Browse entries in the PDBbind-CN Database
HEADER 4Q46_COMPLEX COMPND 4Q46_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 164 ILE ARG GLN ARG GLN ARG PHE GLY ARG LEU GLU LEU LYS SEQRES 2 A 164 ARG ILE SER GLY ARG GLY PHE LYS ASN ASP GLU GLU ILE SEQRES 3 A 164 LEU ILE GLY ASN GLY THR ILE GLN LYS ILE GLY ILE TRP SEQRES 4 A 164 ASP GLY GLU GLU GLU PHE HIS VAL ARG CYS GLY GLU CYS SEQRES 5 A 164 ARG GLY ILE LEU LYS LYS SER LYS MET LYS LEU GLU LYS SEQRES 6 A 164 LEU LEU ILE ASN SER ALA LYS LYS GLU ASP MET ARG ASP SEQRES 7 A 164 LEU ILE ILE LEU CYS MET VAL PHE SER GLN ASP THR ARG SEQRES 8 A 164 MET PHE GLN GLY VAL ARG GLY GLU ILE ASN PHE LEU ASN SEQRES 9 A 164 ARG ALA GLY GLN LEU LEU SER PRO MET TYR GLN LEU GLN SEQRES 10 A 164 ARG TYR PHE LEU ASN ARG SER SER ASP LEU PHE ASP GLN SEQRES 11 A 164 TRP GLY TYR GLU GLU SER PRO LYS ALA SER GLU LEU HIS SEQRES 12 A 164 GLY ILE ASN GLU SER MET ASN ALA SER ASP TYR THR LEU SEQRES 13 A 164 LYS GLY VAL VAL VAL THR LYS ASN HET GDP A 377 41 ATOM 1 N ILE A 321 20.725 -11.159 -4.977 1.00 44.56 N ATOM 2 CA ILE A 321 19.559 -11.162 -5.937 1.00 45.00 C ATOM 3 C ILE A 321 18.191 -11.567 -5.362 1.00 44.91 C ATOM 4 O ILE A 321 17.165 -11.022 -5.759 1.00 46.23 O ATOM 5 CB ILE A 321 19.840 -11.910 -7.314 1.00 45.17 C ATOM 6 CG1 ILE A 321 18.626 -11.791 -8.261 1.00 44.23 C ATOM 7 CG2 ILE A 321 20.282 -13.374 -7.108 1.00 45.28 C ATOM 8 CD1 ILE A 321 18.940 -11.996 -9.751 1.00 47.41 C ATOM 9 HN3 ILE A 321 20.854 -12.114 -4.587 1.00 0.00 H ATOM 10 HN2 ILE A 321 20.534 -10.490 -4.204 1.00 0.00 H ATOM 11 HN1 ILE A 321 21.587 -10.870 -5.482 1.00 0.00 H ATOM 12 N ARG A 322 18.118 -12.491 -4.428 1.00 43.91 N ATOM 13 CA ARG A 322 16.737 -12.935 -4.126 1.00 42.66 C ATOM 14 C ARG A 322 16.209 -12.565 -2.719 1.00 39.08 C ATOM 15 O ARG A 322 15.092 -12.962 -2.336 1.00 39.79 O ATOM 16 CB ARG A 322 16.576 -14.438 -4.450 1.00 43.75 C ATOM 17 CG ARG A 322 15.278 -14.753 -5.174 1.00 48.68 C ATOM 18 CD ARG A 322 15.526 -15.401 -6.561 1.00 55.49 C ATOM 19 NE ARG A 322 14.618 -14.855 -7.591 1.00 59.50 N ATOM 20 CZ ARG A 322 13.604 -15.510 -8.170 1.00 61.55 C ATOM 21 NH1 ARG A 322 13.327 -16.775 -7.850 1.00 62.39 N ATOM 22 NH2 ARG A 322 12.859 -14.896 -9.091 1.00 62.52 N ATOM 23 HE ARG A 322 14.781 -13.873 -7.893 1.00 0.00 H ATOM 24 HH12 ARG A 322 12.535 -17.267 -8.311 1.00 0.00 H ATOM 25 HH11 ARG A 322 13.903 -17.270 -7.139 1.00 0.00 H ATOM 26 HH22 ARG A 322 12.070 -15.401 -9.543 1.00 0.00 H ATOM 27 HH21 ARG A 322 13.067 -13.912 -9.357 1.00 0.00 H ATOM 28 H ARG A 322 18.955 -12.875 -3.945 1.00 0.00 H ATOM 29 N GLN A 323 16.991 -11.809 -1.952 1.00 34.61 N ATOM 30 CA GLN A 323 16.611 -11.662 -0.561 1.00 29.79 C ATOM 31 C GLN A 323 15.942 -10.352 -0.282 1.00 24.96 C ATOM 32 O GLN A 323 16.383 -9.336 -0.789 1.00 23.10 O ATOM 33 CB GLN A 323 17.758 -11.892 0.385 1.00 31.00 C ATOM 34 CG GLN A 323 17.614 -13.254 1.060 1.00 35.34 C ATOM 35 CD GLN A 323 18.626 -13.447 2.148 1.00 42.85 C ATOM 36 OE1 GLN A 323 19.838 -13.279 1.921 1.00 43.62 O ATOM 37 NE2 GLN A 323 18.147 -13.784 3.358 1.00 45.43 N ATOM 38 HE22 GLN A 323 17.124 -13.913 3.495 1.00 0.00 H ATOM 39 HE21 GLN A 323 18.799 -13.916 4.157 1.00 0.00 H ATOM 40 H GLN A 323 17.839 -11.343 -2.334 1.00 0.00 H ATOM 41 N ARG A 324 14.933 -10.381 0.587 1.00 21.00 N ATOM 42 CA ARG A 324 14.246 -9.154 0.975 1.00 17.67 C ATOM 43 C ARG A 324 15.126 -8.445 1.999 1.00 17.14 C ATOM 44 O ARG A 324 15.626 -9.083 2.960 1.00 17.03 O ATOM 45 CB ARG A 324 12.834 -9.433 1.577 1.00 20.04 C ATOM 46 CG ARG A 324 11.774 -10.089 0.670 1.00 23.37 C ATOM 47 CD ARG A 324 10.640 -10.499 1.578 1.00 25.20 C ATOM 48 NE ARG A 324 9.700 -9.392 1.790 1.00 20.06 N ATOM 49 CZ ARG A 324 8.401 -9.485 1.537 1.00 17.98 C ATOM 50 NH1 ARG A 324 7.896 -10.653 1.139 1.00 20.34 N ATOM 51 NH2 ARG A 324 7.611 -8.433 1.731 1.00 14.31 N ATOM 52 HE ARG A 324 10.070 -8.492 2.156 1.00 0.00 H ATOM 53 HH12 ARG A 324 6.879 -10.738 0.938 1.00 0.00 H ATOM 54 HH11 ARG A 324 8.519 -11.479 1.030 1.00 0.00 H ATOM 55 HH22 ARG A 324 6.592 -8.504 1.533 1.00 0.00 H ATOM 56 HH21 ARG A 324 8.012 -7.539 2.081 1.00 0.00 H ATOM 57 H ARG A 324 14.631 -11.289 0.994 1.00 0.00 H ATOM 58 N GLN A 325 15.364 -7.162 1.812 1.00 15.01 N ATOM 59 CA GLN A 325 16.152 -6.379 2.676 1.00 13.98 C ATOM 60 C GLN A 325 15.502 -5.087 3.061 1.00 14.23 C ATOM 61 O GLN A 325 14.553 -4.670 2.390 1.00 13.78 O ATOM 62 CB GLN A 325 17.588 -6.180 2.132 1.00 14.16 C ATOM 63 CG GLN A 325 17.843 -5.066 1.070 1.00 19.17 C ATOM 64 CD GLN A 325 19.072 -5.347 0.076 1.00 25.74 C ATOM 65 OE1 GLN A 325 20.203 -4.911 0.271 1.00 27.38 O ATOM 66 NE2 GLN A 325 18.789 -6.090 -0.985 1.00 26.71 N ATOM 67 HE22 GLN A 325 17.823 -6.447 -1.127 1.00 0.00 H ATOM 68 HE21 GLN A 325 19.533 -6.316 -1.675 1.00 0.00 H ATOM 69 H GLN A 325 14.946 -6.702 0.978 1.00 0.00 H ATOM 70 N ARG A 326 16.006 -4.405 4.090 1.00 14.21 N ATOM 71 CA ARG A 326 15.398 -3.120 4.455 1.00 14.68 C ATOM 72 C ARG A 326 16.373 -1.966 4.359 1.00 16.15 C ATOM 73 O ARG A 326 17.556 -2.174 4.609 1.00 15.00 O ATOM 74 CB ARG A 326 14.830 -3.170 5.895 1.00 15.42 C ATOM 75 CG ARG A 326 13.739 -4.250 6.120 1.00 17.14 C ATOM 76 CD ARG A 326 12.532 -4.063 5.214 1.00 19.25 C ATOM 77 NE ARG A 326 11.868 -2.776 5.477 1.00 20.04 N ATOM 78 CZ ARG A 326 10.628 -2.610 5.969 1.00 20.62 C ATOM 79 NH1 ARG A 326 9.826 -3.635 6.300 1.00 18.02 N ATOM 80 NH2 ARG A 326 10.171 -1.404 6.132 1.00 20.78 N ATOM 81 HE ARG A 326 12.409 -1.914 5.262 1.00 0.00 H ATOM 82 HH12 ARG A 326 8.874 -3.450 6.677 1.00 0.00 H ATOM 83 HH11 ARG A 326 10.156 -4.614 6.179 1.00 0.00 H ATOM 84 HH22 ARG A 326 9.214 -1.257 6.511 1.00 0.00 H ATOM 85 HH21 ARG A 326 10.763 -0.586 5.883 1.00 0.00 H ATOM 86 H ARG A 326 16.816 -4.777 4.625 1.00 0.00 H ATOM 87 N PHE A 327 15.868 -0.767 3.953 1.00 13.64 N ATOM 88 CA PHE A 327 16.546 0.525 4.181 1.00 12.15 C ATOM 89 C PHE A 327 15.515 1.329 4.988 1.00 10.85 C ATOM 90 O PHE A 327 14.757 2.115 4.431 1.00 9.19 O ATOM 91 CB PHE A 327 16.824 1.228 2.825 1.00 9.73 C ATOM 92 CG PHE A 327 17.359 2.673 2.942 1.00 6.53 C ATOM 93 CD1 PHE A 327 18.322 3.026 3.890 1.00 9.50 C ATOM 94 CD2 PHE A 327 16.857 3.676 2.089 1.00 10.31 C ATOM 95 CE1 PHE A 327 18.796 4.390 3.955 1.00 8.95 C ATOM 96 CE2 PHE A 327 17.321 5.064 2.167 1.00 10.90 C ATOM 97 CZ PHE A 327 18.299 5.383 3.101 1.00 8.23 C ATOM 98 H PHE A 327 14.955 -0.762 3.455 1.00 0.00 H ATOM 99 N GLY A 328 15.498 1.154 6.310 1.00 12.70 N ATOM 100 CA GLY A 328 14.467 1.773 7.136 1.00 10.45 C ATOM 101 C GLY A 328 13.060 1.360 6.692 1.00 11.78 C ATOM 102 O GLY A 328 12.688 0.135 6.672 1.00 13.21 O ATOM 103 H GLY A 328 16.230 0.568 6.759 1.00 0.00 H ATOM 104 N ARG A 329 12.266 2.389 6.403 1.00 9.25 N ATOM 105 CA ARG A 329 10.886 2.206 6.041 1.00 10.73 C ATOM 106 C ARG A 329 10.798 1.580 4.632 1.00 8.83 C ATOM 107 O ARG A 329 9.717 1.136 4.234 1.00 10.49 O ATOM 108 CB ARG A 329 10.179 3.581 6.113 1.00 15.06 C ATOM 109 CG ARG A 329 9.918 3.950 7.625 1.00 19.64 C ATOM 110 CD ARG A 329 8.648 4.786 7.933 1.00 28.82 C ATOM 111 NE ARG A 329 7.463 4.205 7.311 1.00 28.71 N ATOM 112 CZ ARG A 329 6.582 4.857 6.548 1.00 28.58 C ATOM 113 NH1 ARG A 329 6.665 6.170 6.356 1.00 26.96 N ATOM 114 NH2 ARG A 329 5.574 4.188 5.998 1.00 32.26 N ATOM 115 HE ARG A 329 7.289 3.193 7.477 1.00 0.00 H ATOM 116 HH12 ARG A 329 5.966 6.653 5.757 1.00 0.00 H ATOM 117 HH11 ARG A 329 7.429 6.714 6.805 1.00 0.00 H ATOM 118 HH22 ARG A 329 4.883 4.687 5.402 1.00 0.00 H ATOM 119 HH21 ARG A 329 5.477 3.166 6.163 1.00 0.00 H ATOM 120 H ARG A 329 12.655 3.353 6.440 1.00 0.00 H ATOM 121 N LEU A 330 11.899 1.588 3.864 1.00 7.92 N ATOM 122 CA LEU A 330 11.860 0.984 2.491 1.00 8.03 C ATOM 123 C LEU A 330 12.190 -0.491 2.571 1.00 9.74 C ATOM 124 O LEU A 330 13.150 -0.835 3.213 1.00 11.47 O ATOM 125 CB LEU A 330 12.884 1.703 1.561 1.00 5.89 C ATOM 126 CG LEU A 330 13.022 1.193 0.096 1.00 8.58 C ATOM 127 CD1 LEU A 330 11.733 1.483 -0.560 1.00 7.02 C ATOM 128 CD2 LEU A 330 14.142 2.010 -0.568 1.00 11.45 C ATOM 129 H LEU A 330 12.779 2.013 4.221 1.00 0.00 H ATOM 130 N GLU A 331 11.444 -1.341 1.866 1.00 8.62 N ATOM 131 CA GLU A 331 11.816 -2.731 1.693 1.00 8.95 C ATOM 132 C GLU A 331 12.238 -2.927 0.242 1.00 8.59 C ATOM 133 O GLU A 331 11.626 -2.274 -0.661 1.00 9.28 O ATOM 134 CB GLU A 331 10.652 -3.652 2.035 1.00 8.79 C ATOM 135 CG GLU A 331 11.161 -5.082 2.056 1.00 10.54 C ATOM 136 CD GLU A 331 10.097 -6.068 2.507 1.00 16.61 C ATOM 137 OE1 GLU A 331 10.428 -7.064 3.245 1.00 18.32 O ATOM 138 OE2 GLU A 331 8.944 -5.852 2.123 1.00 16.04 O ATOM 139 H GLU A 331 10.567 -0.996 1.426 1.00 0.00 H ATOM 140 N LEU A 332 13.297 -3.730 -0.003 1.00 8.55 N ATOM 141 CA LEU A 332 13.785 -3.959 -1.374 1.00 10.12 C ATOM 142 C LEU A 332 14.142 -5.412 -1.552 1.00 10.24 C ATOM 143 O LEU A 332 14.446 -6.120 -0.577 1.00 11.92 O ATOM 144 CB LEU A 332 15.087 -3.172 -1.645 1.00 12.14 C ATOM 145 CG LEU A 332 15.106 -1.694 -1.325 1.00 15.03 C ATOM 146 CD1 LEU A 332 15.803 -1.431 0.058 1.00 15.88 C ATOM 147 CD2 LEU A 332 15.944 -1.028 -2.461 1.00 14.78 C ATOM 148 H LEU A 332 13.777 -4.196 0.793 1.00 0.00 H ATOM 149 N LYS A 333 14.101 -5.837 -2.818 1.00 10.24 N ATOM 150 CA LYS A 333 14.575 -7.163 -3.180 1.00 10.40 C ATOM 151 C LYS A 333 15.148 -7.002 -4.596 1.00 10.86 C ATOM 152 O LYS A 333 14.449 -6.576 -5.551 1.00 11.78 O ATOM 153 CB LYS A 333 13.421 -8.141 -3.098 1.00 10.84 C ATOM 154 CG LYS A 333 13.742 -9.623 -3.587 1.00 16.60 C ATOM 155 CD LYS A 333 12.406 -10.465 -3.528 1.00 19.98 C ATOM 156 CE LYS A 333 12.364 -11.582 -4.643 1.00 28.67 C ATOM 157 NZ LYS A 333 11.321 -11.353 -5.783 1.00 32.68 N ATOM 158 HZ1 LYS A 333 10.366 -11.309 -5.374 1.00 0.00 H ATOM 159 HZ2 LYS A 333 11.532 -10.459 -6.270 1.00 0.00 H ATOM 160 HZ3 LYS A 333 11.373 -12.139 -6.462 1.00 0.00 H ATOM 161 H LYS A 333 13.724 -5.209 -3.556 1.00 0.00 H ATOM 162 N ARG A 334 16.435 -7.296 -4.715 1.00 10.58 N ATOM 163 CA ARG A 334 17.107 -7.124 -6.034 1.00 12.17 C ATOM 164 C ARG A 334 16.487 -7.943 -7.139 1.00 13.72 C ATOM 165 O ARG A 334 16.140 -9.158 -6.973 1.00 14.61 O ATOM 166 CB ARG A 334 18.610 -7.455 -5.939 1.00 12.36 C ATOM 167 CG ARG A 334 19.365 -7.151 -7.266 1.00 13.53 C ATOM 168 CD ARG A 334 20.829 -7.543 -7.160 1.00 18.98 C ATOM 169 NE ARG A 334 21.432 -6.898 -5.984 1.00 17.15 N ATOM 170 CZ ARG A 334 21.877 -5.635 -5.983 1.00 19.88 C ATOM 171 NH1 ARG A 334 21.794 -4.912 -7.085 1.00 15.69 N ATOM 172 NH2 ARG A 334 22.361 -5.125 -4.869 1.00 20.99 N ATOM 173 HE ARG A 334 21.517 -7.451 -5.108 1.00 0.00 H ATOM 174 HH12 ARG A 334 22.138 -3.931 -7.090 1.00 0.00 H ATOM 175 HH11 ARG A 334 21.385 -5.324 -7.948 1.00 0.00 H ATOM 176 HH22 ARG A 334 22.710 -4.145 -4.854 1.00 0.00 H ATOM 177 HH21 ARG A 334 22.394 -5.702 -4.004 1.00 0.00 H ATOM 178 H ARG A 334 16.971 -7.644 -3.895 1.00 0.00 H ATOM 179 N ILE A 335 16.350 -7.279 -8.282 1.00 12.98 N ATOM 180 CA ILE A 335 15.936 -7.931 -9.524 1.00 13.73 C ATOM 181 C ILE A 335 17.182 -8.228 -10.396 1.00 16.27 C ATOM 182 O ILE A 335 17.354 -9.369 -10.954 1.00 15.71 O ATOM 183 CB ILE A 335 14.903 -7.116 -10.264 1.00 14.34 C ATOM 184 CG1 