -30.308 -2.531 5.208 1.00 46.53 C ATOM 1236 CG LEU A 445 -31.561 -1.976 4.486 1.00 51.05 C ATOM 1237 CD1 LEU A 445 -32.069 -2.912 3.374 1.00 49.67 C ATOM 1238 CD2 LEU A 445 -32.664 -1.714 5.473 1.00 55.03 C ATOM 1239 H LEU A 445 -28.028 -3.285 6.180 1.00 0.00 H ATOM 1240 N PHE A 446 -28.237 -0.467 4.292 1.00 46.59 N ATOM 1241 CA PHE A 446 -27.912 0.820 3.670 1.00 46.66 C ATOM 1242 C PHE A 446 -26.731 0.739 2.696 1.00 53.59 C ATOM 1243 O PHE A 446 -26.800 1.306 1.597 1.00 52.22 O ATOM 1244 CB PHE A 446 -27.729 1.919 4.715 1.00 47.23 C ATOM 1245 CG PHE A 446 -28.991 2.434 5.377 1.00 48.07 C ATOM 1246 CD1 PHE A 446 -30.226 1.840 5.132 1.00 50.05 C ATOM 1247 CD2 PHE A 446 -28.943 3.512 6.261 1.00 50.00 C ATOM 1248 CE1 PHE A 446 -31.381 2.296 5.780 1.00 50.21 C ATOM 1249 CE2 PHE A 446 -30.106 3.984 6.888 1.00 51.45 C ATOM 1250 CZ PHE A 446 -31.315 3.370 6.645 1.00 48.64 C ATOM 1251 H PHE A 446 -28.093 -0.584 5.315 1.00 0.00 H ATOM 1252 N GLN A 447 -25.688 -0.024 3.075 1.00 51.67 N ATOM 1253 CA GLN A 447 -24.498 -0.200 2.252 1.00 52.16 C ATOM 1254 C GLN A 447 -24.733 -0.990 0.973 1.00 58.31 C ATOM 1255 O GLN A 447 -24.013 -0.790 -0.010 1.00 60.20 O ATOM 1256 CB GLN A 447 -23.374 -0.815 3.056 1.00 53.35 C ATOM 1257 CG GLN A 447 -22.770 0.158 4.067 1.00 77.81 C ATOM 1258 CD GLN A 447 -21.686 -0.464 4.916 1.00111.74 C ATOM 1259 OE1 GLN A 447 -21.145 -1.537 4.609 1.00111.66 O ATOM 1260 NE2 GLN A 447 -21.338 0.202 6.009 1.00106.49 N ATOM 1261 HE22 GLN A 447 -21.808 1.100 6.243 1.00 0.00 H ATOM 1262 HE21 GLN A 447 -20.595 -0.174 6.632 1.00 0.00 H ATOM 1263 H GLN A 447 -25.734 -0.508 3.994 1.00 0.00 H ATOM 1264 N ASN A 448 -25.745 -1.852 0.962 1.00 53.20 N ATOM 1265 CA ASN A 448 -26.029 -2.679 -0.197 1.00 52.53 C ATOM 1266 C ASN A 448 -27.162 -2.204 -1.067 1.00 54.98 C ATOM 1267 O ASN A 448 -27.407 -2.777 -2.130 1.00 57.25 O ATOM 1268 CB ASN A 448 -26.214 -4.120 0.226 1.00 55.55 C ATOM 1269 CG ASN A 448 -24.882 -4.784 0.445 1.00102.65 C ATOM 1270 OD1 ASN A 448 -24.474 -4.904 1.704 1.00108.58 O ATOM 1271 ND2 ASN A 448 -24.172 -5.132 -0.514 1.00 94.23 N ATOM 1272 HD22 ASN A 448 -24.523 -5.024 -1.487 1.00 0.00 H ATOM 1273 HD21 ASN A 448 -23.227 -5.531 -0.343 1.00 0.00 H ATOM 1274 H ASN A 448 -26.348 -1.936 1.805 1.00 0.00 H ATOM 1275 N TRP A 449 -27.838 -1.150 -0.644 1.00 47.16 N ATOM 1276 CA TRP A 449 -28.982 -0.619 -1.378 1.00 44.26 C ATOM 1277 C TRP A 449 -28.533 0.021 -2.701 1.00 51.71 C ATOM 1278 O TRP A 449 -29.218 -0.112 -3.730 1.00 51.60 O ATOM 1279 CB TRP A 449 -29.743 0.387 -0.484 1.00 39.63 C ATOM 1280 CG TRP A 449 -30.974 0.935 -1.124 1.00 37.97 C ATOM 1281 CD1 TRP A 449 -31.075 2.095 -1.833 1.00 40.66 C ATOM 1282 CD2 TRP A 449 -32.277 0.329 -1.151 1.00 36.17 C ATOM 1283 NE1 TRP A 449 -32.373 2.274 -2.262 1.00 39.01 N ATOM 1284 CE2 TRP A 449 -33.131 1.206 -1.856 1.00 39.66 C ATOM 1285 CE3 TRP A 449 -32.814 -0.853 -0.620 1.00 36.87 C ATOM 1286 CZ2 TRP A 449 -34.490 0.936 -2.052 1.00 39.04 C ATOM 1287 CZ3 TRP A 449 -34.162 -1.123 -0.810 1.00 38.90 C ATOM 1288 CH2 TRP A 449 -34.990 -0.229 -1.508 1.00 39.62 C ATOM 1289 HE1 TRP A 449 -32.721 3.089 -2.806 1.00 0.00 H ATOM 1290 H TRP A 449 -27.546 -0.685 0.239 1.00 0.00 H ATOM 1291 N GLY A 450 -27.390 0.703 -2.639 1.00 51.34 N ATOM 1292 CA GLY A 450 -26.798 1.389 -3.772 1.00 53.63 C ATOM 1293 C GLY A 450 -26.926 2.897 -3.716 