ILE A 335 13.601 -7.034 -9.386 1.00 12.64 C ATOM 185 CG2 ILE A 335 14.605 -7.757 -11.668 1.00 15.34 C ATOM 186 CD1 ILE A 335 12.597 -6.091 -9.921 1.00 17.44 C ATOM 187 H ILE A 335 16.544 -6.257 -8.294 1.00 0.00 H ATOM 188 N SER A 336 18.038 -7.218 -10.553 1.00 15.78 N ATOM 189 CA SER A 336 19.198 -7.373 -11.420 1.00 16.74 C ATOM 190 C SER A 336 20.262 -6.346 -11.097 1.00 17.60 C ATOM 191 O SER A 336 20.074 -5.430 -10.228 1.00 14.94 O ATOM 192 CB SER A 336 18.750 -7.278 -12.907 1.00 18.45 C ATOM 193 OG SER A 336 18.272 -5.944 -13.151 1.00 17.55 O ATOM 194 HG SER A 336 18.999 -5.296 -12.973 1.00 0.00 H ATOM 195 H SER A 336 17.877 -6.319 -10.056 1.00 0.00 H ATOM 196 N GLY A 337 21.429 -6.537 -11.722 1.00 16.88 N ATOM 197 CA GLY A 337 22.509 -5.600 -11.592 1.00 15.25 C ATOM 198 C GLY A 337 23.291 -5.773 -10.329 1.00 15.87 C ATOM 199 O GLY A 337 23.007 -6.647 -9.443 1.00 17.10 O ATOM 200 H GLY A 337 21.557 -7.382 -12.315 1.00 0.00 H ATOM 201 N ARG A 338 24.276 -4.911 -10.197 1.00 15.96 N ATOM 202 CA ARG A 338 25.206 -4.937 -9.076 1.00 17.23 C ATOM 203 C ARG A 338 25.781 -3.531 -8.871 1.00 17.59 C ATOM 204 O ARG A 338 26.192 -2.842 -9.810 1.00 17.24 O ATOM 205 CB ARG A 338 26.317 -5.998 -9.266 1.00 18.52 C ATOM 206 CG ARG A 338 27.164 -6.228 -8.033 1.00 21.77 C ATOM 207 CD ARG A 338 28.152 -7.432 -8.230 1.00 26.72 C ATOM 208 NE ARG A 338 29.262 -7.331 -7.276 1.00 31.04 N ATOM 209 CZ ARG A 338 30.375 -8.086 -7.255 1.00 36.53 C ATOM 210 NH1 ARG A 338 30.576 -9.059 -8.147 1.00 36.76 N ATOM 211 NH2 ARG A 338 31.291 -7.873 -6.306 1.00 36.87 N ATOM 212 HE ARG A 338 29.180 -6.601 -6.540 1.00 0.00 H ATOM 213 HH12 ARG A 338 31.446 -9.628 -8.109 1.00 0.00 H ATOM 214 HH11 ARG A 338 29.863 -9.248 -8.880 1.00 0.00 H ATOM 215 HH22 ARG A 338 32.156 -8.450 -6.279 1.00 0.00 H ATOM 216 HH21 ARG A 338 31.139 -7.130 -5.594 1.00 0.00 H ATOM 217 H ARG A 338 24.396 -4.178 -10.925 1.00 0.00 H ATOM 218 N GLY A 339 25.780 -3.077 -7.628 1.00 16.69 N ATOM 219 CA GLY A 339 26.426 -1.817 -7.296 1.00 16.03 C ATOM 220 C GLY A 339 27.734 -2.080 -6.538 1.00 15.48 C ATOM 221 O GLY A 339 27.878 -3.077 -5.793 1.00 14.56 O ATOM 222 H GLY A 339 25.312 -3.627 -6.880 1.00 0.00 H ATOM 223 N PHE A 340 28.637 -1.156 -6.689 1.00 14.75 N ATOM 224 CA PHE A 340 29.914 -1.156 -5.959 1.00 15.12 C ATOM 225 C PHE A 340 30.020 0.125 -5.235 1.00 14.72 C ATOM 226 O PHE A 340 29.852 1.197 -5.838 1.00 14.82 O ATOM 227 CB PHE A 340 31.038 -1.236 -6.962 1.00 15.95 C ATOM 228 CG PHE A 340 30.980 -2.453 -7.813 1.00 20.99 C ATOM 229 CD1 PHE A 340 31.673 -3.619 -7.424 1.00 27.01 C ATOM 230 CD2 PHE A 340 30.230 -2.466 -8.988 1.00 24.97 C ATOM 231 CE1 PHE A 340 31.608 -4.782 -8.216 1.00 28.18 C ATOM 232 CE2 PHE A 340 30.146 -3.601 -9.777 1.00 27.91 C ATOM 233 CZ PHE A 340 30.862 -4.772 -9.401 1.00 27.98 C ATOM 234 H PHE A 340 28.447 -0.382 -7.357 1.00 0.00 H ATOM 235 N LYS A 341 30.311 0.055 -3.951 1.00 15.20 N ATOM 236 CA LYS A 341 30.271 1.256 -3.101 1.00 14.15 C ATOM 237 C LYS A 341 31.684 1.840 -2.880 1.00 14.52 C ATOM 238 O LYS A 341 32.669 1.070 -2.617 1.00 13.21 O ATOM 239 CB LYS A 341 29.568 0.889 -1.773 1.00 11.35 C ATOM 240 CG LYS A 341 29.496 2.109 -0.786 1.00 17.66 C ATOM 241 CD LYS A 341 28.643 1.762 0.440 1.00 21.33 C ATOM 242 CE LYS A 341 29.213 0.639 1.241 1.00 28.87 C ATOM 243 NZ LYS A 341 30.503 1.188 1.772 1.00 30.05 N ATOM 244 HZ1 LYS A 341 31.118 1.454 0.977 1.00 0.00 H ATOM 245 HZ2 LYS A 341 30.307 2.026 2.356 1.00 0.00 H ATOM 246 HZ3 LYS A 341 30.975 0.464 2.350 1.00 0.00 H ATOM 247 H LYS A 341 30.572 -0.861 -3.533 1.00 0.00 H ATOM 248 N ASN A 342 31.815 3.148 -3.067 1.00 13.65 N ATOM 249 CA ASN A 342 33.048 3.910 -2.815 1.00 15.48 C ATOM 250 C ASN A 342 32.748 5.194 -2.036 1.00 15.40 C ATOM 251 O ASN A 342 31.796 5.906 -2.396 1.00 13.93 O ATOM 252 CB ASN A 342 33.601 4.372 -4.130 1.00 18.23 C ATOM 253 CG ASN A 342 33.913 3.226 -5.079 1.00 24.46 C ATOM 254 OD1 ASN A 342 34.749 2.375 -4.771 1.00 29.27 O ATOM 255 ND2 ASN A 342 33.229 3.202 -6.260 1.00 29.33 N ATOM 256 HD22 ASN A 342 32.533 3.945 -6.473 1.00 0.00 H ATOM 257 HD21 ASN A 342 33.404 2.441 -6.947 1.00 0.00 H ATOM 258 H ASN A 342 30.987 3.671 -3.417 1.00 0.00 H ATOM 259 N ASP A 343 33.546 5.540 -1.023 1.00 15.16 N ATOM 260 CA ASP A 343 33.342 6.807 -0.301 1.00 16.17 C ATOM 261 C ASP A 343 33.645 7.987 -1.229 1.00 18.01 C ATOM 262 O ASP A 343 34.662 7.953 -1.955 1.00 19.49 O ATOM 263 CB ASP A 343 34.227 6.863 0.954 1.00 16.15 C ATOM 264 CG ASP A 343 33.564 6.222 2.218 1.00 18.97 C ATOM 265 OD1 ASP A 343 32.400 5.786 2.157 1.00 23.22 O ATOM 266 OD2 ASP A 343 34.166 6.265 3.325 1.00 18.20 O ATOM 267 H ASP A 343 34.321 4.907 -0.740 1.00 0.00 H ATOM 268 N GLU A 344 32.753 8.984 -1.256 1.00 16.45 N ATOM 269 CA GLU A 344 32.929 10.199 -2.009 1.00 17.48 C ATOM 270 C GLU A 344 32.561 11.391 -1.133 1.00 17.15 C ATOM 271 O GLU A 344 31.738 11.287 -0.212 1.00 16.22 O ATOM 272 CB GLU A 344 32.053 10.181 -3.281 1.00 18.32 C ATOM 273 CG GLU A 344 32.274 8.973 -4.100 1.00 21.17 C ATOM 274 CD GLU A 344 31.660 9.006 -5.443 1.00 28.10 C ATOM 275 OE1 GLU A 344 31.960 8.066 -6.228 1.00 28.96 O ATOM 276 OE2 GLU A 344 30.909 9.967 -5.734 1.00 30.74 O ATOM 277 H GLU A 344 31.881 8.875 -0.700 1.00 0.00 H ATOM 278 N GLU A 345 33.193 12.535 -1.383 1.00 16.86 N ATOM 279 CA GLU A 345 32.848 13.742 -0.577 1.00 19.40 C ATOM 280 C GLU A 345 31.693 14.440 -1.289 1.00 19.15 C ATOM 281 O GLU A 345 31.860 14.949 -2.391 1.00 20.10 O ATOM 282 CB GLU A 345 34.039 14.688 -0.559 1.00 20.47 C ATOM 283 CG GLU A 345 35.321 14.028 -0.203 1.00 24.75 C ATOM 284 CD GLU A 345 35.317 13.395 1.146 1.00 31.87 C ATOM 285 OE1 GLU A 345 35.098 14.131 2.109 1.00 36.84 O ATOM 286 OE2 GLU A 345 35.556 12.162 1.236 1.00 37.68 O ATOM 287 H GLU A 345 33.916 12.587 -2.129 1.00 0.00 H ATOM 288 N ILE A 346 30.534 14.482 -0.644 1.00 17.80 N ATOM 289 CA ILE A 346 29.334 14.891 -1.331 1.00 16.98 C ATOM 290 C ILE A 346 28.939 16.210 -0.744 1.00 15.94 C ATOM 291 O ILE A 346 28.780 16.337 0.469 1.00 16.31 O ATOM 292 CB ILE A 346 28.177 13.864 -1.093 1.00 17.01 C ATOM 293 CG1 ILE A 346 28.559 12.496 -1.684 1.00 16.69 C ATOM 294 CG2 ILE A 346 26.811 14.385 -1.749 1.00 17.03 C ATOM 295 CD1 ILE A 346 28.698 12.448 -3.150 1.00 18.62 C ATOM 296 H ILE A 346 30.491 14.219 0.361 1.00 0.00 H ATOM 297 N LEU A 347 28.765 17.167 -1.627 1.00 17.62 N ATOM 298 CA LEU A 347 28.195 18.458 -1.237 1.00 18.99 C ATOM 299 C LEU A 347 26.667 18.318 -1.060 1.00 18.89 C ATOM 300 O LEU A 347 25.947 17.961 -2.008 1.00 20.01 O ATOM 301 CB LEU A 347 28.417 19.407 -2.380 1.00 20.85 C ATOM 302 CG LEU A 347 28.576 20.922 -2.091 1.00 25.97 C ATOM 303 CD1 LEU A 347 27.935 21.716 -3.236 1.00 28.44 C ATOM 304 CD2 LEU A 347 28.212 21.441 -0.660 1.00 25.14 C ATOM 305 H LEU A 347 29.036 17.005 -2.618 1.00 0.00 H ATOM 306 N ILE A 348 26.180 18.604 0.134 1.00 17.80 N ATOM 307 CA ILE A 348 24.748 18.651 0.338 1.00 17.48 C ATOM 308 C ILE A 348 24.196 20.086 0.285 1.00 18.50 C ATOM 309 O ILE A 348 24.934 21.062 0.396 1.00 19.64 O ATOM 310 CB ILE A 348 24.295 17.850 1.553 1.00 16.84 C ATOM 311 CG1 ILE A 348 24.619 18.527 2.884 1.00 16.29 C ATOM 312 CG2 ILE A 348 24.794 16.327 1.390 1.00 17.98 C ATOM 313 CD1 ILE A 348 23.912 17.884 3.992 1.00 16.60 C ATOM 314 H ILE A 348 26.825 18.795 0.927 1.00 0.00 H ATOM 315 N GLY A 349 22.903 20.204 0.111 1.00 17.39 N ATOM 316 CA GLY A 349 22.349 21.499 -0.280 1.00 20.06 C ATOM 317 C GLY A 349 22.490 22.629 0.738 1.00 21.21 C ATOM 318 O GLY A 349 22.241 23.793 0.382 1.00 22.59 O ATOM 319 H GLY A 349 22.277 19.385 0.250 1.00 0.00 H ATOM 320 N ASN A 350 22.823 22.311 1.990 1.00 18.56 N ATOM 321 CA ASN A 350 23.056 23.327 3.036 1.00 19.44 C ATOM 322 C ASN A 350 24.525 23.777 3.053 1.00 20.61 C ATOM 323 O ASN A 350 24.918 24.541 3.943 1.00 21.61 O ATOM 324 CB ASN A 350 22.632 22.819 4.440 1.00 18.40 C ATOM 325 CG ASN A 350 23.451 21.611 4.918 1.00 17.95 C ATOM 326 OD1 ASN A 350 24.508 21.353 4.422 1.00 19.36 O ATOM 327 ND2 ASN A 350 22.939 20.876 5.905 1.00 20.63 N ATOM 328 HD22 ASN A 350 22.017 21.127 6.316 1.00 0.00 H ATOM 329 HD21 ASN A 350 23.462 20.052 6.265 1.00 0.00 H ATOM 330 H ASN A 350 22.923 21.306 2.240 1.00 0.00 H ATOM 331 N GLY A 351 25.334 23.317 2.095 1.00 20.92 N ATOM 332 CA GLY A 351 26.736 23.743 2.034 1.00 22.87 C ATOM 333 C GLY A 351 27.737 22.771 2.635 1.00 23.38 C ATOM 334 O GLY A 351 28.900 22.860 2.336 1.00 27.33 O ATOM 335 H GLY A 351 24.966 22.651 1.386 1.00 0.00 H ATOM 336 N THR A 352 27.316 21.844 3.474 1.00 24.07 N ATOM 337 CA THR A 352 28.264 20.958 4.161 1.00 23.07 C ATOM 338 C THR A 352 28.765 19.960 3.107 1.00 23.85 C ATOM 339 O THR A 352 28.045 19.656 2.154 1.00 23.01 O ATOM 340 CB THR A 352 27.648 20.205 5.324 1.00 23.65 C ATOM 341 OG1 THR A 352 26.498 19.537 4.841 1.00 30.01 O ATOM 342 CG2 THR A 352 27.199 21.117 6.474 1.00 19.93 C ATOM 343 HG1 THR A 352 25.858 20.202 4.482 1.00 0.00 H ATOM 344 H THR A 352 26.297 21.739 3.652 1.00 0.00 H ATOM 345 N ILE A 353 29.987 19.479 3.272 1.00 21.94 N ATOM 346 CA ILE A 353 30.479 18.358 2.452 1.00 22.01 C ATOM 347 C ILE A 353 30.572 17.200 3.422 1.00 20.87 C ATOM 348 O ILE A 353 31.173 17.364 4.492 1.00 20.80 O ATOM 349 CB ILE A 353 31.884 18.666 1.852 1.00 21.60 C ATOM 350 CG1 ILE A 353 31.823 19.872 0.903 1.00 24.54 C ATOM 351 CG2 ILE A 353 32.371 17.445 1.052 1.00 23.77 C ATOM 352 CD1 ILE A 353 33.182 20.580 0.682 1.00 27.59 C ATOM 353 H ILE A 353 30.610 19.899 3.992 1.00 0.00 H ATOM 354 N GLN A 354 29.973 16.051 3.068 1.00 17.71 N ATOM 355 CA GLN A 354 29.950 14.911 3.930 1.00 17.43 C ATOM 356 C GLN A 354 30.437 13.726 3.156 1.00 15.45 C ATOM 357 O GLN A 354 30.081 13.533 2.022 1.00 14.43 O ATOM 358 CB GLN A 354 28.522 14.587 4.436 1.00 17.14 C ATOM 359 CG GLN A 354 28.522 13.553 5.617 1.00 19.81 C ATOM 360 CD GLN A 354 29.052 14.159 6.929 1.00 23.14 C ATOM 361 OE1 GLN A 354 29.555 13.433 7.830 1.00 25.28 O ATOM 362 NE2 GLN A 354 28.947 15.481 7.051 1.00 19.03 N ATOM 363 HE22 GLN A 354 28.526 16.042 6.284 1.00 0.00 H ATOM 364 HE21 GLN A 354 29.286 15.952 7.914 1.00 0.00 H ATOM 365 H GLN A 354 29.512 15.989 2.138 1.00 0.00 H ATOM 366 N LYS A 355 31.331 12.978 3.765 1.00 14.88 N ATOM 367 CA LYS A 355 31.728 11.706 3.157 1.00 13.91 C ATOM 368 C LYS A 355 30.621 10.672 3.248 1.00 11.28 C ATOM 369 O LYS A 355 30.113 10.352 4.340 1.00 13.89 O ATOM 370 CB LYS A 355 33.003 11.170 3.825 1.00 13.21 C ATOM 371 CG LYS A 355 33.665 10.011 3.123 1.00 15.34 C ATOM 372 CD LYS A 355 34.827 9.515 4.088 1.00 18.43 C ATOM 373 CE LYS A 355 36.027 10.441 4.329 1.00 25.41 C ATOM 374 NZ LYS A 355 36.779 10.541 3.065 1.00 31.04 N ATOM 375 HZ1 LYS A 355 37.104 9.595 2.780 1.00 0.00 H ATOM 376 HZ2 LYS A 355 36.162 10.934 2.326 1.00 0.00 H ATOM 377 HZ3 LYS A 355 37.600 11.165 3.200 1.00 0.00 H ATOM 378 H LYS A 355 31.750 13.285 4.666 1.00 0.00 H ATOM 379 N ILE A 356 30.233 10.147 2.090 1.00 10.72 N ATOM 380 CA ILE A 356 29.129 9.131 1.983 1.00 11.78 C ATOM 381 C ILE A 356 29.569 7.986 1.093 1.00 9.75 C ATOM 382 O ILE A 356 30.235 8.208 0.076 1.00 9.57 O ATOM 383 CB ILE A 356 27.839 9.755 1.395 1.00 12.92 C ATOM 384 CG1 ILE A 356 27.412 10.953 2.282 1.00 15.77 C ATOM 385 CG2 ILE A 356 26.717 8.692 1.322 1.00 13.43 C ATOM 386 CD1 ILE A 356 26.252 11.614 1.750 1.00 16.03 C ATOM 387 H ILE A 356 30.714 10.452 1.220 1.00 0.00 H ATOM 388 N GLY A 357 29.243 6.745 1.459 1.00 10.17 N ATOM 389 CA GLY A 357 29.464 5.666 0.480 1.00 9.03 C ATOM 390 C GLY A 357 28.445 5.670 -0.646 1.00 12.75 C ATOM 391 O GLY A 357 27.212 5.505 -0.413 1.00 12.46 O ATOM 392 H GLY A 357 28.848 6.547 2.400 1.00 0.00 H ATOM 393 N ILE A 358 28.960 5.895 -1.856 1.00 10.61 N ATOM 394 CA ILE A 358 28.148 6.048 -3.041 1.00 9.13 C ATOM 395 C ILE A 358 28.224 4.794 -3.908 1.00 8.54 C ATOM 396 O ILE A 358 29.336 4.280 -4.223 1.00 10.54 O ATOM 397 CB ILE A 358 28.620 7.282 -3.896 1.00 9.36 C ATOM 398 CG1 ILE A 358 28.426 8.566 -3.083 1.00 10.40 C ATOM 399 CG2 ILE A 358 27.901 7.270 -5.240 1.00 8.10 C ATOM 400 CD1 ILE A 358 26.921 8.791 -2.644 1.00 12.25 C ATOM 401 H ILE A 358 29.993 5.963 -1.950 1.00 0.00 H ATOM 402 N TRP A 359 27.050 4.293 -4.293 1.00 8.77 N ATOM 403 CA TRP A 359 26.978 3.068 -5.116 1.00 9.41 C ATOM 404 C TRP A 359 27.115 3.434 -6.596 1.00 11.56 C ATOM 405 O TRP A 359 26.477 4.347 -7.098 1.00 12.30 O ATOM 406 CB TRP A 359 25.677 2.327 -4.841 1.00 9.58 C ATOM 407 CG TRP A 359 25.633 1.895 -3.428 1.00 8.73 C ATOM 408 CD1 TRP A 359 25.174 2.613 -2.328 1.00 11.26 C ATOM 409 CD2 TRP A 359 26.088 0.626 -2.924 1.00 8.46 C ATOM 410 NE1 TRP A 359 25.331 1.846 -1.188 1.00 9.08 N ATOM 411 CE2 TRP A 359 25.853 0.618 -1.540 1.00 12.06 C ATOM 412 CE3 TRP A 359 26.611 -0.542 -3.543 1.00 10.70 C ATOM 413 CZ2 TRP A 359 26.148 -0.496 -0.733 1.00 14.79 C ATOM 414 CZ3 TRP A 359 26.935 -1.645 -2.751 1.00 15.76 C ATOM 415 CH2 TRP A 359 26.702 -1.610 -1.341 1.00 16.55 C ATOM 416 HE1 TRP A 359 25.094 2.146 -0.221 1.00 0.00 H ATOM 417 H TRP A 359 26.171 4.772 -4.010 1.00 0.00 H ATOM 418 N ASP A 360 27.964 2.674 -7.301 1.00 11.55 N ATOM 419 CA ASP A 360 28.127 2.843 -8.774 1.00 13.62 C ATOM 420 C ASP A 360 27.672 1.569 -9.432 1.00 13.54 C ATOM 421 O ASP A 360 27.979 0.489 -8.941 1.00 15.91 O ATOM 422 CB ASP A 360 29.649 2.983 -9.077 1.00 14.36 C ATOM 423 CG ASP A 360 29.941 3.339 -10.555 1.00 21.56 C ATOM 424 OD1 ASP A 360 29.052 3.785 -11.317 1.00 21.50 O ATOM 425 OD2 ASP A 360 31.113 3.189 -10.920 1.00 29.32 O ATOM 426 H ASP A 360 28.523 1.948 -6.809 1.00 0.00 H ATOM 427 N GLY A 361 26.982 1.694 -10.555 1.00 15.01 N ATOM 428 CA GLY A 361 26.495 0.532 -11.335 1.00 15.88 C ATOM 429 C GLY A 361 24.981 0.570 -11.569 1.00 17.10 C ATOM 430 O GLY A 361 24.219 1.239 -10.827 1.00 15.86 O ATOM 431 H GLY A 361 26.772 2.651 -10.905 1.00 0.00 H ATOM 432 N GLU A 362 24.540 -0.067 -12.652 1.00 16.06 N ATOM 433 CA GLU A 362 23.085 -0.228 -12.866 1.00 16.55 C ATOM 434 C GLU A 362 22.499 -1.306 -11.918 1.00 14.23 C ATOM 435 O GLU A 362 23.042 -2.408 -11.781 1.00 13.66 O ATOM 436 CB GLU A 362 22.772 -0.541 -14.369 1.00 17.37 C ATOM 437 CG GLU A 362 23.533 0.464 -15.249 1.00 26.74 C ATOM 438 CD GLU A 362 22.698 1.213 -16.343 1.00 40.64 C ATOM 439 OE1 GLU A 362 21.937 0.571 -17.143 1.00 44.04 O ATOM 440 OE2 GLU A 362 22.875 2.464 -16.430 1.00 43.30 O ATOM 441 H GLU A 362 25.215 -0.450 -13.344 1.00 0.00 H ATOM 442 N GLU A 363 21.414 -0.963 -11.227 1.00 10.78 N ATOM 443 CA GLU A 363 20.701 -1.873 -10.321 1.00 10.99 C ATOM 444 C GLU A 363 19.215 -1.733 -10.461 1.00 11.38 C ATOM 445 O GLU A 363 18.699 -0.598 -10.693 1.00 11.73 O ATOM 446 CB GLU A 363 21.048 -1.553 -8.851 1.00 9.04 C ATOM 447 CG GLU A 363 22.561 -1.784 -8.570 1.00 10.51 C ATOM 448 CD GLU A 363 22.901 -1.407 -7.146 1.00 12.76 C ATOM 449 OE1 GLU A 363 23.341 -0.247 -6.852 1.00 16.78 O ATOM 450 OE2 GLU A 363 22.708 -2.300 -6.306 1.00 13.04 O ATOM 451 H GLU A 363 21.050 0.005 -11.335 1.00 0.00 H ATOM 452 N GLU A 364 18.504 -2.858 -10.314 1.00 10.46 N ATOM 453 CA GLU A 364 17.086 -2.807 -10.385 1.00 11.82 C ATOM 454 C GLU A 364 16.500 -3.576 -9.183 1.00 10.13 C ATOM 455 O GLU A 364 16.957 -4.642 -8.891 1.00 12.08 O ATOM 456 CB GLU A 364 16.572 -3.431 -11.694 1.00 13.74 C ATOM 457 CG GLU A 364 15.037 -3.536 -11.843 1.00 15.94 C ATOM 458 CD GLU A 364 14.561 -3.846 -13.289 1.00 30.70 C ATOM 459 OE1 GLU A 364 15.200 -3.349 -14.260 1.00 38.07 O ATOM 460 OE2 GLU A 364 13.534 -4.564 -13.470 1.00 35.20 O ATOM 461 H GLU A 364 18.987 -3.764 -10.149 1.00 0.00 H ATOM 462 N PHE A 365 15.487 -3.012 -8.522 1.00 9.10 N ATOM 463 CA PHE A 365 14.922 -3.635 -7.278 1.00 8.08 C ATOM 464 C PHE A 365 13.408 -3.621 -7.314 1.00 8.00 C ATOM 465 O PHE A 365 12.766 -2.687 -7.794 1.00 10.34 O ATOM 466 CB PHE A 365 15.323 -2.842 -5.974 1.00 8.97 C ATOM 467 CG PHE A 365 16.792 -2.798 -5.704 1.00 8.86 C ATOM 468 CD1 PHE A 365 17.400 -3.805 -4.918 1.00 11.29 C ATOM 469 CD2 PHE A 365 17.587 -1.763 -6.227 1.00 10.66 C ATOM 470 CE1 PHE A 365 18.776 -3.752 -4.639 1.00 13.26 C ATOM 471 CE2 PHE A 365 18.943 -1.747 -5.975 1.00 12.59 C ATOM 472 CZ PHE A 365 19.538 -2.708 -5.190 1.00 12.27 C ATOM 473 H PHE A 365 15.080 -2.123 -8.876 1.00 0.00 H ATOM 474 N HIS A 366 12.777 -4.697 -6.818 1.00 8.28 N ATOM 475 CA HIS A 366 11.469 -4.517 -6.258 1.00 7.04 C ATOM 476 C HIS A 366 11.593 -3.685 -4.971 1.00 6.82 C ATOM 477 O HIS A 366 12.527 -3.863 -4.116 1.00 7.71 O ATOM 478 CB HIS A 366 10.876 -5.920 -5.805 1.00 7.61 C ATOM 479 CG HIS A 366 10.564 -6.861 -6.925 1.00 10.04 C ATOM 480 ND1 HIS A 366 9.516 -6.677 -7.812 1.00 13.31 N ATOM 481 CD2 HIS A 366 11.179 -8.010 -7.301 1.00 14.08 C ATOM 482 CE1 HIS A 366 9.495 -7.687 -8.669 1.00 17.85 C ATOM 483 NE2 HIS A 366 10.488 -8.512 -8.367 1.00 15.18 N ATOM 484 H HIS A 366 13.224 -5.636 -6.839 1.00 0.00 H ATOM 485 N VAL A 367 10.602 -2.843 -4.783 1.00 7.29 N ATOM 486 CA VAL A 367 10.560 -1.971 -3.610 1.00 7.20 C ATOM 487 C VAL A 367 9.132 -1.945 -3.005 1.00 7.64 C ATOM 488 O VAL A 367 8.137 -2.181 -3.686 1.00 9.12 O ATOM 489 CB VAL A 367 10.968 -0.513 -3.945 1.00 5.33 C ATOM 490 CG1 VAL A 367 12.515 -0.417 -4.191 1.00 6.93 C ATOM 491 CG2 VAL A 367 10.087 0.057 -5.140 1.00 4.40 C ATOM 492 H VAL A 367 9.833 -2.796 -5.482 1.00 0.00 H ATOM 493 N ARG A 368 9.043 -1.552 -1.746 1.00 6.72 N ATOM 494 CA ARG A 368 7.733 -1.485 -1.082 1.00 8.12 C ATOM 495 C ARG A 368 7.801 -0.470 0.051 1.00 7.85 C ATOM 496 O ARG A 368 8.803 -0.371 0.736 1.00 7.79 O ATOM 497 CB ARG A 368 7.363 -2.853 -0.456 1.00 7.26 C ATOM 498 CG ARG A 368 5.981 -2.762 0.278 1.00 7.90 C ATOM 499 CD ARG A 368 5.644 -4.132 0.858 1.00 6.31 C ATOM 500 NE ARG A 368 6.431 -4.476 2.034 1.00 10.83 N ATOM 501 CZ ARG A 368 6.101 -4.132 3.287 1.00 10.50 C ATOM 502 NH1 ARG A 368 5.076 -3.334 3.511 1.00 9.80 N ATOM 503 NH2 ARG A 368 6.868 -4.574 4.303 1.00 8.79 N ATOM 504 HE ARG A 368 7.304 -5.023 1.893 1.00 0.00 H ATOM 505 HH12 ARG A 368 4.825 -3.071 4.485 1.00 0.00 H ATOM 506 HH11 ARG A 368 4.518 -2.968 2.713 1.00 0.00 H ATOM 507 HH22 ARG A 368 6.630 -4.319 5.283 1.00 0.00 H ATOM 508 HH21 ARG A 368 7.698 -5.170 4.107 1.00 0.00 H ATOM 509 H ARG A 368 9.903 -1.289 -1.223 1.00 0.00 H ATOM 510 N CYS A 369 6.752 0.302 0.251 1.00 6.26 N ATOM 511 CA CYS A 369 6.591 1.021 1.523 1.00 9.47 C ATOM 512 C CYS A 369 5.125 0.811 1.877 1.00 10.78 C ATOM 513 O CYS A 369 4.240 1.264 1.153 1.00 9.58 O ATOM 514 CB CYS A 369 6.967 2.521 1.324 1.00 12.45 C ATOM 515 SG CYS A 369 6.699 3.484 2.869 1.00 15.86 S ATOM 516 H CYS A 369 6.034 0.403 -0.495 1.00 0.00 H ATOM 517 N GLY A 370 4.842 0.126 2.971 1.00 10.23 N ATOM 518 CA GLY A 370 3.417 -0.099 3.203 1.00 11.39 C ATOM 519 C GLY A 370 2.725 -0.882 2.132 1.00 10.89 C ATOM 520 O GLY A 370 3.147 -1.991 1.715 1.00 9.58 O ATOM 521 H GLY A 370 5.577 -0.226 3.617 1.00 0.00 H ATOM 522 N GLU A 371 1.589 -0.345 1.701 1.00 10.27 N ATOM 523 CA GLU A 371 0.771 -0.966 0.655 1.00 11.31 C ATOM 524 C GLU A 371 1.176 -0.580 -0.803 1.00 11.09 C ATOM 525 O GLU A 371 0.554 -1.032 -1.791 1.00 13.15 O ATOM 526 CB GLU A 371 -0.667 -0.488 0.874 1.00 14.26 C ATOM 527 CG GLU A 371 -1.284 -1.101 2.121 1.00 21.46 C ATOM 528 CD GLU A 371 -2.683 -0.452 2.431 1.00 29.91 C ATOM 529 OE1 GLU A 371 -2.838 0.214 3.469 1.00 34.03 O ATOM 530 OE2 GLU A 371 -3.604 -0.560 1.603 1.00 32.54 O ATOM 531 H GLU A 371 1.268 0.550 2.122 1.00 0.00 H ATOM 532 N CYS A 372 2.196 0.255 -0.925 1.00 9.14 N ATOM 533 CA CYS A 372 2.639 0.690 -2.259 1.00 9.20 C ATOM 534 C CYS A 372 3.899 -0.097 -2.670 1.00 10.06 C ATOM 535 O CYS A 372 4.822 -0.210 -1.885 1.00 9.88 O ATOM 536 CB CYS A 372 2.900 2.184 -2.253 1.00 9.89 C ATOM 537 SG CYS A 372 3.296 2.872 -3.924 1.00 12.17 S ATOM 538 H CYS A 372 2.685 0.604 -0.076 1.00 0.00 H ATOM 539 N ARG A 373 3.892 -0.683 -3.859 1.00 10.13 N ATOM 540 CA ARG A 373 5.048 -1.447 -4.324 1.00 10.34 C ATOM 541 C ARG A 373 5.450 -0.987 -5.695 1.00 10.71 C ATOM 542 O ARG A 373 4.622 -0.399 -6.420 1.00 10.96 O ATOM 543 CB ARG A 373 4.780 -2.946 -4.283 1.00 11.55 C ATOM 544 CG ARG A 373 3.578 -3.390 -5.028 1.00 17.01 C ATOM 545 CD ARG A 373 3.096 -4.744 -4.465 1.00 21.71 C ATOM 546 NE ARG A 373 1.684 -4.787 -4.844 1.00 29.60 N ATOM 547 CZ ARG A 373 0.621 -4.545 -4.088 1.00 26.12 C ATOM 548 NH1 ARG A 373 0.674 -4.374 -2.751 1.00 26.09 N ATOM 549 NH2 ARG A 373 -0.556 -4.596 -4.712 1.00 30.66 N ATOM 550 HE ARG A 373 1.488 -5.040 -5.834 1.00 0.00 H ATOM 551 HH12 ARG A 373 -0.198 -4.187 -2.216 1.00 0.00 H ATOM 552 HH11 ARG A 373 1.587 -4.429 -2.255 1.00 0.00 H ATOM 553 HH22 ARG A 373 -1.433 -4.417 -4.183 1.00 0.00 H ATOM 554 HH21 ARG A 373 -0.597 -4.815 -5.728 1.00 0.00 H ATOM 555 H ARG A 373 3.054 -0.598 -4.468 1.00 0.00 H ATOM 556 N GLY A 374 6.693 -1.295 -6.039 1.00 9.63 N ATOM 557 CA GLY A 374 7.165 -0.689 -7.288 1.00 11.73 C ATOM 558 C GLY A 374 8.383 -1.430 -7.770 1.00 9.31 C ATOM 559 O GLY A 374 8.840 -2.374 -7.140 1.00 8.64 O ATOM 560 H GLY A 374 7.291 -1.922 -5.464 1.00 0.00 H ATOM 561 N ILE A 375 8.933 -0.953 -8.871 1.00 7.40 N ATOM 562 CA ILE A 375 10.207 -1.379 -9.378 1.00 7.95 C ATOM 563 C ILE A 375 11.055 -0.136 -9.591 1.00 7.67 C ATOM 564 O ILE A 375 10.631 0.742 -10.229 1.00 8.20 O ATOM 565 CB ILE A 375 10.049 -2.162 -10.675 1.00 9.29 C ATOM 566 CG1 ILE A 375 9.323 -3.461 -10.369 1.00 13.30 C ATOM 567 CG2 ILE A 375 11.311 -2.409 -11.255 1.00 12.89 C ATOM 568 CD1 ILE A 375 8.853 -4.217 -11.528 1.00 20.75 C ATOM 569 H ILE A 375 8.413 -0.226 -9.403 1.00 0.00 H ATOM 570 N LEU A 376 12.207 -0.127 -8.953 1.00 7.88 N ATOM 571 CA LEU A 376 13.183 0.937 -9.012 1.00 4.48 C ATOM 572 C LEU A 376 14.402 0.563 -9.827 1.00 8.80 C ATOM 573 O LEU A 376 14.962 -0.428 -9.573 1.00 9.48 O ATOM 574 CB LEU A 376 13.737 1.246 -7.617 1.00 20.00 C ATOM 575 CG LEU A 376 14.775 2.347 -7.522 1.00 20.00 C ATOM 576 CD1 LEU A 376 14.242 3.688 -8.016 1.00 20.00 C ATOM 577 CD2 LEU A 376 15.354 2.453 -6.123 1.00 20.00 C ATOM 578 H LEU A 376 12.432 -0.951 -8.360 1.00 0.00 H ATOM 579 N LYS A 377 14.792 1.451 -10.718 1.00 8.66 N ATOM 580 CA LYS A 377 15.993 1.302 -11.511 1.00 10.53 C ATOM 581 C LYS A 377 16.842 2.520 -11.215 1.00 9.15 C ATOM 582 O LYS A 377 16.366 3.615 -11.321 1.00 11.55 O ATOM 583 CB LYS A 377 15.701 1.314 -13.008 1.00 12.59 C ATOM 584 CG LYS A 377 14.816 