1.00 64.59 C ATOM 1294 O GLY A 450 -27.885 3.436 -3.140 1.00 66.06 O ATOM 1295 H GLY A 450 -26.894 0.746 -1.726 1.00 0.00 H ATOM 1296 N ILE A 451 -25.959 3.588 -4.347 1.00 62.89 N ATOM 1297 CA ILE A 451 -25.954 5.037 -4.427 1.00 63.90 C ATOM 1298 C ILE A 451 -26.053 5.534 -5.850 1.00 71.82 C ATOM 1299 O ILE A 451 -25.713 4.816 -6.791 1.00 71.96 O ATOM 1300 CB ILE A 451 -24.806 5.699 -3.643 1.00 67.80 C ATOM 1301 CG1 ILE A 451 -23.446 5.107 -4.022 1.00 68.89 C ATOM 1302 CG2 ILE A 451 -25.064 5.620 -2.130 1.00 69.87 C ATOM 1303 CD1 ILE A 451 -22.263 5.998 -3.669 1.00 82.73 C ATOM 1304 H ILE A 451 -25.183 3.062 -4.796 1.00 0.00 H ATOM 1305 N GLU A 452 -26.555 6.755 -6.007 1.00 71.22 N ATOM 1306 CA GLU A 452 -26.693 7.392 -7.299 1.00 71.69 C ATOM 1307 C GLU A 452 -26.291 8.850 -7.195 1.00 80.69 C ATOM 1308 O GLU A 452 -26.401 9.446 -6.117 1.00 80.26 O ATOM 1309 CB GLU A 452 -28.149 7.273 -7.796 1.00 72.31 C ATOM 1310 CG GLU A 452 -29.167 8.120 -7.043 1.00 78.61 C ATOM 1311 CD GLU A 452 -30.622 7.727 -7.238 1.00 87.13 C ATOM 1312 OE1 GLU A 452 -30.896 6.890 -8.126 1.00 84.10 O ATOM 1313 OE2 GLU A 452 -31.492 8.251 -6.502 1.00 64.54 O ATOM 1314 H GLU A 452 -26.863 7.277 -5.162 1.00 0.00 H ATOM 1315 N HIS A 453 -25.863 9.436 -8.324 1.00 80.45 N ATOM 1316 CA HIS A 453 -25.635 10.871 -8.409 1.00 81.14 C ATOM 1317 C HIS A 453 -27.034 11.489 -8.453 1.00 81.39 C ATOM 1318 O HIS A 453 -27.960 10.901 -9.027 1.00 78.42 O ATOM 1319 CB HIS A 453 -24.850 11.235 -9.676 1.00 83.11 C ATOM 1320 CG HIS A 453 -23.370 11.128 -9.501 1.00 87.79 C ATOM 1321 ND1 HIS A 453 -22.594 12.245 -9.232 1.00 90.10 N ATOM 1322 CD2 HIS A 453 -22.569 10.033 -9.541 1.00 90.24 C ATOM 1323 CE1 HIS A 453 -21.349 11.798 -9.137 1.00 89.97 C ATOM 1324 NE2 HIS A 453 -21.286 10.471 -9.314 1.00 90.22 N ATOM 1325 H HIS A 453 -25.689 8.847 -9.163 1.00 0.00 H ATOM 1326 N ILE A 454 -27.194 12.648 -7.818 1.00 78.34 N ATOM 1327 CA ILE A 454 -28.493 13.298 -7.759 1.00 78.97 C ATOM 1328 C ILE A 454 -28.553 14.579 -8.580 1.00 86.93 C ATOM 1329 O ILE A 454 -27.547 15.271 -8.735 1.00 85.78 O ATOM 1330 CB ILE A 454 -29.016 13.487 -6.297 1.00 81.32 C ATOM 1331 CG1 ILE A 454 -28.180 14.508 -5.505 1.00 80.44 C ATOM 1332 CG2 ILE A 454 -29.084 12.154 -5.562 1.00 82.54 C ATOM 1333 CD1 ILE A 454 -28.758 14.929 -4.178 1.00 78.79 C ATOM 1334 H ILE A 454 -26.376 13.096 -7.357 1.00 0.00 H ATOM 1335 N ASP A 455 -29.744 14.885 -9.107 1.00 87.16 N ATOM 1336 CA ASP A 455 -29.995 16.119 -9.843 1.00 88.56 C ATOM 1337 C ASP A 455 -30.252 17.200 -8.792 1.00 93.83 C ATOM 1338 O ASP A 455 -30.805 16.904 -7.729 1.00 94.30 O ATOM 1339 CB ASP A 455 -31.236 15.979 -10.751 1.00 91.35 C ATOM 1340 CG ASP A 455 -31.197 14.842 -11.760 1.00109.61 C ATOM 1341 OD1 ASP A 455 -31.313 13.666 -11.336 1.00111.50 O ATOM 1342 OD2 ASP A 455 -31.103 15.129 -12.981 1.00116.44 O ATOM 1343 H ASP A 455 -30.527 14.212 -8.986 1.00 0.00 H ATOM 1344 N ASN A 456 -29.860 18.445 -9.068 1.00 90.67 N ATOM 1345 CA ASN A 456 -30.110 19.499 -8.079 1.00 90.41 C ATOM 1346 C ASN A 456 -31.567 19.952 -8.015 1.00 91.42 C ATOM 1347 O ASN A 456 -32.073 20.589 -8.948 1.00 90.85 O ATOM 1348 CB ASN A 456 -29.135 20.698 -8.163 1.00 93.79 C ATOM 1349 CG ASN A 456 -29.286 21.663 -6.983 1.00119.00 C ATOM 1350 OD1 ASN A 456 -28.716 21.472 -5.896 1.00110.24 O ATOM 1351 ND2 ASN A 456 -30.081 22.717 -7.156 1.00110.45 N ATOM 1352 HD22 ASN A 456 -30.553 22.868 -8.070 1.00 0.00 H ATOM 1353 HD21 ASN A 456 -30.230 23.390 -6.377 1.00 0.00 H ATOM 1354 H ASN A 456 -29.386 18.664 -9.967 1.00 0.00 H ATOM 1355 N VAL A 457 -32.233 19.596 -6.902 1.00 85.51 N ATOM 1356 CA VAL A 457 -33.589 20.039 -6.581 1.00 84.18 C ATOM 1357 C VAL A 457 -33.495 20.709 -5.238 1.00 86.38 C ATOM 1358 O VAL A 457 -33.076 20.071 -4.269 1.00 86.81 O ATOM 1359 CB VAL A 457 -34.679 18.951 -6.572 1.00 87.60 C ATOM 1360 CG1 VAL A 457 -36.037 19.565 -6.224 1.00 87.15 C ATOM 1361 CG2 VAL A 457 -34.736 18.211 -7.906 1.00 87.18 C ATOM 1362 H VAL A 457 -31.753 18.966 -6.227 1.00 0.00 H ATOM 1363 N MET A 458 -33.856 21.997 -5.177 1.00 80.99 N ATOM 1364 CA MET A 458 -33.794 22.752 -3.930 1.00 79.59 C ATOM 1365 C MET A 458 -34.870 22.293 -2.944 1.00 83.60 C ATOM 1366 O MET A 458 -35.926 21.774 -3.355 1.00 83.23 O ATOM 1367 CB MET A 458 -33.810 24.257 -4.180 1.00 81.35 C ATOM 1368 CG MET A 458 -32.565 24.757 -4.888 1.00 84.38 C ATOM 1369 SD MET A 458 -32.722 26.495 -5.330 1.00 87.86 S ATOM 1370 CE MET A 458 -32.286 26.446 -7.097 1.00 84.08 C ATOM 1371 H MET A 458 -34.189 22.471 -6.041 1.00 0.00 H ATOM 1372 N GLY A 459 -34.538 22.408 -1.654 1.00 79.08 N ATOM 1373 CA GLY A 459 -35.384 21.958 -0.554 1.00 78.11 C ATOM 1374 C GLY A 459 -35.322 20.454 -0.325 1.00 78.70 C ATOM 1375 O GLY A 459 -36.013 19.920 0.558 1.00 79.64 O ATOM 1376 H GLY A 459 -33.623 22.844 -1.421 1.00 0.00 H ATOM 1377 N MET A 460 -34.492 19.763 -1.129 1.00 70.09 N ATOM 1378 CA MET A 460 -34.290 18.322 -1.046 1.00 67.98 C ATOM 1379 C MET A 460 -32.827 18.011 -1.023 1.00 71.45 C ATOM 1380 O MET A 460 -32.031 18.684 -1.692 1.00 73.47 O ATOM 1381 CB MET A 460 -34.895 17.612 -2.237 1.00 69.68 C ATOM 1382 CG MET A 460 -36.353 17.437 -2.131 1.00 72.94 C ATOM 1383 SD MET A 460 -36.811 16.239 -3.369 1.00 76.90 S ATOM 1384 CE MET A 460 -38.459 16.078 -3.005 1.00 72.70 C ATOM 1385 H MET A 460 -33.963 20.289 -1.853 1.00 0.00 H ATOM 1386 N VAL A 461 -32.458 16.982 -0.267 1.00 63.69 N ATOM 1387 CA VAL A 461 -31.066 16.558 -0.169 1.00 61.69 C ATOM 1388 C VAL A 461 -30.936 15.073 -0.321 1.00 57.79 C ATOM 1389 O VAL A 461 -31.889 14.335 -0.112 1.00 55.28 O ATOM 1390 CB VAL A 461 -30.357 17.039 1.123 1.00 67.11 C ATOM 1391 CG1 VAL A 461 -30.196 18.549 1.134 1.00 67.20 C ATOM 1392 CG2 VAL A 461 -31.089 16.559 2.377 1.00 67.54 C ATOM 1393 H VAL A 461 -33.183 16.464 0.270 1.00 0.00 H ATOM 1394 N GLY A 462 -29.746 14.650 -0.679 1.00 52.28 N ATOM 1395 CA GLY A 462 -29.431 13.248 -0.770 1.00 51.33 C ATOM 1396 C GLY A 462 -28.941 12.805 0.582 1.00 54.30 C ATOM 1397 O GLY A 462 -28.565 13.638 1.428 1.00 54.62 O ATOM 1398 H GLY A 462 -29.009 15.348 -0.904 1.00 0.00 H ATOM 1399 N VAL A 463 -28.963 11.493 0.804 1.00 48.37 N ATOM 1400 CA VAL A 463 -28.465 10.949 2.055 1.00 47.03 C ATOM 1401 C VAL A 463 -27.591 9.762 1.758 1.00 50.28 C ATOM 1402 O VAL A 463 -27.979 8.875 1.016 1.00 47.79 O ATOM 1403 CB VAL A 463 -29.579 10.675 3.101 1.00 50.13 C ATOM 1404 CG1 VAL A 463 -30.660 9.745 2.556 1.00 49.94 C ATOM 1405 CG2 VAL A 463 -28.988 10.126 4.372 1.00 49.62 C ATOM 1406 H VAL A 463 -29.340 10.853 0.076 1.00 0.00 H ATOM 1407 N LEU A 464 -26.391 9.783 2.292 1.00 50.97 N ATOM 1408 CA LEU A 464 -25.427 8.707 2.124 1.00 52.87 C ATOM 1409 C LEU A 464 -25.756 7.533 3.052 