0.226 -13.490 1.00 22.54 C ATOM 585 CD LYS A 377 14.446 0.350 -15.007 1.00 28.42 C ATOM 586 CE LYS A 377 13.454 -0.705 -15.458 1.00 34.65 C ATOM 587 NZ LYS A 377 12.872 -0.585 -16.860 1.00 40.20 N ATOM 588 HZ1 LYS A 377 12.365 0.319 -16.947 1.00 0.00 H ATOM 589 HZ2 LYS A 377 13.642 -0.621 -17.558 1.00 0.00 H ATOM 590 HZ3 LYS A 377 12.213 -1.371 -17.029 1.00 0.00 H ATOM 591 H LYS A 377 14.209 2.300 -10.858 1.00 0.00 H ATOM 592 N LYS A 378 18.084 2.277 -10.851 1.00 11.30 N ATOM 593 CA LYS A 378 18.989 3.345 -10.452 1.00 10.95 C ATOM 594 C LYS A 378 20.319 3.160 -11.168 1.00 11.74 C ATOM 595 O LYS A 378 20.634 2.058 -11.682 1.00 13.01 O ATOM 596 CB LYS A 378 19.232 3.424 -8.890 1.00 13.81 C ATOM 597 CG LYS A 378 20.292 2.371 -8.444 1.00 13.41 C ATOM 598 CD LYS A 378 20.792 2.473 -7.015 1.00 17.38 C ATOM 599 CE LYS A 378 21.349 3.779 -6.659 1.00 21.33 C ATOM 600 NZ LYS A 378 22.671 3.959 -7.273 1.00 18.71 N ATOM 601 HZ1 LYS A 378 23.313 3.214 -6.935 1.00 0.00 H ATOM 602 HZ2 LYS A 378 22.582 3.899 -8.308 1.00 0.00 H ATOM 603 HZ3 LYS A 378 23.050 4.891 -7.009 1.00 0.00 H ATOM 604 H LYS A 378 18.428 1.295 -10.849 1.00 0.00 H ATOM 605 N SER A 379 21.055 4.256 -11.348 1.00 12.08 N ATOM 606 CA SER A 379 22.497 4.138 -11.691 1.00 12.91 C ATOM 607 C SER A 379 23.234 5.056 -10.713 1.00 12.87 C ATOM 608 O SER A 379 22.633 5.519 -9.709 1.00 12.66 O ATOM 609 CB SER A 379 22.747 4.580 -13.161 1.00 14.31 C ATOM 610 OG SER A 379 22.230 5.873 -13.315 1.00 14.29 O ATOM 611 HG SER A 379 22.689 6.487 -12.689 1.00 0.00 H ATOM 612 H SER A 379 20.620 5.195 -11.248 1.00 0.00 H ATOM 613 N LYS A 380 24.515 5.333 -10.947 1.00 12.86 N ATOM 614 CA LYS A 380 25.265 6.033 -9.932 1.00 11.64 C ATOM 615 C LYS A 380 24.637 7.416 -9.718 1.00 12.47 C ATOM 616 O LYS A 380 24.524 8.229 -10.667 1.00 10.49 O ATOM 617 CB LYS A 380 26.703 6.283 -10.359 1.00 12.71 C ATOM 618 CG LYS A 380 27.500 7.012 -9.324 1.00 12.57 C ATOM 619 CD LYS A 380 28.999 7.070 -9.781 1.00 14.75 C ATOM 620 CE LYS A 380 29.770 7.708 -8.668 1.00 21.34 C ATOM 621 NZ LYS A 380 31.228 7.807 -9.004 1.00 30.54 N ATOM 622 HZ1 LYS A 380 31.610 6.854 -9.169 1.00 0.00 H ATOM 623 HZ2 LYS A 380 31.346 8.382 -9.862 1.00 0.00 H ATOM 624 HZ3 LYS A 380 31.735 8.253 -8.213 1.00 0.00 H ATOM 625 H LYS A 380 24.965 5.051 -11.841 1.00 0.00 H ATOM 626 N MET A 381 24.257 7.680 -8.481 1.00 10.37 N ATOM 627 CA MET A 381 23.623 8.981 -8.109 1.00 9.61 C ATOM 628 C MET A 381 22.459 9.386 -9.035 1.00 10.81 C ATOM 629 O MET A 381 22.291 10.582 -9.389 1.00 9.70 O ATOM 630 CB MET A 381 24.700 10.082 -7.936 1.00 8.47 C ATOM 631 CG MET A 381 25.600 9.672 -6.707 1.00 12.15 C ATOM 632 SD MET A 381 26.813 10.943 -6.263 1.00 21.46 S ATOM 633 CE MET A 381 27.754 10.910 -7.717 1.00 24.78 C ATOM 634 H MET A 381 24.403 6.961 -7.744 1.00 0.00 H ATOM 635 N LYS A 382 21.637 8.409 -9.419 1.00 8.23 N ATOM 636 CA LYS A 382 20.547 8.697 -10.289 1.00 9.55 C ATOM 637 C LYS A 382 19.380 7.756 -10.166 1.00 10.24 C ATOM 638 O LYS A 382 19.522 6.541 -10.357 1.00 10.87 O ATOM 639 CB LYS A 382 21.059 8.776 -11.785 1.00 9.99 C ATOM 640 CG LYS A 382 19.959 9.033 -12.794 1.00 12.88 C ATOM 641 CD LYS A 382 19.509 10.482 -12.775 1.00 13.50 C ATOM 642 CE LYS A 382 18.392 10.690 -13.836 1.00 19.35 C ATOM 643 NZ LYS A 382 18.936 10.348 -15.221 1.00 25.39 N ATOM 644 HZ1 LYS A 382 19.742 10.969 -15.439 1.00 0.00 H ATOM 645 HZ2 LYS A 382 19.248 9.356 -15.234 1.00 0.00 H ATOM 646 HZ3 LYS A 382 18.188 10.487 -15.930 1.00 0.00 H ATOM 647 H LYS A 382 21.792 7.437 -9.083 1.00 0.00 H ATOM 648 N LEU A 383 18.197 8.298 -9.845 1.00 9.09 N ATOM 649 CA LEU A 383 16.948 7.485 -10.020 1.00 9.08 C ATOM 650 C LEU A 383 16.607 7.507 -11.506 1.00 10.69 C ATOM 651 O LEU A 383 16.313 8.594 -12.069 1.00 10.79 O ATOM 652 CB LEU A 383 15.808 8.128 -9.188 1.00 8.25 C ATOM 653 CG LEU A 383 14.530 7.302 -9.204 1.00 10.67 C ATOM 654 CD1 LEU A 383 13.803 7.695 -7.830 1.00 10.16 C ATOM 655 CD2 LEU A 383 13.598 7.578 -10.457 1.00 11.79 C ATOM 656 H LEU A 383 18.145 9.270 -9.479 1.00 0.00 H ATOM 657 N GLU A 384 16.690 6.360 -12.175 1.00 8.85 N ATOM 658 CA GLU A 384 16.414 6.337 -13.610 1.00 12.43 C ATOM 659 C GLU A 384 14.922 6.144 -13.874 1.00 10.88 C ATOM 660 O GLU A 384 14.322 6.825 -14.725 1.00 12.42 O ATOM 661 CB GLU A 384 17.147 5.198 -14.254 1.00 12.18 C ATOM 662 CG GLU A 384 18.645 5.317 -14.126 1.00 17.17 C ATOM 663 CD GLU A 384 19.230 6.257 -15.177 1.00 23.99 C ATOM 664 OE1 GLU A 384 18.455 6.978 -15.861 1.00 26.67 O ATOM 665 OE2 GLU A 384 20.473 6.328 -15.254 1.00 23.21 O ATOM 666 H GLU A 384 16.950 5.484 -11.679 1.00 0.00 H ATOM 667 N LYS A 385 14.285 5.206 -13.167 1.00 9.28 N ATOM 668 CA LYS A 385 12.870 4.968 -13.345 1.00 10.00 C ATOM 669 C LYS A 385 12.273 4.400 -12.053 1.00 11.42 C ATOM 670 O LYS A 385 12.921 3.584 -11.408 1.00 12.68 O ATOM 671 CB LYS A 385 12.629 3.949 -14.499 1.00 13.01 C ATOM 672 CG LYS A 385 11.168 3.619 -14.845 1.00 18.29 C ATOM 673 CD LYS A 385 10.208 4.864 -14.950 1.00 27.90 C ATOM 674 CE LYS A 385 10.070 5.459 -16.390 1.00 32.65 C ATOM 675 NZ LYS A 385 9.429 6.869 -16.411 1.00 24.81 N ATOM 676 HZ1 LYS A 385 8.476 6.821 -15.998 1.00 0.00 H ATOM 677 HZ2 LYS A 385 10.016 7.524 -15.856 1.00 0.00 H ATOM 678 HZ3 LYS A 385 9.366 7.205 -17.393 1.00 0.00 H ATOM 679 H LYS A 385 14.816 4.637 -12.477 1.00 0.00 H ATOM 680 N LEU A 386 11.059 4.809 -11.734 1.00 8.27 N ATOM 681 CA LEU A 386 10.309 4.195 -10.598 1.00 8.06 C ATOM 682 C LEU A 386 8.891 3.969 -11.059 1.00 8.99 C ATOM 683 O LEU A 386 8.161 4.937 -11.366 1.00 11.40 O ATOM 684 CB LEU A 386 10.322 5.108 -9.382 1.00 7.22 C ATOM 685 CG LEU A 386 9.453 4.584 -8.213 1.00 7.16 C ATOM 686 CD1 LEU A 386 9.871 3.166 -7.722 1.00 11.88 C ATOM 687 CD2 LEU A 386 9.607 5.661 -7.062 1.00 6.80 C ATOM 688 H LEU A 386 10.617 5.573 -12.284 1.00 0.00 H ATOM 689 N LEU A 387 8.481 2.714 -11.112 1.00 7.62 N ATOM 690 CA LEU A 387 7.127 2.340 -11.590 1.00 8.62 C ATOM 691 C LEU A 387 6.419 1.713 -10.412 1.00 8.57 C ATOM 692 O LEU A 387 6.939 0.762 -9.838 1.00 10.25 O ATOM 693 CB LEU A 387 7.245 1.344 -12.730 1.00 8.45 C ATOM 694 CG LEU A 387 5.904 0.682 -13.154 1.00 12.74 C ATOM 695 CD1 LEU A 387 4.917 1.633 -13.631 1.00 16.65 C ATOM 696 CD2 LEU A 387 6.200 -0.493 -14.215 1.00 18.80 C ATOM 697 H LEU A 387 9.131 1.961 -10.808 1.00 0.00 H ATOM 698 N ILE A 388 5.307 2.311 -9.994 1.00 8.16 N ATOM 699 CA ILE A 388 4.608 1.946 -8.720 1.00 8.96 C ATOM 700 C ILE A 388 3.172 1.678 -9.000 1.00 8.95 C ATOM 701 O ILE A 388 2.607 2.146 -10.012 1.00 8.79 O ATOM 702 CB ILE A 388 4.802 3.061 -7.659 1.00 9.12 C ATOM 703 CG1 ILE A 388 4.144 4.388 -8.090 1.00 9.71 C ATOM 704 CG2 ILE A 388 6.289 3.279 -7.435 1.00 10.25 C ATOM 705 CD1 ILE A 388 4.067 5.495 -6.929 1.00 13.23 C ATOM 706 H ILE A 388 4.903 3.069 -10.580 1.00 0.00 H ATOM 707 N ASN A 389 2.525 0.976 -8.079 1.00 10.01 N ATOM 708 CA ASN A 389 1.090 0.861 -8.121 1.00 13.78 C ATOM 709 C ASN A 389 0.402 2.046 -7.445 1.00 15.06 C ATOM 710 O ASN A 389 1.003 2.918 -6.775 1.00 14.69 O ATOM 711 CB ASN A 389 0.621 -0.449 -7.506 1.00 15.28 C ATOM 712 CG ASN A 389 0.815 -0.465 -6.004 1.00 17.28 C ATOM 713 OD1 ASN A 389 1.651 0.237 -5.496 1.00 16.79 O ATOM 714 ND2 ASN A 389 0.009 -1.222 -5.304 1.00 19.34 N ATOM 715 HD22 ASN A 389 -0.699 -1.813 -5.785 1.00 0.00 H ATOM 716 HD21 ASN A 389 0.076 -1.233 -4.266 1.00 0.00 H ATOM 717 H ASN A 389 3.058 0.505 -7.321 1.00 0.00 H ATOM 718 N SER A 390 -0.899 2.132 -7.687 1.00 15.90 N ATOM 719 CA SER A 390 -1.673 3.126 -7.067 1.00 17.20 C ATOM 720 C SER A 390 -1.960 2.559 -5.672 1.00 17.93 C ATOM 721 O SER A 390 -2.253 1.315 -5.522 1.00 19.23 O ATOM 722 CB SER A 390 -2.952 3.266 -7.914 1.00 19.33 C ATOM 723 OG SER A 390 -3.542 4.487 -7.615 1.00 22.61 O ATOM 724 HG SER A 390 -4.367 4.594 -8.152 1.00 0.00 H ATOM 725 H SER A 390 -1.349 1.459 -8.340 1.00 0.00 H ATOM 726 N ALA A 391 -1.866 3.422 -4.671 1.00 15.84 N ATOM 727 CA ALA A 391 -2.104 3.029 -3.278 1.00 14.99 C ATOM 728 C ALA A 391 -2.491 4.226 -2.436 1.00 13.58 C ATOM 729 O ALA A 391 -2.616 5.379 -2.961 1.00 15.35 O ATOM 730 CB ALA A 391 -0.857 2.315 -2.689 1.00 15.23 C ATOM 731 H ALA A 391 -1.615 4.410 -4.880 1.00 0.00 H ATOM 732 N LYS A 392 -2.668 3.996 -1.121 1.00 13.57 N ATOM 733 CA LYS A 392 -2.914 5.035 -0.166 1.00 15.92 C ATOM 734 C LYS A 392 -1.918 6.183 -0.459 1.00 13.12 C ATOM 735 O LYS A 392 -0.740 5.912 -0.578 1.00 12.21 O ATOM 736 CB LYS A 392 -2.587 4.355 1.185 1.00 15.24 C ATOM 737 CG LYS A 392 -2.592 5.103 2.407 1.00 23.58 C ATOM 738 CD LYS A 392 -2.713 4.014 3.483 1.00 23.22 C ATOM 739 CE LYS A 392 -2.206 4.403 4.750 1.00 27.89 C ATOM 740 NZ LYS A 392 -2.672 3.323 5.644 1.00 17.50 N ATOM 741 HZ1 LYS A 392 -3.711 3.283 5.625 1.00 0.00 H ATOM 742 HZ2 LYS A 392 -2.283 2.415 5.320 1.00 0.00 H ATOM 743 HZ3 LYS A 392 -2.349 3.514 6.614 1.00 0.00 H ATOM 744 H LYS A 392 -2.624 3.014 -0.781 1.00 0.00 H ATOM 745 N LYS A 393 -2.351 7.454 -0.572 1.00 13.63 N ATOM 746 CA LYS A 393 -1.388 8.485 -0.998 1.00 14.53 C ATOM 747 C LYS A 393 -0.173 8.617 -0.060 1.00 12.94 C ATOM 748 O LYS A 393 0.892 8.976 -0.499 1.00 12.19 O ATOM 749 CB LYS A 393 -2.066 9.854 -1.184 1.00 14.79 C ATOM 750 CG LYS A 393 -3.021 9.869 -2.332 1.00 19.88 C ATOM 751 CD LYS A 393 -3.846 11.217 -2.360 1.00 31.14 C ATOM 752 CE LYS A 393 -3.153 12.318 -3.186 1.00 36.70 C ATOM 753 NZ LYS A 393 -3.802 13.713 -3.211 1.00 39.94 N ATOM 754 HZ1 LYS A 393 -4.762 13.640 -3.605 1.00 0.00 H ATOM 755 HZ2 LYS A 393 -3.851 14.089 -2.242 1.00 0.00 H ATOM 756 HZ3 LYS A 393 -3.231 14.349 -3.803 1.00 0.00 H ATOM 757 H LYS A 393 -3.340 7.701 -0.364 1.00 0.00 H ATOM 758 N GLU A 394 -0.359 8.452 1.247 1.00 12.67 N ATOM 759 CA GLU A 394 0.765 8.498 2.194 1.00 14.92 C ATOM 760 C GLU A 394 1.848 7.462 1.860 1.00 12.43 C ATOM 761 O GLU A 394 3.036 7.766 1.967 1.00 11.84 O ATOM 762 CB GLU A 394 0.270 8.199 3.633 1.00 16.75 C ATOM 763 CG GLU A 394 -0.777 9.209 4.088 1.00 24.55 C ATOM 764 CD GLU A 394 -2.261 8.862 3.766 1.00 29.17 C ATOM 765 OE1 GLU A 394 -2.612 8.327 2.692 1.00 29.78 O ATOM 766 OE2 GLU A 394 -3.128 9.171 4.620 1.00 29.69 O ATOM 767 H GLU A 394 -1.321 8.287 1.607 1.00 0.00 H ATOM 768 N ASP A 395 1.437 6.263 1.484 1.00 12.38 N ATOM 769 CA ASP A 395 2.428 5.220 1.111 1.00 10.17 C ATOM 770 C ASP A 395 3.082 5.504 -0.258 1.00 9.34 C ATOM 771 O ASP A 395 4.266 5.160 -0.442 1.00 9.25 O ATOM 772 CB ASP A 395 1.807 3.840 1.104 1.00 11.02 C ATOM 773 CG ASP A 395 1.369 3.389 2.516 1.00 13.29 C ATOM 774 OD1 ASP A 395 1.690 4.144 3.465 1.00 19.19 O ATOM 775 OD2 ASP A 395 0.755 2.298 2.619 1.00 18.11 O ATOM 776 H ASP A 395 0.420 6.050 1.449 1.00 0.00 H ATOM 777 N MET A 396 2.300 6.019 -1.236 1.00 9.79 N ATOM 778 CA MET A 396 2.905 6.428 -2.476 1.00 8.07 C ATOM 779 C MET A 396 3.949 7.474 -2.256 1.00 8.24 C ATOM 780 O MET A 396 5.074 7.357 -2.797 1.00 8.27 O ATOM 781 CB MET A 396 1.807 6.910 -3.480 1.00 6.78 C ATOM 782 CG MET A 396 0.859 5.789 -3.823 1.00 9.14 C ATOM 783 SD MET A 396 -0.386 6.484 -5.036 1.00 15.29 S ATOM 784 CE MET A 396 0.517 6.521 -6.553 1.00 20.16 C ATOM 785 H MET A 396 1.275 6.118 -1.093 1.00 0.00 H ATOM 786 N ARG A 397 3.620 8.488 -1.447 1.00 8.78 N ATOM 787 CA ARG A 397 4.557 9.572 -1.227 1.00 10.49 C ATOM 788 C ARG A 397 5.828 9.062 -0.521 1.00 10.11 C ATOM 789 O ARG A 397 6.959 9.431 -0.902 1.00 9.57 O ATOM 790 CB ARG A 397 3.851 10.644 -0.341 1.00 10.55 C ATOM 791 CG ARG A 397 4.792 11.817 0.026 1.00 16.67 C ATOM 792 CD ARG A 397 4.298 12.528 1.301 1.00 25.06 C ATOM 793 NE ARG A 397 4.082 11.481 2.321 1.00 31.60 N ATOM 794 CZ ARG A 397 3.226 11.529 3.333 1.00 36.53 C ATOM 795 NH1 ARG A 397 2.469 12.609 3.519 1.00 38.40 N ATOM 796 NH2 ARG A 397 3.129 10.480 4.155 1.00 35.35 N ATOM 797 HE ARG A 397 4.659 10.620 2.237 1.00 0.00 H ATOM 798 HH12 ARG A 397 1.799 12.644 4.313 1.00 0.00 H ATOM 799 HH11 ARG A 397 2.548 13.418 2.870 1.00 0.00 H ATOM 800 HH22 ARG A 397 2.462 10.504 4.953 1.00 0.00 H ATOM 801 HH21 ARG A 397 3.721 9.639 3.997 1.00 0.00 H ATOM 802 H ARG A 397 2.693 8.498 -0.976 1.00 0.00 H ATOM 803 N ASP A 398 5.631 8.254 0.519 1.00 9.21 N ATOM 804 CA ASP A 398 6.775 7.740 1.191 1.00 11.14 C ATOM 805 C ASP A 398 7.659 6.812 0.346 1.00 9.36 C ATOM 806 O ASP A 398 8.879 6.916 0.476 1.00 8.79 O ATOM 807 CB ASP A 398 6.435 7.195 2.555 1.00 11.94 C ATOM 808 CG ASP A 398 5.936 8.267 3.489 1.00 15.78 C ATOM 809 OD1 ASP A 398 6.094 9.534 3.254 1.00 18.87 O ATOM 810 OD2 ASP A 398 5.361 7.824 4.473 1.00 19.14 O ATOM 811 H ASP A 398 4.670 8.006 0.831 1.00 0.00 H ATOM 812 N LEU A 399 7.055 5.985 -0.516 1.00 7.62 N ATOM 813 CA LEU A 399 7.843 5.085 -1.373 1.00 5.32 C ATOM 814 C LEU A 399 8.657 5.996 -2.299 1.00 6.13 C ATOM 815 O LEU A 399 9.840 5.749 -2.574 1.00 7.31 O ATOM 816 CB LEU A 399 6.966 4.135 -2.179 1.00 6.41 C ATOM 817 CG LEU A 399 7.754 3.163 -3.103 1.00 7.77 C ATOM 818 CD1 LEU A 399 8.773 2.337 -2.275 1.00 8.61 C ATOM 819 CD2 LEU A 399 6.769 2.226 -3.837 1.00 9.23 C ATOM 820 H LEU A 399 6.017 5.978 -0.581 1.00 0.00 H ATOM 821 N ILE A 400 8.007 6.986 -2.860 1.00 5.00 N ATOM 822 CA ILE A 400 8.739 7.824 -3.843 1.00 6.02 C ATOM 823 C ILE A 400 9.901 8.553 -3.147 1.00 7.44 C ATOM 824 O ILE A 400 11.018 8.565 -3.646 1.00 7.73 O ATOM 825 CB ILE A 400 7.787 8.834 -4.491 1.00 5.93 C ATOM 826 CG1 ILE A 400 6.884 8.039 -5.407 1.00 8.27 C ATOM 827 CG2 ILE A 400 8.634 9.983 -5.294 1.00 8.95 C ATOM 828 CD1 ILE A 400 5.674 8.852 -5.893 1.00 11.87 C ATOM 829 H ILE A 400 7.012 7.178 -2.625 1.00 0.00 H ATOM 830 N ILE A 401 9.659 9.143 -1.981 1.00 6.32 N ATOM 831 CA ILE A 401 10.743 9.855 -1.265 1.00 7.23 C ATOM 832 C ILE A 401 11.860 8.830 -0.937 1.00 8.02 C ATOM 833 O ILE A 401 13.053 9.137 -1.077 1.00 7.51 O ATOM 834 CB ILE A 401 10.221 10.411 0.078 1.00 7.41 C ATOM 835 CG1 ILE A 401 9.263 11.552 -0.209 1.00 8.88 C ATOM 836 CG2 ILE A 401 11.395 11.023 0.929 1.00 10.15 C ATOM 837 CD1 ILE A 401 8.411 11.907 1.094 1.00 19.15 C ATOM 838 H ILE A 401 8.705 9.105 -1.569 1.00 0.00 H ATOM 839 N LEU A 402 11.481 7.651 -0.433 1.00 6.02 N ATOM 840 CA LEU A 402 12.501 6.653 -0.030 1.00 7.51 C ATOM 841 C LEU A 402 13.307 6.181 -1.226 1.00 7.06 C ATOM 842 O LEU A 402 14.535 5.935 -1.092 1.00 6.57 O ATOM 843 CB LEU A 402 11.853 5.445 0.639 1.00 7.45 C ATOM 844 CG LEU A 402 11.295 5.739 2.069 1.00 9.13 C ATOM 845 CD1 LEU A 402 10.377 4.541 2.484 1.00 12.71 C ATOM 846 CD2 LEU A 402 12.374 5.949 3.089 1.00 13.76 C ATOM 847 H LEU A 402 10.470 7.434 -0.324 1.00 0.00 H ATOM 848 N CYS A 403 12.658 6.096 -2.374 1.00 7.64 N ATOM 849 CA CYS A 403 13.444 5.655 -3.535 1.00 7.01 C ATOM 850 C CYS A 403 14.337 6.780 -4.031 1.00 7.48 C ATOM 851 O CYS A 403 15.429 6.481 -4.528 1.00 7.29 O ATOM 852 CB CYS A 403 12.548 5.214 -4.689 1.00 5.39 C ATOM 853 SG CYS A 403 11.771 3.610 -4.347 1.00 10.35 S ATOM 854 H CYS A 403 11.647 6.328 -2.452 1.00 0.00 H ATOM 855 N MET A 404 13.871 8.038 -3.885 1.00 7.62 N ATOM 856 CA MET A 404 14.730 9.183 -4.274 1.00 8.50 C ATOM 857 C MET A 404 15.996 9.202 -3.402 1.00 9.69 C ATOM 858 O MET A 404 17.128 9.423 -3.874 1.00 9.07 O ATOM 859 CB MET A 404 13.906 10.468 -4.069 1.00 9.37 C ATOM 860 CG MET A 404 12.839 10.640 -5.222 1.00 10.44 C ATOM 861 SD MET A 404 11.825 12.091 -4.777 1.00 13.55 S ATOM 862 CE MET A 404 10.899 12.270 -6.317 1.00 14.63 C ATOM 863 H MET A 404 12.918 8.203 -3.503 1.00 0.00 H ATOM 864 N VAL A 405 15.838 8.957 -2.103 1.00 5.78 N ATOM 865 CA VAL A 405 16.990 8.890 -1.202 1.00 6.52 C ATOM 866 C VAL A 405 17.896 7.632 -1.502 1.00 7.06 C ATOM 867 O VAL A 405 19.095 7.761 -1.583 1.00 7.79 O ATOM 868 CB VAL A 405 16.506 8.802 0.270 1.00 6.65 C ATOM 869 CG1 VAL A 405 17.751 8.646 1.229 1.00 8.78 C ATOM 870 CG2 VAL A 405 15.716 10.139 0.624 1.00 9.07 C ATOM 871 H VAL A 405 14.881 8.811 -1.722 1.00 0.00 H ATOM 872 N PHE A 406 17.286 6.457 -1.610 1.00 7.29 N ATOM 873 CA PHE A 406 18.013 5.200 -1.817 1.00 7.30 C ATOM 874 C PHE A 406 18.797 5.298 -3.150 1.00 7.86 C ATOM 875 O PHE A 406 19.919 4.767 -3.254 1.00 7.90 O ATOM 876 CB PHE A 406 17.049 4.026 -1.932 1.00 7.46 C ATOM 877 CG PHE A 406 17.785 2.713 -2.155 1.00 7.76 C ATOM 878 CD1 PHE A 406 18.398 2.074 -1.054 1.00 9.33 C ATOM 879 CD2 PHE A 406 17.931 2.174 -3.456 1.00 10.66 C ATOM 880 CE1 PHE A 406 19.132 0.895 -1.225 1.00 7.91 C ATOM 881 CE2 PHE A 406 18.683 1.014 -3.605 1.00 9.80 C ATOM 882 CZ PHE A 406 19.237 0.381 -2.477 1.00 7.55 C ATOM 883 H PHE A 406 16.248 6.427 -1.545 1.00 0.00 H ATOM 884 N SER A 407 18.233 6.003 -4.125 1.00 9.13 N ATOM 885 CA SER A 407 18.909 6.236 -5.425 1.00 8.22 C ATOM 886 C SER A 407 20.168 7.066 -5.320 1.00 8.36 C ATOM 887 O SER A 407 20.992 7.063 -6.252 1.00 10.16 O ATOM 888 CB SER A 407 17.952 6.901 -6.446 1.00 8.94 C ATOM 889 OG SER A 407 17.787 8.275 -6.164 1.00 6.39 O ATOM 890 HG SER A 407 17.407 8.381 -5.256 1.00 0.00 H ATOM 891 H SER A 407 17.286 6.405 -3.972 1.00 0.00 H ATOM 892 N GLN A 408 20.328 7.770 -4.201 1.00 7.42 N ATOM 893 CA GLN A 408 21.438 8.735 -4.019 1.00 8.38 C ATOM 894 C GLN A 408 21.444 9.752 -5.148 1.00 9.36 C ATOM 895 O GLN A 408 22.505 10.227 -5.528 1.00 8.95 O ATOM 896 CB GLN A 408 22.837 8.065 -3.922 1.00 6.47 C ATOM 897 CG GLN A 408 22.826 7.015 -2.762 1.00 6.64 C ATOM 898 CD GLN A 408 24.166 6.312 -2.615 1.00 5.56 C ATOM 899 OE1 GLN A 408 24.722 5.773 -3.584 1.00 8.73 O ATOM 900 NE2 GLN A 408 24.642 6.219 -1.344 1.00 8.94 N ATOM 901 HE22 GLN A 408 24.139 6.689 -0.565 1.00 0.00 H ATOM 902 HE21 GLN A 408 25.509 5.677 -1.152 1.00 0.00 H ATOM 903 H GLN A 408 19.648 7.638 -3.425 1.00 0.00 H ATOM 904 N ASP A 409 20.251 10.131 -5.624 1.00 8.43 N ATOM 905 CA ASP A 409 20.198 11.046 -6.741 1.00 10.42 C ATOM 906 C ASP A 409 20.828 12.398 -6.371 1.00 9.83 C ATOM 907 O ASP A 409 20.621 12.935 -5.292 1.00 9.64 O ATOM 908 CB ASP A 409 18.731 11.276 -7.162 1.00 10.39 C ATOM 909 CG ASP A 409 18.616 11.908 -8.529 1.00 13.38 C ATOM 910 OD1 ASP A 409 18.299 11.181 -9.490 1.00 11.43 O ATOM 911 OD2 ASP A 409 18.795 13.125 -8.623 1.00 13.12 O ATOM 912 H ASP A 409 19.374 9.771 -5.195 1.00 0.00 H ATOM 913 N THR A 410 21.617 12.937 -7.282 1.00 11.75 N ATOM 914 CA THR A 410 22.192 14.278 -7.049 1.00 12.01 C ATOM 915 C THR A 410 21.204 15.324 -6.521 1.00 11.10 C ATOM 916 O THR A 410 21.502 16.118 -5.617 1.00 11.81 O ATOM 917 CB THR A 410 22.895 14.738 -8.336 1.00 14.69 C ATOM 918 OG1 THR A 410 23.958 13.804 -8.568 1.00 18.30 O ATOM 919 CG2 THR A 410 23.474 16.131 -8.124 1.00 17.26 C ATOM 920 HG1 THR A 410 24.445 14.058 -9.392 1.00 0.00 H ATOM 921 H THR A 410 21.833 12.421 -8.159 1.00 0.00 H ATOM 922 N ARG A 411 19.999 15.302 -7.076 1.00 11.03 N ATOM 923 CA ARG A 411 18.927 16.242 -6.658 1.00 10.00 C ATOM 924 C ARG A 411 18.508 16.059 -5.209 1.00 11.45 C ATOM 925 O ARG A 411 18.149 17.032 -4.550 1.00 10.57 O ATOM 926 CB ARG A 411 17.709 16.056 -7.538 1.00 10.70 C ATOM 927 CG ARG A 411 17.953 16.397 -8.997 1.00 12.31 C ATOM 928 CD ARG A 411 16.778 15.931 -9.870 1.00 10.70 C ATOM 929 NE ARG A 411 16.895 14.499 -10.121 1.00 14.22 N ATOM 930 CZ ARG A 411 16.181 13.814 -11.006 1.00 16.15 C ATOM 931 NH1 ARG A 411 15.180 14.397 -11.681 1.00 13.07 N ATOM 932 NH2 ARG A 411 16.453 12.526 -11.199 1.00 12.22 N ATOM 933 HE ARG A 411 17.595 13.972 -9.561 1.00 0.00 H ATOM 934 HH12 ARG A 411 14.629 13.848 -12.371 1.00 0.00 H ATOM 935 HH11 ARG A 411 14.954 15.398 -11.514 1.00 0.00 H ATOM 936 HH22 ARG A 411 15.902 11.976 -11.889 1.00 0.00 H ATOM 937 HH21 ARG A 411 17.216 12.069 -10.660 1.00 0.00 H ATOM 938 H ARG A 411 19.799 14.608 -7.824 1.00 0.00 H ATOM 939 N MET A 412 18.549 14.809 -4.728 1.00 9.21 N ATOM 940 CA MET A 412 18.214 14.545 -3.351 1.00 10.74 C ATOM 941 C MET A 412 19.288 15.194 -2.449 1.00 11.40 C ATOM 942 O MET A 412 18.981 15.890 -1.464 1.00 10.04 O ATOM 943 CB MET A 412 18.065 13.039 -3.172 1.00 10.73 C ATOM 944 CG MET A 412 17.776 12.632 -1.694 1.00 10.22 C ATOM 945 SD MET A 412 19.207 12.452 -0.665 1.00 12.23 S ATOM 946 CE MET A 412 20.236 11.316 -1.604 1.00 7.94 C ATOM 947 H MET A 412 18.824 14.024 -5.352 1.00 0.00 H ATOM 948 N PHE A 413 20.566 14.993 -2.750 1.00 10.61 N ATOM 949 CA PHE A 413 21.576 15.641 -1.887 1.00 11.63 C ATOM 950 C PHE A 413 21.435 17.181 -1.902 1.00 13.05 C ATOM 951 O PHE A 413 21.616 17.843 -0.869 1.00 12.49 O ATOM 952 CB PHE A 413 22.994 15.233 -2.286 1.00 13.50 C ATOM 953 CG PHE A 413 23.296 13.780 -2.097 1.00 11.34 C ATOM 954 CD1 PHE A 413 23.331 13.187 -0.806 1.00 9.84 C ATOM 955 CD2 PHE A 413 23.653 13.004 -3.179 1.00 12.32 C ATOM 956 CE1 PHE A 413 23.692 11.810 -0.638 1.00 9.78 C ATOM 957 CE2 PHE A 413 24.042 11.646 -2.995 1.00 11.59 C ATOM 958 CZ PHE A 413 24.022 11.066 -1.732 1.00 13.01 C ATOM 959 H PHE A 413 20.845 14.403 -3.560 1.00 0.00 H ATOM 960 N GLN A 414 21.116 17.729 -3.078 1.00 13.31 N ATOM 961 CA GLN A 414 20.899 19.180 -3.255 1.00 16.57 C ATOM 962 C GLN A 414 19.698 19.706 -2.506 1.00 16.16 C ATOM 963 O GLN A 414 19.591 20.941 -2.248 1.00 15.16 O ATOM 964 CB GLN A 414 20.769 19.522 -4.739 1.00 16.34 C ATOM 965 CG GLN A 414 22.162 19.307 -5.515 1.00 20.75 C ATOM 966 CD GLN A 414 22.105 19.418 -7.056 1.00 30.67 C ATOM 967 OE1 GLN A 414 21.042 19.214 -7.692 1.00 32.56 O ATOM 968 NE2 GLN A 414 23.281 19.710 -7.685 1.00 27.41 N ATOM 969 HE22 GLN A 414 24.143 19.873 -7.126 1.00 0.00 H ATOM 970 HE21 GLN A 414 23.315 19.769 -8.723 1.00 0.00 H ATOM 971 H GLN A 414 21.016 17.107 -3.905 1.00 0.00 H ATOM 972 N GLY A 415 18.775 18.799 -2.153 1.00 15.93 N ATOM 973 CA GLY A 415 17.525 19.153 -1.443 1.00 15.29 C ATOM 974 C GLY A 415 17.648 19.372 0.045 1.00 16.72 C ATOM 975 O GLY A 415 16.706 19.836 0.683 1.00 16.70 O ATOM 976 H GLY A 415 18.945 17.801 -2.389 1.00 0.00 H ATOM 977 N VAL A 416 18.807 19.075 0.622 1.00 16.08 N ATOM 978 CA VAL A 416 18.966 19.277 2.028 1.00 18.93 C ATOM 979 C VAL A 416 19.211 20.763 2.257 1.00 21.81 C ATOM 980 O VAL A 416 20.313 21.209 2.174 1.00 26.73 O ATOM 981 CB VAL A 416 20.133 18.463 2.604 1.00 17.19 C ATOM 982 CG1 VAL A 416 20.138 18.645 4.126 1.00 20.08 C ATOM 983 CG2 VAL A 416 19.963 17.029 2.266 1.00 18.65 C ATOM 984 H VAL A 416 19.593 18.698 0.055 1.00 0.00 H ATOM 985 N ARG A 417 18.185 21.497 2.594 1.00 22.63 N ATOM 986 CA ARG A 417 18.315 22.942 2.779 1.00 25.69 C ATOM 987 C ARG A 417 18.586 23.193 4.241 1.00 