1.00 56.70 C ATOM 1410 O LEU A 464 -26.511 7.701 4.022 1.00 56.92 O ATOM 1411 CB LEU A 464 -23.984 9.226 2.378 1.00 53.99 C ATOM 1412 CG LEU A 464 -23.471 10.369 1.464 1.00 59.09 C ATOM 1413 CD1 LEU A 464 -21.993 10.600 1.656 1.00 59.21 C ATOM 1414 CD2 LEU A 464 -23.799 10.129 -0.018 1.00 59.52 C ATOM 1415 H LEU A 464 -26.117 10.609 2.862 1.00 0.00 H ATOM 1416 N PRO A 465 -25.197 6.335 2.792 1.00 52.03 N ATOM 1417 CA PRO A 465 -25.530 5.179 3.651 1.00 51.58 C ATOM 1418 C PRO A 465 -25.271 5.358 5.136 1.00 55.94 C ATOM 1419 O PRO A 465 -25.840 4.625 5.931 1.00 56.29 O ATOM 1420 CB PRO A 465 -24.700 4.032 3.048 1.00 53.14 C ATOM 1421 CG PRO A 465 -24.476 4.437 1.610 1.00 57.21 C ATOM 1422 CD PRO A 465 -24.324 5.936 1.662 1.00 52.55 C ATOM 1423 N ASP A 466 -24.497 6.365 5.505 1.00 53.71 N ATOM 1424 CA ASP A 466 -24.265 6.654 6.909 1.00 53.81 C ATOM 1425 C ASP A 466 -25.130 7.788 7.404 1.00 57.09 C ATOM 1426 O ASP A 466 -24.915 8.301 8.491 1.00 56.28 O ATOM 1427 CB ASP A 466 -22.803 6.986 7.171 1.00 55.99 C ATOM 1428 CG ASP A 466 -22.325 8.167 6.389 1.00 68.44 C ATOM 1429 OD1 ASP A 466 -23.159 8.985 5.991 1.00 69.66 O ATOM 1430 OD2 ASP A 466 -21.107 8.284 6.179 1.00 77.76 O ATOM 1431 H ASP A 466 -24.048 6.959 4.779 1.00 0.00 H ATOM 1432 N MET A 467 -26.107 8.166 6.592 1.00 52.53 N ATOM 1433 CA MET A 467 -27.106 9.147 6.958 1.00 51.12 C ATOM 1434 C MET A 467 -26.551 10.551 7.083 1.00 58.17 C ATOM 1435 O MET A 467 -27.121 11.390 7.757 1.00 60.41 O ATOM 1436 CB MET A 467 -27.804 8.745 8.246 1.00 52.23 C ATOM 1437 CG MET A 467 -28.718 7.557 8.086 1.00 54.74 C ATOM 1438 SD MET A 467 -30.178 7.913 7.120 1.00 57.53 S ATOM 1439 CE MET A 467 -30.651 9.485 7.790 1.00 53.29 C ATOM 1440 H MET A 467 -26.158 7.737 5.646 1.00 0.00 H ATOM 1441 N THR A 468 -25.444 10.813 6.414 1.00 52.98 N ATOM 1442 CA THR A 468 -24.932 12.156 6.342 1.00 52.15 C ATOM 1443 C THR A 468 -25.445 12.745 5.060 1.00 54.21 C ATOM 1444 O THR A 468 -25.545 12.057 4.064 1.00 52.83 O ATOM 1445 CB THR A 468 -23.407 12.181 6.362 1.00 61.08 C ATOM 1446 OG1 THR A 468 -22.904 11.283 5.374 1.00 66.24 O ATOM 1447 CG2 THR A 468 -22.903 11.767 7.720 1.00 57.84 C ATOM 1448 HG1 THR A 468 -23.222 10.366 5.570 1.00 0.00 H ATOM 1449 H THR A 468 -24.937 10.042 5.934 1.00 0.00 H ATOM 1450 N PRO A 469 -25.799 14.018 5.083 1.00 51.56 N ATOM 1451 CA PRO A 469 -26.446 14.600 3.902 1.00 52.37 C ATOM 1452 C PRO A 469 -25.447 14.928 2.801 1.00 57.26 C ATOM 1453 O PRO A 469 -24.267 15.154 3.073 1.00 56.24 O ATOM 1454 CB PRO A 469 -27.179 15.820 4.457 1.00 53.68 C ATOM 1455 CG PRO A 469 -26.480 16.158 5.685 1.00 57.18 C ATOM 1456 CD PRO A 469 -25.766 14.971 6.205 1.00 52.88 C ATOM 1457 N SER A 470 -25.913 14.882 1.558 1.00 54.07 N ATOM 1458 CA SER A 470 -25.082 15.183 0.412 1.00 54.61 C ATOM 1459 C SER A 470 -25.911 15.825 -0.659 1.00 60.98 C ATOM 1460 O SER A 470 -27.037 15.398 -0.893 1.00 60.77 O ATOM 1461 CB SER A 470 -24.424 13.914 -0.120 1.00 58.73 C ATOM 1462 OG SER A 470 -23.772 14.123 -1.367 1.00 65.67 O ATOM 1463 HG SER A 470 -23.362 13.274 -1.670 1.00 0.00 H ATOM 1464 H SER A 470 -26.908 14.621 1.403 1.00 0.00 H ATOM 1465 N THR A 471 -25.363 16.852 -1.315 1.00 60.67 N ATOM 1466 CA THR A 471 -26.049 17.493 -2.449 1.00 62.13 C ATOM 1467 C THR A 471 -25.549 16.850 -3.747 1.00 66.69 C ATOM 1468 O THR A 471 -25.988 17.216 -4.827 