24.61 C ATOM 988 O ARG A 417 19.287 24.137 4.624 1.00 26.12 O ATOM 989 CB ARG A 417 16.995 23.622 2.337 1.00 24.93 C ATOM 990 CG ARG A 417 17.002 24.151 0.872 1.00 31.58 C ATOM 991 CD ARG A 417 17.563 23.137 -0.164 1.00 38.69 C ATOM 992 NE ARG A 417 18.009 23.785 -1.401 1.00 48.26 N ATOM 993 CZ ARG A 417 17.217 24.360 -2.316 1.00 50.99 C ATOM 994 NH1 ARG A 417 15.901 24.400 -2.153 1.00 52.95 N ATOM 995 NH2 ARG A 417 17.742 24.910 -3.413 1.00 53.27 N ATOM 996 HE ARG A 417 19.033 23.800 -1.585 1.00 0.00 H ATOM 997 HH12 ARG A 417 15.301 24.850 -2.873 1.00 0.00 H ATOM 998 HH11 ARG A 417 15.469 23.981 -1.305 1.00 0.00 H ATOM 999 HH22 ARG A 417 17.122 25.355 -4.119 1.00 0.00 H ATOM 1000 HH21 ARG A 417 18.771 24.894 -3.561 1.00 0.00 H ATOM 1001 H ARG A 417 17.258 21.046 2.733 1.00 0.00 H ATOM 1002 N GLY A 418 18.064 22.328 5.079 1.00 24.25 N ATOM 1003 CA GLY A 418 18.067 22.581 6.493 1.00 23.58 C ATOM 1004 C GLY A 418 19.201 21.965 7.279 1.00 24.59 C ATOM 1005 O GLY A 418 20.184 21.462 6.709 1.00 24.35 O ATOM 1006 H GLY A 418 17.643 21.449 4.715 1.00 0.00 H ATOM 1007 N GLU A 419 19.073 21.966 8.597 1.00 24.24 N ATOM 1008 CA GLU A 419 20.161 21.387 9.390 1.00 25.68 C ATOM 1009 C GLU A 419 20.061 19.840 9.393 1.00 23.61 C ATOM 1010 O GLU A 419 18.974 19.285 9.436 1.00 25.62 O ATOM 1011 CB GLU A 419 20.146 21.907 10.804 1.00 27.88 C ATOM 1012 CG GLU A 419 19.341 21.080 11.755 1.00 35.23 C ATOM 1013 CD GLU A 419 20.177 20.575 12.915 1.00 43.58 C ATOM 1014 OE1 GLU A 419 21.418 20.523 12.753 1.00 48.52 O ATOM 1015 OE2 GLU A 419 19.594 20.220 13.977 1.00 46.05 O ATOM 1016 H GLU A 419 18.228 22.365 9.054 1.00 0.00 H ATOM 1017 N ILE A 420 21.192 19.145 9.323 1.00 21.39 N ATOM 1018 CA ILE A 420 21.110 17.659 9.394 1.00 19.74 C ATOM 1019 C ILE A 420 22.317 17.214 10.233 1.00 17.60 C ATOM 1020 O ILE A 420 23.397 17.751 10.046 1.00 19.09 O ATOM 1021 CB ILE A 420 21.135 17.016 7.986 1.00 19.03 C ATOM 1022 CG1 ILE A 420 20.991 15.491 8.108 1.00 18.15 C ATOM 1023 CG2 ILE A 420 22.395 17.364 7.259 1.00 20.65 C ATOM 1024 CD1 ILE A 420 20.497 14.787 6.809 1.00 17.06 C ATOM 1025 H ILE A 420 22.109 19.625 9.221 1.00 0.00 H ATOM 1026 N ASN A 421 22.119 16.254 11.133 1.00 16.89 N ATOM 1027 CA ASN A 421 23.181 15.866 12.045 1.00 17.68 C ATOM 1028 C ASN A 421 23.706 14.509 11.693 1.00 15.50 C ATOM 1029 O ASN A 421 22.924 13.611 11.392 1.00 16.17 O ATOM 1030 CB ASN A 421 22.625 15.796 13.448 1.00 19.27 C ATOM 1031 CG ASN A 421 22.309 17.169 13.976 1.00 23.53 C ATOM 1032 OD1 ASN A 421 23.156 18.069 13.938 1.00 27.41 O ATOM 1033 ND2 ASN A 421 21.092 17.350 14.440 1.00 29.88 N ATOM 1034 HD22 ASN A 421 20.416 16.559 14.450 1.00 0.00 H ATOM 1035 HD21 ASN A 421 20.805 18.284 14.797 1.00 0.00 H ATOM 1036 H ASN A 421 21.196 15.777 11.184 1.00 0.00 H ATOM 1037 N PHE A 422 25.025 14.349 11.740 1.00 15.18 N ATOM 1038 CA PHE A 422 25.571 12.967 11.511 1.00 15.34 C ATOM 1039 C PHE A 422 26.198 12.344 12.759 1.00 14.98 C ATOM 1040 O PHE A 422 26.759 11.278 12.690 1.00 13.69 O ATOM 1041 CB PHE A 422 26.538 12.946 10.312 1.00 15.09 C ATOM 1042 CG PHE A 422 25.897 13.427 9.026 1.00 16.54 C ATOM 1043 CD1 PHE A 422 24.958 12.645 8.381 1.00 13.43 C ATOM 1044 CD2 PHE A 422 26.152 14.744 8.555 1.00 19.28 C ATOM 1045 CE1 PHE A 422 24.305 13.076 7.164 1.00 16.04 C ATOM 1046 CE2 PHE A 422 25.518 15.211 7.362 1.00 18.23 C ATOM 1047 CZ PHE A 422 24.576 14.365 6.667 1.00 18.08 C ATOM 1048 H PHE A 422 25.658 15.153 11.929 1.00 0.00 H ATOM 1049 N LEU A 423 26.064 13.027 13.897 1.00 16.10 N ATOM 1050 CA LEU A 423 26.442 12.476 15.198 1.00 15.69 C ATOM 1051 C LEU A 423 25.249 12.739 16.064 1.00 17.49 C ATOM 1052 O LEU A 423 24.492 13.717 15.823 1.00 17.67 O ATOM 1053 CB LEU A 423 27.546 13.291 15.814 1.00 15.39 C ATOM 1054 CG LEU A 423 28.859 13.372 15.080 1.00 20.12 C ATOM 1055 CD1 LEU A 423 29.718 14.382 15.923 1.00 21.08 C ATOM 1056 CD2 LEU A 423 29.562 11.951 14.989 1.00 19.55 C ATOM 1057 H LEU A 423 25.675 13.991 13.857 1.00 0.00 H ATOM 1058 N ASN A 424 25.021 11.852 17.015 1.00 15.99 N ATOM 1059 CA ASN A 424 23.983 12.125 18.001 1.00 17.06 C ATOM 1060 C ASN A 424 24.499 12.979 19.159 1.00 18.70 C ATOM 1061 O ASN A 424 25.618 13.461 19.111 1.00 17.59 O ATOM 1062 CB ASN A 424 23.250 10.860 18.403 1.00 16.10 C ATOM 1063 CG ASN A 424 24.032 9.945 19.351 1.00 14.31 C ATOM 1064 OD1 ASN A 424 25.092 10.265 19.823 1.00 11.44 O ATOM 1065 ND2 ASN A 424 23.505 8.763 19.537 1.00 17.96 N ATOM 1066 HD22 ASN A 424 22.586 8.530 19.109 1.00 0.00 H ATOM 1067 HD21 ASN A 424 24.005 8.056 20.113 1.00 0.00 H ATOM 1068 H ASN A 424 25.574 10.972 17.060 1.00 0.00 H ATOM 1069 N ARG A 425 23.629 13.256 20.135 1.00 21.53 N ATOM 1070 CA ARG A 425 23.991 14.125 21.264 1.00 23.99 C ATOM 1071 C ARG A 425 25.160 13.610 22.091 1.00 24.23 C ATOM 1072 O ARG A 425 25.993 14.402 22.563 1.00 26.18 O ATOM 1073 CB ARG A 425 22.775 14.370 22.140 1.00 26.51 C ATOM 1074 CG ARG A 425 21.775 15.320 21.445 1.00 31.78 C ATOM 1075 CD ARG A 425 20.649 15.759 22.406 1.00 41.00 C ATOM 1076 NE ARG A 425 19.313 15.605 21.825 1.00 46.49 N ATOM 1077 CZ ARG A 425 18.554 14.516 21.957 1.00 48.89 C ATOM 1078 NH1 ARG A 425 17.352 14.477 21.401 1.00 51.14 N ATOM 1079 NH2 ARG A 425 18.983 13.463 22.639 1.00 49.60 N ATOM 1080 HE ARG A 425 18.930 16.398 21.272 1.00 0.00 H ATOM 1081 HH12 ARG A 425 16.759 13.629 21.503 1.00 0.00 H ATOM 1082 HH11 ARG A 425 17.001 15.295 20.863 1.00 0.00 H ATOM 1083 HH22 ARG A 425 18.378 12.622 22.732 1.00 0.00 H ATOM 1084 HH21 ARG A 425 19.924 13.478 23.081 1.00 0.00 H ATOM 1085 H ARG A 425 22.674 12.847 20.095 1.00 0.00 H ATOM 1086 N ALA A 426 25.277 12.292 22.179 1.00 22.25 N ATOM 1087 CA ALA A 426 26.337 11.630 22.933 1.00 19.68 C ATOM 1088 C ALA A 426 27.582 11.418 22.093 1.00 18.93 C ATOM 1089 O ALA A 426 28.486 10.750 22.575 1.00 20.85 O ATOM 1090 CB ALA A 426 25.844 10.281 23.462 1.00 19.46 C ATOM 1091 H ALA A 426 24.578 11.700 21.686 1.00 0.00 H ATOM 1092 N GLY A 427 27.651 12.028 20.882 1.00 17.60 N ATOM 1093 CA GLY A 427 28.814 11.998 20.016 1.00 15.47 C ATOM 1094 C GLY A 427 28.946 10.702 19.189 1.00 13.76 C ATOM 1095 O GLY A 427 30.018 10.439 18.607 1.00 13.42 O ATOM 1096 H GLY A 427 26.814 12.551 20.554 1.00 0.00 H ATOM 1097 N GLN A 428 27.898 9.875 19.201 1.00 12.90 N ATOM 1098 CA GLN A 428 27.938 8.583 18.504 1.00 11.31 C ATOM 1099 C GLN A 428 27.740 8.842 17.042 1.00 10.82 C ATOM 1100 O GLN A 428 27.134 9.860 16.622 1.00 10.86 O ATOM 1101 CB GLN A 428 26.949 7.548 19.024 1.00 11.93 C ATOM 1102 CG GLN A 428 26.998 7.382 20.585 1.00 12.82 C ATOM 1103 CD GLN A 428 26.022 6.301 20.971 1.00 12.38 C ATOM 1104 OE1 GLN A 428 24.818 6.557 21.105 1.00 14.98 O ATOM 1105 NE2 GLN A 428 26.514 5.048 21.062 1.00 16.12 N ATOM 1106 HE22 GLN A 428 27.533 4.880 20.942 1.00 0.00 H ATOM 1107 HE21 GLN A 428 25.874 4.251 21.252 1.00 0.00 H ATOM 1108 H GLN A 428 27.036 10.151 19.714 1.00 0.00 H ATOM 1109 N LEU A 429 28.228 7.881 16.257 1.00 10.36 N ATOM 1110 CA LEU A 429 28.224 7.976 14.833 1.00 9.79 C ATOM 1111 C LEU A 429 26.883 7.550 14.245 1.00 8.05 C ATOM 1112 O LEU A 429 26.360 6.482 14.548 1.00 10.70 O ATOM 1113 CB LEU A 429 29.290 7.010 14.248 1.00 9.49 C ATOM 1114 CG LEU A 429 30.692 7.235 14.810 1.00 8.69 C ATOM 1115 CD1 LEU A 429 31.547 6.028 14.526 1.00 12.86 C ATOM 1116 CD2 LEU A 429 31.288 8.448 14.143 1.00 15.83 C ATOM 1117 H LEU A 429 28.627 7.029 16.700 1.00 0.00 H ATOM 1118 N LEU A 430 26.354 8.376 13.326 1.00 9.38 N ATOM 1119 CA LEU A 430 25.105 8.022 12.627 1.00 10.40 C ATOM 1120 C LEU A 430 25.375 7.819 11.141 1.00 10.52 C ATOM 1121 O LEU A 430 26.300 8.380 10.542 1.00 11.69 O ATOM 1122 CB LEU A 430 24.034 9.129 12.767 1.00 11.73 C ATOM 1123 CG LEU A 430 23.780 9.581 14.190 1.00 14.01 C ATOM 1124 CD1 LEU A 430 22.801 10.849 14.238 1.00 14.73 C ATOM 1125 CD2 LEU A 430 23.228 8.306 14.969 1.00 13.91 C ATOM 1126 H LEU A 430 26.830 9.274 13.106 1.00 0.00 H ATOM 1127 N SER A 431 24.520 7.009 10.536 1.00 11.95 N ATOM 1128 CA SER A 431 24.705 6.738 9.089 1.00 10.96 C ATOM 1129 C SER A 431 24.175 7.944 8.279 1.00 11.17 C ATOM 1130 O SER A 431 23.049 8.305 8.464 1.00 10.39 O ATOM 1131 CB SER A 431 23.866 5.495 8.760 1.00 11.25 C ATOM 1132 OG SER A 431 23.494 5.405 7.367 1.00 10.43 O ATOM 1133 HG SER A 431 24.312 5.368 6.810 1.00 0.00 H ATOM 1134 H SER A 431 23.737 6.573 11.063 1.00 0.00 H ATOM 1135 N PRO A 432 24.974 8.527 7.369 1.00 10.85 N ATOM 1136 CA PRO A 432 24.468 9.607 6.525 1.00 10.69 C ATOM 1137 C PRO A 432 23.215 9.204 5.736 1.00 9.64 C ATOM 1138 O PRO A 432 22.290 10.015 5.632 1.00 10.34 O ATOM 1139 CB PRO A 432 25.638 9.889 5.572 1.00 11.09 C ATOM 1140 CG PRO A 432 26.929 9.571 6.431 1.00 12.02 C ATOM 1141 CD PRO A 432 26.436 8.342 7.256 1.00 9.65 C ATOM 1142 N MET A 433 23.167 8.024 5.146 1.00 8.57 N ATOM 1143 CA MET A 433 22.011 7.649 4.297 1.00 9.30 C ATOM 1144 C MET A 433 20.741 7.551 5.146 1.00 9.30 C ATOM 1145 O MET A 433 19.663 7.988 4.745 1.00 9.00 O ATOM 1146 CB MET A 433 22.218 6.325 3.551 1.00 8.57 C ATOM 1147 CG MET A 433 23.257 6.522 2.375 1.00 10.17 C ATOM 1148 SD MET A 433 22.681 7.775 1.170 1.00 16.62 S ATOM 1149 CE MET A 433 21.393 6.838 0.574 1.00 20.77 C ATOM 1150 H MET A 433 23.948 7.350 5.278 1.00 0.00 H ATOM 1151 N TYR A 434 20.877 6.926 6.328 1.00 9.40 N ATOM 1152 CA TYR A 434 19.703 6.822 7.184 1.00 10.67 C ATOM 1153 C TYR A 434 19.326 8.224 7.670 1.00 9.13 C ATOM 1154 O TYR A 434 18.118 8.474 7.823 1.00 10.67 O ATOM 1155 CB TYR A 434 19.955 5.870 8.403 1.00 12.18 C ATOM 1156 CG TYR A 434 19.919 4.450 7.968 1.00 17.84 C ATOM 1157 CD1 TYR A 434 21.051 3.838 7.389 1.00 23.62 C ATOM 1158 CD2 TYR A 434 18.736 3.746 8.040 1.00 22.55 C ATOM 1159 CE1 TYR A 434 21.023 2.528 6.920 1.00 27.28 C ATOM 1160 CE2 TYR A 434 18.681 2.437 7.571 1.00 28.33 C ATOM 1161 CZ TYR A 434 19.811 1.843 7.012 1.00 25.51 C ATOM 1162 OH TYR A 434 19.684 0.564 6.594 1.00 30.38 O ATOM 1163 HH TYR A 434 20.546 0.254 6.219 1.00 0.00 H ATOM 1164 H TYR A 434 21.792 6.529 6.622 1.00 0.00 H ATOM 1165 N GLN A 435 20.299 9.101 7.930 1.00 10.01 N ATOM 1166 CA GLN A 435 19.919 10.476 8.393 1.00 9.59 C ATOM 1167 C GLN A 435 19.209 11.251 7.316 1.00 8.63 C ATOM 1168 O GLN A 435 18.259 11.964 7.612 1.00 9.77 O ATOM 1169 CB GLN A 435 21.098 11.298 8.936 1.00 9.00 C ATOM 1170 CG GLN A 435 21.581 10.703 10.300 1.00 13.95 C ATOM 1171 CD GLN A 435 20.539 10.832 11.365 1.00 16.50 C ATOM 1172 OE1 GLN A 435 19.939 9.884 11.735 1.00 16.98 O ATOM 1173 NE2 GLN A 435 20.342 12.033 11.869 1.00 17.08 N ATOM 1174 HE22 GLN A 435 20.892 12.842 11.515 1.00 0.00 H ATOM 1175 HE21 GLN A 435 19.637 12.172 12.621 1.00 0.00 H ATOM 1176 H GLN A 435 21.298 8.836 7.814 1.00 0.00 H ATOM 1177 N LEU A 436 19.602 10.985 6.067 1.00 8.36 N ATOM 1178 CA LEU A 436 18.932 11.587 4.870 1.00 7.41 C ATOM 1179 C LEU A 436 17.509 11.084 4.675 1.00 8.56 C ATOM 1180 O LEU A 436 16.586 11.879 4.382 1.00 9.80 O ATOM 1181 CB LEU A 436 19.794 11.305 3.603 1.00 7.41 C ATOM 1182 CG LEU A 436 21.100 12.184 3.521 1.00 10.04 C ATOM 1183 CD1 LEU A 436 22.153 11.730 2.444 1.00 12.90 C ATOM 1184 CD2 LEU A 436 20.665 13.659 