1.00 64.49 O ATOM 1469 CB THR A 471 -25.849 19.022 -2.462 1.00 72.12 C ATOM 1470 OG1 THR A 471 -24.450 19.327 -2.470 1.00 80.22 O ATOM 1471 CG2 THR A 471 -26.551 19.715 -1.318 1.00 67.25 C ATOM 1472 HG1 THR A 471 -24.328 20.309 -2.478 1.00 0.00 H ATOM 1473 H THR A 471 -24.431 17.206 -1.018 1.00 0.00 H ATOM 1474 N GLU A 472 -24.652 15.875 -3.624 1.00 66.54 N ATOM 1475 CA GLU A 472 -24.003 15.225 -4.752 1.00 68.24 C ATOM 1476 C GLU A 472 -24.553 13.847 -5.069 1.00 72.45 C ATOM 1477 O GLU A 472 -24.855 13.551 -6.229 1.00 71.62 O ATOM 1478 CB GLU A 472 -22.497 15.134 -4.461 1.00 70.63 C ATOM 1479 CG GLU A 472 -21.643 14.782 -5.669 1.00 89.06 C ATOM 1480 CD GLU A 472 -21.358 15.934 -6.622 1.00119.65 C ATOM 1481 OE1 GLU A 472 -21.894 17.046 -6.401 1.00113.61 O ATOM 1482 OE2 GLU A 472 -20.598 15.719 -7.596 1.00116.41 O ATOM 1483 H GLU A 472 -24.400 15.559 -2.666 1.00 0.00 H ATOM 1484 N MET A 473 -24.641 12.987 -4.048 1.00 70.19 N ATOM 1485 CA MET A 473 -25.129 11.625 -4.201 1.00 70.20 C ATOM 1486 C MET A 473 -26.127 11.250 -3.120 1.00 68.91 C ATOM 1487 O MET A 473 -26.251 11.949 -2.116 1.00 67.40 O ATOM 1488 CB MET A 473 -23.960 10.641 -4.195 1.00 73.75 C ATOM 1489 CG MET A 473 -23.073 10.741 -5.424 1.00 79.35 C ATOM 1490 SD MET A 473 -21.864 9.396 -5.512 1.00 85.24 S ATOM 1491 CE MET A 473 -20.833 9.779 -4.092 1.00 82.30 C ATOM 1492 H MET A 473 -24.347 13.306 -3.103 1.00 0.00 H ATOM 1493 N SER A 474 -26.840 10.134 -3.330 1.00 62.67 N ATOM 1494 CA SER A 474 -27.803 9.605 -2.366 1.00 60.38 C ATOM 1495 C SER A 474 -28.042 8.116 -2.543 1.00 62.01 C ATOM 1496 O SER A 474 -27.841 7.577 -3.637 1.00 62.51 O ATOM 1497 CB SER A 474 -29.145 10.317 -2.498 1.00 59.36 C ATOM 1498 OG SER A 474 -29.960 10.040 -1.374 1.00 57.27 O ATOM 1499 HG SER A 474 -30.827 10.508 -1.473 1.00 0.00 H ATOM 1500 H SER A 474 -26.701 9.619 -4.223 1.00 0.00 H ATOM 1501 N MET A 475 -28.562 7.472 -1.481 1.00 54.57 N ATOM 1502 CA MET A 475 -29.030 6.101 -1.553 1.00 52.58 C ATOM 1503 C MET A 475 -30.133 6.101 -2.629 1.00 55.43 C ATOM 1504 O MET A 475 -30.968 7.017 -2.684 1.00 53.80 O ATOM 1505 CB MET A 475 -29.576 5.634 -0.202 1.00 54.37 C ATOM 1506 CG MET A 475 -28.484 5.312 0.765 1.00 58.26 C ATOM 1507 SD MET A 475 -29.002 4.494 2.275 1.00 63.37 S ATOM 1508 CE MET A 475 -29.772 5.878 3.199 1.00 60.07 C ATOM 1509 H MET A 475 -28.631 7.977 -0.574 1.00 0.00 H ATOM 1510 N ARG A 476 -30.088 5.106 -3.515 1.00 51.68 N ATOM 1511 CA ARG A 476 -30.998 4.997 -4.651 1.00 50.82 C ATOM 1512 C ARG A 476 -32.489 5.286 -4.348 1.00 50.51 C ATOM 1513 O ARG A 476 -33.113 4.583 -3.565 1.00 50.59 O ATOM 1514 CB ARG A 476 -30.797 3.642 -5.367 1.00 51.37 C ATOM 1515 CG ARG A 476 -31.842 3.364 -6.456 1.00 59.23 C ATOM 1516 CD ARG A 476 -31.670 2.006 -7.105 1.00 68.51 C ATOM 1517 NE ARG A 476 -31.477 0.905 -6.149 1.00 71.89 N ATOM 1518 CZ ARG A 476 -32.459 0.227 -5.552 1.00 76.29 C ATOM 1519 NH1 ARG A 476 -33.742 0.563 -5.760 1.00 58.79 N ATOM 1520 NH2 ARG A 476 -32.170 -0.778 -4.733 1.00 42.35 N ATOM 1521 HE ARG A 476 -30.499 0.634 -5.921 1.00 0.00 H ATOM 1522 HH12 ARG A 476 -34.502 0.030 -5.291 1.00 0.00 H ATOM 1523 HH11 ARG A 476 -33.976 1.357 -6.390 1.00 0.00 H ATOM 1524 HH22 ARG A 476 -32.936 -1.306 -4.268 1.00 0.00 H ATOM 1525 HH21 ARG A 476 -31.178 -1.037 -4.557 1.00 0.00 H ATOM 1526 H ARG A 476 -29.366 4.368 -3.390 1.00 0.00 H ATOM 1527 N GLY A 477 -33.027 6.319 -4.979 1.00 44.14 N ATOM 1528 CA GLY A 477 -34.437 6.697 -4.888 1.00 42.40 C ATOM 1529 C GLY A 477 -34.818 7.431 -3.624 1.00 45.63 C ATOM 1530 O GLY A 477 -35.995 7.764 -3.443 1.00 44.54 O ATOM 1531 H GLY A 477 -32.406 6.899 -5.578 1.00 0.00 H ATOM 1532 N ILE A 478 -33.827 7.662 -2.716 1.00 41.04 N ATOM 1533 CA ILE A 478 -34.060 8.275 -1.409 1.00 39.15 C ATOM 1534 C ILE A 478 -33.688 9.750 -1.416 1.00 47.99 C ATOM 1535 O ILE A 478 -32.569 10.105 -1.800 1.00 46.84 O ATOM 1536 CB ILE A 478 -33.328 7.523 -0.264 1.00 39.26 C ATOM 1537 CG1 ILE A 478 -33.416 5.974 -0.386 1.00 38.64 C ATOM 1538 CG2 ILE A 478 -33.730 8.039 1.126 1.00 35.75 C ATOM 1539 CD1 ILE A 478 -34.750 5.394 -0.209 1.00 44.80 C ATOM 1540 H ILE A 478 -32.855 7.388 -2.966 1.00 0.00 H ATOM 1541 N ARG A 479 -34.630 10.601 -0.968 1.00 47.26 N ATOM 1542 CA ARG A 479 -34.380 12.018 -0.777 1.00 48.84 C ATOM 1543 C ARG A 479 -34.921 12.453 0.603 1.00 53.47 C ATOM 1544 O ARG A 479 -35.950 11.946 1.071 1.00 54.76 O ATOM 1545 CB ARG A 479 -34.989 12.871 -1.918 1.00 53.71 C ATOM 1546 CG ARG A 479 -34.561 12.495 -3.349 1.00 68.77 C ATOM 1547 CD ARG A 479 -33.076 12.768 -3.632 1.00 77.82 C ATOM 1548 NE ARG A 479 -32.690 12.455 -5.011 1.00 82.45 N ATOM 1549 CZ ARG A 479 -32.339 11.251 -5.451 1.00 90.84 C ATOM 1550 NH1 ARG A 479 -32.307 10.218 -4.625 1.00 73.31 N ATOM 1551 NH2 ARG A 479 -32.003 11.075 -6.719 1.00 83.25 N ATOM 1552 HE ARG A 479 -32.691 13.235 -5.698 1.00 0.00 H ATOM 1553 HH12 ARG A 479 -32.031 9.279 -4.977 1.00 0.00 H ATOM 1554 HH11 ARG A 479 -32.558 10.345 -3.624 1.00 0.00 H ATOM 1555 HH22 ARG A 479 -31.729 10.131 -7.058 1.00 0.00 H ATOM 1556 HH21 ARG A 479 -32.013 11.881 -7.376 1.00 0.00 H ATOM 1557 H ARG A 479 -35.576 10.228 -0.750 1.00 0.00 H ATOM 1558 N VAL A 480 -34.216 13.379 1.249 1.00 47.61 N ATOM 1559 CA VAL A 480 -34.639 13.960 2.520 1.00 46.08 C ATOM 1560 C VAL A 480 -35.117 15.394 2.254 1.00 48.76 C ATOM 1561 O VAL A 480 -34.417 16.189 1.622 1.00 47.36 O ATOM 1562 CB VAL A 480 -33.545 13.907 3.605 1.00 48.49 C ATOM 1563 CG1 VAL A 480 -33.996 14.644 4.844 1.00 48.34 C ATOM 1564 CG2 VAL A 480 -33.216 12.474 3.965 1.00 47.94 C ATOM 1565 H VAL A 480 -33.322 13.704 0.829 1.00 0.00 H ATOM 1566 N SER A 481 -36.318 15.703 2.721 1.00 44.87 N ATOM 1567 CA SER A 481 -36.929 17.012 2.591 1.00 44.02 C ATOM 1568 C SER A 481 -36.842 17.726 3.934 1.00 49.17 C ATOM 1569 O SER A 481 -36.808 17.082 4.992 1.00 47.55 O ATOM 1570 CB SER A 481 -38.400 16.838 2.221 1.00 48.59 C ATOM 1571 OG SER A 481 -39.049 18.077 1.974 1.00 65.30 O ATOM 1572 HG SER A 481 -39.003 18.640 2.787 1.00 0.00 H ATOM 1573 H SER A 481 -36.856 14.960 3.211 1.00 0.00 H ATOM 1574 N LYS A 482 -36.829 19.073 3.902 1.00 48.88 N ATOM 1575 CA LYS A 482 -36.883 19.889 5.132 1.00 48.22 C ATOM 1576 C LYS A 482 -38.309 19.811 5.723 1.00 52.68 C ATOM 1577 O LYS A 482 -39.295 19.755 4.979 1.00 50.00 O ATOM 1578 CB LYS A 482 -36.451 21.338 4.887 1.00 48.99 C ATOM 1579 CG LYS A 482 -34.987 21.451 4.475 1.00 65.89 C ATOM 1580 CD LYS A 482 -34.738 22.606 3.501 1.00 81.68 C ATOM 1581 CE LYS A 482 -33.280 22.811 3.131 1.00 87.90 C ATOM 1582 NZ LYS A 482 -32.757 21.716 2.286 1.00 98.95 N ATOM 1583 HZ1 LYS A 482 -32.836 20.815 2.800 1.00 0.00 H ATOM 1584 HZ2 LYS A 482 -33.309 21.665 1.406 1.00 0.00 H ATOM 1585 HZ3 LYS