3.212 1.00 10.44 C ATOM 1185 H LEU A 436 20.402 10.337 5.921 1.00 0.00 H ATOM 1186 N GLN A 437 17.302 9.788 4.905 1.00 8.28 N ATOM 1187 CA GLN A 437 15.968 9.195 4.917 1.00 8.74 C ATOM 1188 C GLN A 437 15.109 9.928 5.974 1.00 8.87 C ATOM 1189 O GLN A 437 13.986 10.372 5.669 1.00 8.78 O ATOM 1190 CB GLN A 437 15.994 7.665 5.237 1.00 9.62 C ATOM 1191 CG GLN A 437 14.580 7.165 5.584 1.00 12.99 C ATOM 1192 CD GLN A 437 14.438 5.639 5.668 1.00 14.95 C ATOM 1193 OE1 GLN A 437 13.492 5.134 6.310 1.00 14.23 O ATOM 1194 NE2 GLN A 437 15.322 4.912 4.975 1.00 11.97 N ATOM 1195 HE22 GLN A 437 16.091 5.383 4.458 1.00 0.00 H ATOM 1196 HE21 GLN A 437 15.240 3.875 4.954 1.00 0.00 H ATOM 1197 H GLN A 437 18.123 9.175 5.083 1.00 0.00 H ATOM 1198 N ARG A 438 15.611 10.024 7.225 1.00 9.30 N ATOM 1199 CA ARG A 438 14.844 10.712 8.272 1.00 10.28 C ATOM 1200 C ARG A 438 14.541 12.172 7.867 1.00 10.60 C ATOM 1201 O ARG A 438 13.391 12.615 8.070 1.00 11.80 O ATOM 1202 CB ARG A 438 15.544 10.565 9.655 1.00 12.00 C ATOM 1203 CG ARG A 438 15.567 9.064 10.170 1.00 21.21 C ATOM 1204 CD ARG A 438 16.599 8.875 11.311 1.00 30.20 C ATOM 1205 NE ARG A 438 16.736 7.469 11.792 1.00 42.77 N ATOM 1206 CZ ARG A 438 17.163 6.404 11.080 1.00 42.46 C ATOM 1207 NH1 ARG A 438 17.488 6.488 9.795 1.00 49.05 N ATOM 1208 NH2 ARG A 438 17.223 5.215 11.653 1.00 47.68 N ATOM 1209 HE ARG A 438 16.474 7.290 12.783 1.00 0.00 H ATOM 1210 HH12 ARG A 438 17.812 5.642 9.284 1.00 0.00 H ATOM 1211 HH11 ARG A 438 17.418 7.400 9.299 1.00 0.00 H ATOM 1212 HH22 ARG A 438 17.551 4.392 11.109 1.00 0.00 H ATOM 1213 HH21 ARG A 438 16.942 5.102 12.648 1.00 0.00 H ATOM 1214 H ARG A 438 16.540 9.611 7.446 1.00 0.00 H ATOM 1215 N TYR A 439 15.521 12.867 7.286 1.00 11.12 N ATOM 1216 CA TYR A 439 15.426 14.263 6.903 1.00 11.99 C ATOM 1217 C TYR A 439 14.255 14.437 5.945 1.00 11.86 C ATOM 1218 O TYR A 439 13.357 15.316 6.155 1.00 12.81 O ATOM 1219 CB TYR A 439 16.718 14.766 6.280 1.00 11.97 C ATOM 1220 CG TYR A 439 16.586 16.192 5.861 1.00 14.40 C ATOM 1221 CD1 TYR A 439 16.864 17.238 6.781 1.00 14.90 C ATOM 1222 CD2 TYR A 439 16.166 16.512 4.598 1.00 11.78 C ATOM 1223 CE1 TYR A 439 16.734 18.605 6.398 1.00 13.06 C ATOM 1224 CE2 TYR A 439 16.040 17.879 4.196 1.00 14.61 C ATOM 1225 CZ TYR A 439 16.299 18.894 5.143 1.00 17.17 C ATOM 1226 OH TYR A 439 16.159 20.192 4.728 1.00 15.47 O ATOM 1227 HH TYR A 439 15.228 20.343 4.428 1.00 0.00 H ATOM 1228 H TYR A 439 16.416 12.373 7.094 1.00 0.00 H ATOM 1229 N PHE A 440 14.228 13.613 4.898 1.00 10.73 N ATOM 1230 CA PHE A 440 13.242 13.873 3.849 1.00 10.05 C ATOM 1231 C PHE A 440 11.858 13.303 4.132 1.00 12.62 C ATOM 1232 O PHE A 440 10.868 13.782 3.570 1.00 12.78 O ATOM 1233 CB PHE A 440 13.779 13.380 2.477 1.00 10.10 C ATOM 1234 CG PHE A 440 14.832 14.262 1.910 1.00 7.36 C ATOM 1235 CD1 PHE A 440 14.524 15.569 1.515 1.00 10.69 C ATOM 1236 CD2 PHE A 440 16.112 13.802 1.771 1.00 6.78 C ATOM 1237 CE1 PHE A 440 15.514 16.408 0.977 1.00 11.06 C ATOM 1238 CE2 PHE A 440 17.106 14.636 1.229 1.00 10.19 C ATOM 1239 CZ PHE A 440 16.820 15.909 0.813 1.00 11.74 C ATOM 1240 H PHE A 440 14.887 12.811 4.829 1.00 0.00 H ATOM 1241 N LEU A 441 11.760 12.336 5.017 1.00 12.18 N ATOM 1242 CA LEU A 441 10.411 11.848 5.367 1.00 14.56 C ATOM 1243 C LEU A 441 9.810 12.963 6.213 1.00 16.85 C ATOM 1244 O LEU A 441 8.619 13.213 6.143 1.00 18.64 O ATOM 1245 CB LEU A 441 10.432 10.540 6.171 1.00 14.95 C ATOM 1246 CG LEU A 441 10.684 9.276 5.320 1.00 12.37 C ATOM 1247 CD1 LEU A 441 11.051 8.083 6.291 1.00 13.60 C ATOM 1248 CD2 LEU A 441 9.509 8.952 4.390 1.00 13.86 C ATOM 1249 H LEU A 441 12.608 11.926 5.458 1.00 0.00 H ATOM 1250 N ASN A 442 10.650 13.689 6.914 1.00 14.95 N ATOM 1251 CA ASN A 442 10.126 14.842 7.721 1.00 17.98 C ATOM 1252 C ASN A 442 9.862 16.113 6.908 1.00 18.78 C ATOM 1253 O ASN A 442 8.974 16.966 7.269 1.00 19.65 O ATOM 1254 CB ASN A 442 11.112 15.101 8.882 1.00 18.59 C ATOM 1255 CG ASN A 442 10.656 16.233 9.795 1.00 24.72 C ATOM 1256 OD1 ASN A 442 9.667 16.076 10.517 1.00 33.02 O ATOM 1257 ND2 ASN A 442 11.343 17.370 9.753 1.00 25.16 N ATOM 1258 HD22 ASN A 442 12.170 17.455 9.128 1.00 0.00 H ATOM 1259 HD21 ASN A 442 11.053 18.175 10.345 1.00 0.00 H ATOM 1260 H ASN A 442 11.666 13.468 6.910 1.00 0.00 H ATOM 1261 N ARG A 443 10.577 16.269 5.810 1.00 17.49 N ATOM 1262 CA ARG A 443 10.539 17.456 4.954 1.00 20.05 C ATOM 1263 C ARG A 443 10.533 17.157 3.458 1.00 18.24 C ATOM 1264 O ARG A 443 11.512 17.355 2.769 1.00 23.27 O ATOM 1265 CB ARG A 443 11.731 18.366 5.248 1.00 21.19 C ATOM 1266 CG ARG A 443 11.678 19.047 6.603 1.00 26.90 C ATOM 1267 CD ARG A 443 12.949 19.912 6.847 1.00 32.86 C ATOM 1268 NE ARG A 443 12.956 21.105 5.999 1.00 36.77 N ATOM 1269 CZ ARG A 443 13.759 22.156 6.197 1.00 40.43 C ATOM 1270 NH1 ARG A 443 14.602 22.176 7.241 1.00 40.05 N ATOM 1271 NH2 ARG A 443 13.717 23.187 5.362 1.00 40.22 N ATOM 1272 HE ARG A 443 12.297 21.137 5.195 1.00 0.00 H ATOM 1273 HH12 ARG A 443 15.225 22.995 7.391 1.00 0.00 H ATOM 1274 HH11 ARG A 443 14.633 21.372 7.900 1.00 0.00 H ATOM 1275 HH22 ARG A 443 14.341 24.005 5.514 1.00 0.00 H ATOM 1276 HH21 ARG A 443 13.060 23.177 4.556 1.00 0.00 H ATOM 1277 H ARG A 443 11.213 15.494 5.533 1.00 0.00 H ATOM 1278 N SER A 444 9.458 16.707 2.924 1.00 18.43 N ATOM 1279 CA SER A 444 9.592 16.193 1.569 1.00 18.92 C ATOM 1280 C SER A 444 9.521 17.305 0.553 1.00 19.20 C ATOM 1281 O SER A 444 9.967 17.144 -0.569 1.00 19.72 O ATOM 1282 CB SER A 444 8.563 15.169 1.306 1.00 18.43 C ATOM 1283 OG SER A 444 7.291 15.630 1.655 1.00 23.02 O ATOM 1284 HG SER A 444 7.275 15.854 2.619 1.00 0.00 H ATOM 1285 H SER A 444 8.548 16.709 3.427 1.00 0.00 H ATOM 1286 N SER A 445 8.979 18.453 0.936 1.00 19.28 N ATOM 1287 CA SER A 445 8.832 19.539 -0.075 1.00 20.67 C ATOM 1288 C SER A 445 10.198 20.024 -0.566 1.00 20.49 C ATOM 1289 O SER A 445 10.325 20.411 -1.700 1.00 18.48 O ATOM 1290 CB SER A 445 7.979 20.687 0.454 1.00 21.98 C ATOM 1291 OG SER A 445 8.667 21.378 1.455 1.00 24.13 O ATOM 1292 HG SER A 445 9.509 21.743 1.083 1.00 0.00 H ATOM 1293 H SER A 445 8.664 18.592 1.917 1.00 0.00 H ATOM 1294 N ASP A 446 11.228 19.918 0.297 1.00 19.15 N ATOM 1295 CA ASP A 446 12.602 20.143 -0.069 1.00 20.65 C ATOM 1296 C ASP A 446 13.105 19.224 -1.181 1.00 19.03 C ATOM 1297 O ASP A 446 13.957 19.602 -1.951 1.00 21.32 O ATOM 1298 CB ASP A 446 13.469 19.877 1.177 1.00 21.78 C ATOM 1299 CG ASP A 446 13.544 21.096 2.102 1.00 26.68 C ATOM 1300 OD1 ASP A 446 12.856 22.143 1.817 1.00 23.85 O ATOM 1301 OD2 ASP A 446 14.369 20.997 3.050 1.00 26.24 O ATOM 1302 H ASP A 446 11.018 19.659 1.282 1.00 0.00 H ATOM 1303 N LEU A 447 12.616 18.005 -1.232 1.00 16.98 N ATOM 1304 CA LEU A 447 13.048 17.145 -2.278 1.00 16.58 C ATOM 1305 C LEU A 447 12.183 17.404 -3.548 1.00 15.40 C ATOM 1306 O LEU A 447 12.710 17.441 -4.653 1.00 15.18 O ATOM 1307 CB LEU A 447 12.909 15.722 -1.822 1.00 16.15 C ATOM 1308 CG LEU A 447 13.335 14.510 -2.601 1.00 21.22 C ATOM 1309 CD1 LEU A 447 14.640 14.644 -3.324 1.00 19.15 C ATOM 1310 CD2 LEU A 447 13.350 13.266 -1.651 1.00 23.62 C ATOM 1311 H LEU A 447 11.929 17.677 -0.523 1.00 0.00 H ATOM 1312 N PHE A 448 10.868 17.513 -3.373 1.00 15.62 N ATOM 1313 CA PHE A 448 9.994 17.688 -4.565 1.00 14.69 C ATOM 1314 C PHE A 448 10.219 19.020 -5.238 1.00 17.85 C ATOM 1315 O PHE A 448 10.187 19.078 -6.466 1.00 16.28 O ATOM 1316 CB PHE A 448 8.520 17.543 -4.164 1.00 15.57 C ATOM 1317 CG PHE A 448 8.149 16.178 -3.708 1.00 13.97 C ATOM 1318 CD1 PHE A 448 8.435 15.067 -4.513 1.00 16.94 C ATOM 1319 CD2 PHE A 448 7.422 16.017 -2.530 1.00 17.82 C ATOM 1320 CE1 PHE A 448 8.027 13.757 -4.105 1.00 17.64 C ATOM 1321 CE2 PHE A 448 7.004 14.759 -2.100 1.00 19.49 C ATOM 1322 CZ PHE A 448 7.305 13.612 -2.898 1.00 17.44 C ATOM 1323 H PHE A 448 10.458 17.476 -2.418 1.00 0.00 H ATOM 1324 N ASP A 449 10.533 20.090 -4.463 1.00 18.38 N ATOM 1325 CA ASP A 449 10.484 21.434 -5.064 1.00 21.00 C ATOM 1326 C ASP A 449 11.341 21.532 -6.310 1.00 20.82 C ATOM 1327 O ASP A 449 10.944 22.246 -7.249 1.00 20.22 O ATOM 1328 CB ASP A 449 11.040 22.568 -4.156 1.00 22.34 C ATOM 1329 CG ASP A 449 10.048 23.084 -3.142 1.00 22.95 C ATOM 1330 OD1 ASP A 449 8.833 22.828 -3.222 1.00 26.25 O ATOM 1331 OD2 ASP A 449 10.546 23.787 -2.210 1.00 28.57 O ATOM 1332 H ASP A 449 10.802 19.963 -3.466 1.00 0.00 H ATOM 1333 N GLN A 450 12.558 20.951 -6.273 1.00 17.89 N ATOM 1334 CA GLN A 450 13.463 21.017 -7.401 1.00 18.28 C ATOM 1335 C GLN A 450 13.715 19.671 -8.155 1.00 16.95 C ATOM 1336 O GLN A 450 14.623 19.621 -8.964 1.00 18.31 O ATOM 1337 CB GLN A 450 14.848 21.564 -6.963 1.00 17.56 C ATOM 1338 CG GLN A 450 14.746 22.711 -5.931 1.00 18.25 C ATOM 1339 CD GLN A 450 14.101 23.966 -6.548 1.00 21.68 C ATOM 1340 OE1 GLN A 450 14.170 24.157 -7.798 1.00 21.44 O ATOM 1341 NE2 GLN A 450 13.447 24.822 -5.682 1.00 21.27 N ATOM 1342 HE22 GLN A 450 13.423 24.613 -4.663 1.00 0.00 H ATOM 1343 HE21 GLN A 450 12.978 25.675 -6.049 1.00 0.00 H ATOM 1344 H GLN A 450 12.853 20.444 -5.414 1.00 0.00 H ATOM 1345 N TRP A 451 12.975 18.587 -7.851 1.00 14.17 N ATOM 1346 CA TRP A 451 13.133 17.307 -8.543 1.00 11.07 C ATOM 1347 C TRP A 451 12.920 17.452 -10.066 1.00 11.40 C ATOM 1348 O TRP A 451 13.689 16.955 -10.928 1.00 12.39 O ATOM 1349 CB TRP A 451 12.135 16.246 -7.967 1.00 10.30 C ATOM 1350 CG TRP A 451 12.424 14.906 -8.534 1.00 10.22 C ATOM 1351 CD1 TRP A 451 11.752 14.279 -9.566 1.00 10.73 C ATOM 1352 CD2 TRP A 451 13.456 14.019 -8.128 1.00 11.83 C ATOM 1353 NE1 TRP A 451 12.332 13.073 -9.820 1.00 11.22 N ATOM 1354 CE2 TRP A 451 13.354 12.864 -8.944 1.00 11.00 C ATOM 1355 CE3 TRP A 451 14.462 14.069 -7.138 1.00 14.76 C ATOM 1356 CZ2 TRP A 451 14.205 11.787 -8.810 1.00 10.72 C ATOM 1357 CZ3 TRP A 451 15.339 12.978 -7.015 1.00 13.70 C ATOM 1358 CH2 TRP A 451 15.201 11.860 -7.849 1.00 10.90 C ATOM 1359 HE1 TRP A 451 12.039 12.413 -10.568 1.00 0.00 H ATOM 1360 H TRP A 451 12.264 18.663 -7.096 1.00 0.00 H ATOM 1361 N GLY A 452 11.870 18.153 -10.419 1.00 10.62 N ATOM 1362 CA GLY A 452 11.598 18.258 -11.899 1.00 10.30 C ATOM 1363 C GLY A 452 10.461 17.393 -12.407 1.00 9.82 C ATOM 1364 O GLY A 452 10.183 16.307 -11.860 1.00 8.90 O ATOM 1365 H GLY A 452 11.257 18.612 -9.716 1.00 0.00 H ATOM 1366 N TYR A 453 9.774 17.884 -13.459 1.00 9.05 N ATOM 1367 CA TYR A 453 8.627 17.192 -14.033 1.00 9.56 C ATOM 1368 C TYR A 453 8.880 16.994 -15.515 1.00 11.71 C ATOM 1369 O TYR A 453 9.673 17.715 -16.142 1.00 12.15 O ATOM 1370 CB TYR A 453 7.362 18.067 -13.902 1.00 8.91 C ATOM 1371 CG TYR A 453 6.757 18.024 -12.498 1.00 8.61 C ATOM 1372 CD1 TYR A 453 5.669 17.197 -12.255 1.00 10.99 C ATOM 1373 CD2 TYR A 453 7.320 18.760 -11.439 1.00 12.96 C ATOM 1374 CE1 TYR A 453 5.067 17.125 -11.016 1.00 12.08 C ATOM 1375 CE2 TYR A 453 6.740 18.710 -10.170 1.00 9.97 C ATOM 1376 CZ TYR A 453 5.624 17.842 -9.957 1.00 11.37 C ATOM 1377 OH TYR A 453 4.964 17.755 -8.721 1.00 13.31 O ATOM 1378 HH TYR A 453 4.599 18.643 -8.480 1.00 0.00 H ATOM 1379 H TYR A 453 10.074 18.789 -13.875 1.00 0.00 H ATOM 1380 N GLU A 454 8.184 15.993 -16.081 1.00 12.30 N