A 482 -31.759 21.901 2.060 1.00 0.00 H ATOM 1586 H LYS A 482 -36.779 19.554 2.981 1.00 0.00 H ATOM 1587 N MET A 483 -38.398 19.712 7.060 1.00 52.47 N ATOM 1588 CA MET A 483 -39.664 19.637 7.792 1.00100.08 C ATOM 1589 C MET A 483 -40.557 20.854 7.503 1.00113.91 C ATOM 1590 O MET A 483 -41.562 20.737 6.805 1.00 69.05 O ATOM 1591 CB MET A 483 -39.392 19.538 9.290 1.00102.64 C ATOM 1592 CG MET A 483 -40.563 19.043 10.055 1.00106.66 C ATOM 1593 SD MET A 483 -40.355 17.324 10.513 1.00111.03 S ATOM 1594 CE MET A 483 -40.051 17.529 12.228 1.00107.54 C ATOM 1595 H MET A 483 -37.514 19.687 7.608 1.00 0.00 H TER 1596 MET A 483 HETATM 1597 O HOH 1 -54.666 4.730 -9.343 1.00 40.36 O HETATM 1598 O HOH 2 -55.546 -3.228 -4.690 1.00 78.62 O HETATM 1599 O HOH 3 -55.322 -13.230 -1.128 1.00 53.70 O HETATM 1600 O HOH 4 -40.037 -3.443 -10.737 1.00 46.74 O HETATM 1601 O HOH 5 -36.653 18.881 13.191 1.00 50.49 O HETATM 1602 O HOH 6 -22.265 -7.708 -0.315 1.00 51.58 O HETATM 1603 O HOH 7 -35.697 -11.314 13.268 1.00 59.68 O HETATM 1604 O HOH 8 -36.808 1.397 11.713 1.00 53.23 O HETATM 1605 O HOH 9 -45.952 -16.121 10.771 1.00 57.37 O HETATM 1606 O HOH 10 -55.174 4.663 -5.243 1.00 66.18 O HETATM 1607 O HOH 11 -57.227 -5.296 -6.244 1.00 46.14 O HETATM 1608 O HOH 12 -24.791 -14.873 10.981 1.00 57.15 O HETATM 1609 O HOH 13 -58.748 1.501 4.357 1.00 61.64 O HETATM 1610 O HOH 14 -26.942 3.699 9.349 1.00 55.86 O HETATM 1611 O HOH 15 -35.449 8.566 -7.670 1.00 47.37 O HETATM 1612 O HOH 16 -28.846 -2.546 -5.795 1.00 60.48 O HETATM 1613 O HOH 17 -40.992 -18.308 5.776 1.00 47.47 O HETATM 1614 O HOH 18 -57.333 -2.758 -10.239 1.00 45.62 O HETATM 1615 O HOH 19 -42.743 14.742 3.219 1.00 48.59 O HETATM 1616 O HOH 20 -56.716 3.302 -0.274 1.00 67.37 O HETATM 1617 O HOH 21 -55.106 -4.450 -8.116 1.00 57.23 O HETATM 1618 O HOH 22 -35.235 17.183 9.707 1.00 50.00 O HETATM 1619 O HOH 23 -36.378 16.387 7.485 1.00 50.00 O HETATM 1620 O HOH 24 -51.400 -1.709 -10.392 1.00 50.00 O HETATM 1621 O HOH 25 -46.866 -2.962 -5.177 1.00 50.00 O HETATM 1622 CL1 UNN A 26 -45.060 -5.546 2.587 1.00 -0.07 CL HETATM 1623 C23 UNN A 26 -46.167 -4.841 1.472 1.00 0.05 C HETATM 1624 C22 UNN A 26 -47.479 -4.658 1.864 1.00 -0.04 C HETATM 1625 C21 UNN A 26 -48.316 -4.008 0.971 1.00 0.02 C HETATM 1626 C16 UNN A 26 -49.736 -3.647 0.971 1.00 0.03 C HETATM 1627 C14 UNN A 26 -50.709 -3.856 2.033 1.00 0.08 C HETATM 1628 N13 UNN A 26 -51.985 -3.600 1.762 1.00 -0.30 N HETATM 1629 C12 UNN A 26 -52.925 -3.692 2.709 1.00 0.04 C HETATM 1630 C11 UNN A 26 -52.541 -4.061 3.985 1.00 0.19 C HETATM 1631 C10 UNN A 26 -51.188 -4.286 4.252 1.00 0.16 C HETATM 1632 N9 UNN A 26 -50.841 -4.585 5.552 1.00 -0.28 N HETATM 1633 C2 UNN A 26 -49.452 -4.595 5.991 1.00 0.13 C HETATM 1634 C1 UNN A 26 -49.482 -4.486 7.517 1.00 -0.02 C HETATM 1635 H UNN A 26 -49.956 -3.537 7.808 1.00 0.03 H HETATM 1636 H UNN A 26 -48.454 -4.516 7.907 1.00 0.03 H HETATM 1637 H UNN A 26 -50.057 -5.326 7.933 1.00 0.03 H HETATM 1638 C4 UNN A 26 -48.797 -5.905 5.600 1.00 0.20 C HETATM 1639 O5 UNN A 26 -49.525 -6.875 5.392 1.00 -0.39 O HETATM 1640 N6 UNN A 26 -47.435 -6.018 5.495 1.00 -0.28 N HETATM 1641 C7 UNN A 26 -46.829 -7.306 5.123 1.00 0.02 C HETATM 1642 H UNN A 26 -45.735 -7.200 5.090 1.00 0.05 H HETATM 1643 H UNN A 26 -47.198 -7.612 4.133 1.00 0.05 H HETATM 1644 H UNN A 26 -47.102 -8.068 5.868 1.00 0.05 H HETATM 1645 C8 UNN A 26 -46.520 -4.880 5.726 1.00 0.02 C HETATM 1646 H UNN A 26 -47.105 -3.988 5.995 1.00 0.05 H HETATM 1647 H UNN A 26 -45.946 -4.679 4.810 1.00 0.05 H HETATM 1648 H UNN A 26 -45.829 -5.126 6.546 1.00 0.05 H HETATM 1649 H UNN A 26 -48.901 -3.751 5.550 1.00 0.08 H HETATM 1650 H UNN A 26 -51.583 -4.807 6.231 1.00 0.19 H HETATM 1651 N15 UNN A 26 -50.296 -4.177 3.260 1.00 -0.27 N HETATM 1652 F27 UNN A 26 -53.426 -4.183 4.989 1.00 -0.18 F HETATM 1653 H UNN A 26 -53.964 -3.482 2.481 1.00 0.08 H HETATM 1654 C17 UNN A 26 -49.990 -3.031 -0.211 1.00 0.06 C HETATM 1655 N18 UNN A 26 -48.841 -3.003 -0.960 1.00 -0.25 N HETATM 1656 C20 UNN A 26 -47.801 -3.577 -0.274 1.00 0.14 C HETATM 1657 N25 UNN A 26 -46.531 -3.766 -0.594 1.00 -0.28 N HETATM 1658 C24 UNN A 26 -45.708 -4.340 0.261 1.00 0.01 C HETATM 1659 H UNN A 26 -44.656 -4.422 0.015 1.00 0.08 H HETATM 1660 H UNN A 26 -48.769 -2.606 -1.907 1.00 0.24 H HETATM 1661 H UNN A 26 -50.953 -2.624 -0.516 1.00 0.11 H HETATM 1662 H UNN A 26 -47.837 -5.007 2.826 1.00 0.07 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1622 1623 CONECT 1623 1622 1624 1658 CONECT 1624 1623 1625 1662 CONECT 1625 1624 1626 1656 CONECT 1626 1625 1627 1654 CONECT 1627 1626 1628 1651 CONECT 1628 1627 1629 CONECT 1629 1628 1630 1653 CONECT 1630 1629 1631 1652 CONECT 1631 1630 1632 1651 CONECT 1632 1631 1633 1650 CONECT 1633 1632 1634 1638 1649 CONECT 1634 1633 1635 1636 1637 CONECT 1635 1634 CONECT 1636 1634 CONECT 1637 1634 CONECT 1638 1633 1639 1640 CONECT 1639 1638 CONECT 1640 1638 1641 1645 CONECT 1641 1640 1642 1643 1644 CONECT 1642 1641 CONECT 1643 1641 CONECT 1644 1641 CONECT 1645 1640 1646 1647 1648 CONECT 1646 1645 CONECT 1647 1645 CONECT 1648 1645 CONECT 1649 1633 CONECT 1650 1632 CONECT 1651 1627 1631 CONECT 1652 1630 CONECT 1653 1629 CONECT 1654 1626 1655 1661 CONECT 1655 1654 1656 1660 CONECT 1656 1625 1655 1657 CONECT 1657 1656 1658 CONECT 1658 1623 1657 1659 CONECT 1659 1658 CONECT 1660 1655 CONECT 1661 1654 CONECT 1662 1624 MASTER 0 0 0 0 0 0 0 0 1661 1 45 13 END
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Related entries of code: 4ncm
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Protein Sequence Similarity
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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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
4ncm
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Influenza polymerase basic protein 2 (PB2)
Ligand Name
704
EC.Number
E.C.-.-.-.-
Resolution
2.82(Å)
Affinity (Kd/Ki/IC50)
Kd=0.10uM
Release Year
2014
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J.Med.Chem. Vol. 57: pp. 6668-6678
Ligand Properties
Formula
C
1
6
H
1
6
ClFN
6
O
Molecular Weight
362.789
Exact Mass
362.106
No. of atoms
41
No. of bonds
43
Polar Surface Area
86.8
LOGP Value
2.23 (
Computed with XLOGP3
)
2.77 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
Clc1cnc2c(c1)c(c[nH]2)c1ncc(c(n1)N[C@H](C(=O)N(C)C)C)F
InChI String
InChI=1S/C16H16ClFN6O/c1-8(16(25)24(2)3)22-15-12(18)7-21-14(23-15)11-6-20-13-10(11)4-9(17)5-19-13/h4-8H,1-3H3,(H,19,20)(H,21,22,23)/t8-/m0/s1
Links to External Databases
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P31345
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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