ATOM 1381 CA GLU A 454 8.261 15.710 -17.515 1.00 12.79 C ATOM 1382 C GLU A 454 6.859 15.284 -17.952 1.00 12.14 C ATOM 1383 O GLU A 454 5.973 14.954 -17.150 1.00 11.70 O ATOM 1384 CB GLU A 454 9.286 14.570 -17.791 1.00 12.45 C ATOM 1385 CG GLU A 454 8.862 13.168 -17.150 1.00 13.58 C ATOM 1386 CD GLU A 454 10.040 12.192 -17.105 1.00 19.93 C ATOM 1387 OE1 GLU A 454 11.134 12.591 -17.556 1.00 22.55 O ATOM 1388 OE2 GLU A 454 9.929 11.050 -16.562 1.00 18.98 O ATOM 1389 H GLU A 454 7.573 15.402 -15.482 1.00 0.00 H ATOM 1390 N GLU A 455 6.617 15.344 -19.256 1.00 12.46 N ATOM 1391 CA GLU A 455 5.311 14.981 -19.730 1.00 11.81 C ATOM 1392 C GLU A 455 4.957 13.546 -19.304 1.00 11.75 C ATOM 1393 O GLU A 455 5.789 12.610 -19.428 1.00 12.12 O ATOM 1394 CB GLU A 455 5.282 15.149 -21.254 1.00 15.91 C ATOM 1395 CG GLU A 455 3.924 15.603 -21.714 1.00 22.69 C ATOM 1396 CD GLU A 455 3.784 15.538 -23.231 1.00 34.40 C ATOM 1397 OE1 GLU A 455 4.792 15.194 -23.933 1.00 34.67 O ATOM 1398 OE2 GLU A 455 2.645 15.812 -23.682 1.00 40.18 O ATOM 1399 H GLU A 455 7.358 15.647 -19.920 1.00 0.00 H ATOM 1400 N SER A 456 3.725 13.340 -18.881 1.00 12.22 N ATOM 1401 CA SER A 456 3.214 11.973 -18.524 1.00 10.44 C ATOM 1402 C SER A 456 3.025 11.136 -19.794 1.00 14.86 C ATOM 1403 O SER A 456 2.769 11.700 -20.869 1.00 15.89 O ATOM 1404 CB SER A 456 1.868 12.113 -17.835 1.00 11.96 C ATOM 1405 OG SER A 456 2.100 12.857 -16.594 1.00 13.12 O ATOM 1406 HG SER A 456 1.242 12.970 -16.113 1.00 0.00 H ATOM 1407 H SER A 456 3.084 14.154 -18.791 1.00 0.00 H ATOM 1408 N PRO A 457 3.086 9.815 -19.663 1.00 14.82 N ATOM 1409 CA PRO A 457 2.690 9.032 -20.884 1.00 17.25 C ATOM 1410 C PRO A 457 1.236 9.219 -21.338 1.00 17.67 C ATOM 1411 O PRO A 457 0.312 9.483 -20.528 1.00 18.69 O ATOM 1412 CB PRO A 457 3.018 7.592 -20.499 1.00 17.54 C ATOM 1413 CG PRO A 457 3.034 7.567 -18.946 1.00 18.03 C ATOM 1414 CD PRO A 457 3.118 9.003 -18.429 1.00 15.14 C ATOM 1415 N LYS A 458 1.027 9.140 -22.664 1.00 18.28 N ATOM 1416 CA LYS A 458 -0.304 9.240 -23.238 1.00 18.59 C ATOM 1417 C LYS A 458 -0.637 7.890 -23.907 1.00 17.97 C ATOM 1418 O LYS A 458 0.258 7.198 -24.409 1.00 19.64 O ATOM 1419 CB LYS A 458 -0.416 10.367 -24.274 1.00 20.68 C ATOM 1420 CG LYS A 458 0.114 11.756 -23.794 1.00 23.59 C ATOM 1421 CD LYS A 458 0.317 12.624 -25.035 1.00 30.44 C ATOM 1422 CE LYS A 458 -0.652 13.763 -25.060 1.00 36.15 C ATOM 1423 NZ LYS A 458 0.033 15.010 -24.589 1.00 37.81 N ATOM 1424 HZ1 LYS A 458 0.379 14.869 -23.618 1.00 0.00 H ATOM 1425 HZ2 LYS A 458 0.835 15.222 -25.217 1.00 0.00 H ATOM 1426 HZ3 LYS A 458 -0.641 15.802 -24.606 1.00 0.00 H ATOM 1427 H LYS A 458 1.841 9.003 -23.297 1.00 0.00 H ATOM 1428 N ALA A 459 -1.877 7.495 -23.702 1.00 20.51 N ATOM 1429 CA ALA A 459 -2.506 6.373 -24.389 1.00 21.01 C ATOM 1430 C ALA A 459 -1.911 5.059 -23.980 1.00 21.07 C ATOM 1431 O ALA A 459 -1.971 4.084 -24.747 1.00 21.51 O ATOM 1432 CB ALA A 459 -2.363 6.557 -25.952 1.00 20.91 C ATOM 1433 H ALA A 459 -2.444 8.018 -23.005 1.00 0.00 H ATOM 1434 N SER A 460 -1.345 4.998 -22.764 1.00 20.96 N ATOM 1435 CA SER A 460 -0.725 3.778 -22.299 1.00 19.33 C ATOM 1436 C SER A 460 -1.373 3.142 -21.043 1.00 17.76 C ATOM 1437 O SER A 460 -2.444 3.560 -20.595 1.00 17.23 O ATOM 1438 CB SER A 460 0.782 3.989 -22.098 1.00 21.01 C ATOM 1439 OG SER A 460 1.026 4.569 -20.831 1.00 20.28 O ATOM 1440 HG SER A 460 2.000 4.701 -20.712 1.00 0.00 H ATOM 1441 H SER A 460 -1.353 5.838 -22.150 1.00 0.00 H ATOM 1442 N GLU A 461 -0.698 2.124 -20.521 1.00 17.33 N ATOM 1443 CA GLU A 461 -1.219 1.408 -19.335 1.00 17.63 C ATOM 1444 C GLU A 461 -0.758 2.149 -18.071 1.00 16.34 C ATOM 1445 O GLU A 461 -1.089 1.712 -16.956 1.00 16.20 O ATOM 1446 CB GLU A 461 -0.782 -0.102 -19.309 1.00 18.59 C ATOM 1447 CG GLU A 461 0.701 -0.409 -18.952 1.00 20.12 C ATOM 1448 CD GLU A 461 1.791 0.006 -20.010 1.00 25.01 C ATOM 1449 OE1 GLU A 461 1.464 0.639 -21.073 1.00 26.00 O ATOM 1450 OE2 GLU A 461 2.997 -0.288 -19.718 1.00 29.69 O ATOM 1451 H GLU A 461 0.203 1.828 -20.949 1.00 0.00 H ATOM 1452 N LEU A 462 -0.044 3.265 -18.242 1.00 13.42 N ATOM 1453 CA LEU A 462 0.568 3.963 -17.096 1.00 12.85 C ATOM 1454 C LEU A 462 0.035 5.383 -17.050 1.00 13.25 C ATOM 1455 O LEU A 462 -0.370 5.935 -18.098 1.00 14.87 O ATOM 1456 CB LEU A 462 2.072 4.029 -17.221 1.00 12.61 C ATOM 1457 CG LEU A 462 2.812 2.692 -17.414 1.00 15.14 C ATOM 1458 CD1 LEU A 462 4.279 3.045 -17.445 1.00 14.26 C ATOM 1459 CD2 LEU A 462 2.491 1.772 -16.222 1.00 15.90 C ATOM 1460 H LEU A 462 0.083 3.648 -19.200 1.00 0.00 H ATOM 1461 N HIS A 463 0.105 6.042 -15.887 1.00 12.43 N ATOM 1462 CA HIS A 463 -0.201 7.481 -15.841 1.00 11.18 C ATOM 1463 C HIS A 463 0.851 8.240 -15.009 1.00 11.36 C ATOM 1464 O HIS A 463 1.714 7.616 -14.348 1.00 9.88 O ATOM 1465 CB HIS A 463 -1.610 7.740 -15.342 1.00 13.41 C ATOM 1466 CG HIS A 463 -1.824 7.396 -13.915 1.00 12.36 C ATOM 1467 ND1 HIS A 463 -1.493 8.258 -12.887 1.00 16.66 N ATOM 1468 CD2 HIS A 463 -2.398 6.314 -13.321 1.00 17.34 C ATOM 1469 CE1 HIS A 463 -1.820 7.711 -11.721 1.00 15.96 C ATOM 1470 NE2 HIS A 463 -2.399 6.547 -11.959 1.00 13.71 N ATOM 1471 H HIS A 463 0.375 5.538 -15.018 1.00 0.00 H ATOM 1472 N GLY A 464 0.773 9.548 -15.031 1.00 9.85 N ATOM 1473 CA GLY A 464 1.823 10.345 -14.384 1.00 9.21 C ATOM 1474 C GLY A 464 1.284 10.784 -13.011 1.00 8.54 C ATOM 1475 O GLY A 464 0.086 10.717 -12.788 1.00 11.45 O ATOM 1476 H GLY A 464 -0.026 10.018 -15.503 1.00 0.00 H ATOM 1477 N ILE A 465 2.180 11.211 -12.135 1.00 10.05 N ATOM 1478 CA ILE A 465 1.797 11.609 -10.762 1.00 13.48 C ATOM 1479 C ILE A 465 2.548 12.868 -10.368 1.00 12.58 C ATOM 1480 O ILE A 465 3.712 13.012 -10.656 1.00 11.20 O ATOM 1481 CB ILE A 465 2.010 10.468 -9.758 1.00 13.79 C ATOM 1482 CG1 ILE A 465 1.314 10.746 -8.406 1.00 18.55 C ATOM 1483 CG2 ILE A 465 3.455 10.087 -9.617 1.00 16.29 C ATOM 1484 CD1 ILE A 465 1.450 9.558 -7.428 1.00 22.56 C ATOM 1485 H ILE A 465 3.179 11.268 -12.419 1.00 0.00 H ATOM 1486 N ASN A 466 1.857 13.759 -9.704 1.00 13.11 N ATOM 1487 CA ASN A 466 2.545 14.913 -9.172 1.00 11.95 C ATOM 1488 C ASN A 466 2.914 14.804 -7.688 1.00 13.43 C ATOM 1489 O ASN A 466 2.655 13.781 -7.063 1.00 13.26 O ATOM 1490 CB ASN A 466 1.747 16.147 -9.531 1.00 14.04 C ATOM 1491 CG ASN A 466 0.490 16.276 -8.714 1.00 16.44 C ATOM 1492 OD1 ASN A 466 0.335 15.699 -7.590 1.00 14.25 O ATOM 1493 ND2 ASN A 466 -0.447 17.054 -9.272 1.00 14.57 N ATOM 1494 HD22 ASN A 466 -0.269 17.502 -10.193 1.00 0.00 H ATOM 1495 HD21 ASN A 466 -1.352 17.210 -8.784 1.00 0.00 H ATOM 1496 H ASN A 466 0.834 13.639 -9.562 1.00 0.00 H ATOM 1497 N GLU A 467 3.546 15.829 -7.127 1.00 12.32 N ATOM 1498 CA GLU A 467 4.088 15.737 -5.789 1.00 13.52 C ATOM 1499 C GLU A 467 3.050 15.639 -4.732 1.00 12.84 C ATOM 1500 O GLU A 467 3.390 15.312 -3.586 1.00 16.37 O ATOM 1501 CB GLU A 467 4.965 16.965 -5.495 1.00 10.90 C ATOM 1502 CG GLU A 467 4.214 18.281 -5.700 1.00 13.57 C ATOM 1503 CD GLU A 467 5.247 19.380 -5.859 1.00 20.19 C ATOM 1504 OE1 GLU A 467 5.927 19.339 -6.922 1.00 14.96 O ATOM 1505 OE2 GLU A 467 5.460 20.164 -4.893 1.00 17.35 O ATOM 1506 H GLU A 467 3.653 16.715 -7.660 1.00 0.00 H ATOM 1507 N SER A 468 1.810 15.956 -5.082 1.00 14.03 N ATOM 1508 CA SER A 468 0.675 15.748 -4.204 1.00 14.63 C ATOM 1509 C SER A 468 0.028 14.392 -4.313 1.00 14.61 C ATOM 1510 O SER A 468 -0.979 14.125 -3.604 1.00 14.51 O ATOM 1511 CB SER A 468 -0.359 16.892 -4.329 1.00 15.89 C ATOM 1512 OG SER A 468 0.226 18.151 -4.051 1.00 20.06 O ATOM 1513 HG SER A 468 0.584 18.151 -3.128 1.00 0.00 H ATOM 1514 H SER A 468 1.646 16.369 -6.022 1.00 0.00 H ATOM 1515 N MET A 469 0.650 13.513 -5.104 1.00 12.52 N ATOM 1516 CA MET A 469 0.189 12.109 -5.380 1.00 12.32 C ATOM 1517 C MET A 469 -1.092 12.036 -6.182 1.00 13.21 C ATOM 1518 O MET A 469 -1.747 11.002 -6.195 1.00 14.73 O ATOM 1519 CB MET A 469 0.110 11.212 -4.099 1.00 11.39 C ATOM 1520 CG MET A 469 1.384 11.251 -3.265 1.00 10.30 C ATOM 1521 SD MET A 469 2.779 10.503 -4.177 1.00 14.47 S ATOM 1522 CE MET A 469 3.660 11.902 -4.874 1.00 17.48 C ATOM 1523 H MET A 469 1.527 13.826 -5.568 1.00 0.00 H ATOM 1524 N ASN A 470 -1.429 13.123 -6.889 1.00 10.56 N ATOM 1525 CA ASN A 470 -2.572 13.124 -7.789 1.00 12.78 C ATOM 1526 C ASN A 470 -2.145 12.862 -9.224 1.00 12.21 C ATOM 1527 O ASN A 470 -1.070 13.276 -9.620 1.00 13.05 O ATOM 1528 CB ASN A 470 -3.252 14.503 -7.788 1.00 13.69 C ATOM 1529 CG ASN A 470 -3.820 14.862 -6.398 1.00 16.07 C ATOM 1530 OD1 ASN A 470 -4.363 13.983 -5.709 1.00 18.14 O ATOM 1531 ND2 ASN A 470 -3.701 16.115 -6.001 1.00 16.55 N ATOM 1532 HD22 ASN A 470 -3.237 16.814 -6.616 1.00 0.00 H ATOM 1533 HD21 ASN A 470 -4.071 16.404 -5.073 1.00 0.00 H ATOM 1534 H ASN A 470 -0.859 13.988 -6.792 1.00 0.00 H ATOM 1535 N ALA A 471 -2.998 12.195 -9.992 1.00 13.88 N ATOM 1536 CA ALA A 471 -2.684 11.987 -11.449 1.00 12.83 C ATOM 1537 C ALA A 471 -2.631 13.291 -12.129 1.00 13.19 C ATOM 1538 O ALA A 471 -3.365 14.246 -11.793 1.00 14.85 O ATOM 1539 CB ALA A 471 -3.711 11.118 -12.109 1.00 14.47 C ATOM 1540 H ALA A 471 -3.879 11.818 -9.589 1.00 0.00 H ATOM 1541 N SER A 472 -1.712 13.385 -13.061 1.00 13.46 N ATOM 1542 CA SER A 472 -1.402 14.661 -13.678 1.00 14.80 C ATOM 1543 C SER A 472 -0.881 14.416 -15.057 1.00 14.48 C ATOM 1544 O SER A 472 -0.373 13.315 -15.308 1.00 13.60 O ATOM 1545 CB SER A 472 -0.274 15.371 -12.907 1.00 15.31 C ATOM 1546 OG SER A 472 -0.240 16.720 -13.333 1.00 18.22 O ATOM 1547 HG SER A 472 0.479 17.199 -12.850 1.00 0.00 H ATOM 1548 H SER A 472 -1.198 12.532 -13.362 1.00 0.00 H ATOM 1549 N ASP A 473 -1.032 15.428 -15.926 1.00 13.51 N ATOM 1550 CA ASP A 473 -0.454 15.369 -17.280 1.00 15.68 C ATOM 1551 C ASP A 473 1.062 15.553 -17.351 1.00 12.63 C ATOM 1552 O ASP A 473 1.659 15.376 -18.435 1.00 13.40 O ATOM 1553 CB ASP A 473 -1.141 16.404 -18.218 1.00 16.80 C ATOM 1554 CG ASP A 473 -1.000 17.870 -17.735 1.00 24.00 C ATOM 1555 OD1 ASP A 473 -1.106 18.829 -18.565 1.00 29.00 O ATOM 1556 OD2 ASP A 473 -0.854 18.097 -16.511 1.00 29.15 O ATOM 1557 H ASP A 473 -1.568 16.271 -15.638 1.00 0.00 H ATOM 1558 N TYR A 474 1.674 15.990 -16.247 1.00 11.93 N ATOM 1559 CA TYR A 474 3.115 16.012 -16.083 1.00 10.75 C ATOM 1560 C TYR A 474 3.414 15.241 -14.848 1.00 12.50 C ATOM 1561 O TYR A 474 2.659 15.297 -13.850 1.00 13.30 O ATOM 1562 CB TYR A 474 3.710 17.420 -15.895 1.00 13.76 C ATOM 1563 CG TYR A 474 3.831 18.095 -17.207 1.00 12.69 C ATOM 1564 CD1 TYR A 474 5.060 18.256 -17.813 1.00 18.52 C ATOM 1565 CD2 TYR A 474 2.686 18.477 -17.867 1.00 20.10 C ATOM 1566 CE1 TYR A 474 5.159 18.839 -19.103 1.00 24.86 C ATOM 1567 CE2 TYR A 474 2.757 19.039 -19.164 1.00 22.79 C ATOM 1568 CZ TYR A 474 3.973 19.223 -19.742 1.00 24.61 C ATOM 1569 OH TYR A 474 3.995 19.809 -20.997 1.00 30.17 O ATOM 1570 HH TYR A 474 4.932 19.887 -21.307 1.00 0.00 H ATOM 1571 H TYR A 474 1.085 16.333 -15.462 1.00 0.00 H ATOM 1572 N THR A 475 4.566 14.594 -14.861 1.00 11.10 N ATOM 1573 CA THR A 475 4.815 13.643 -13.756 1.00 10.38 C ATOM 1574 C THR A 475 6.197 13.911 -13.175 1.00 9.04 C ATOM 1575 O THR A 475 7.091 14.405 -13.882 1.00 9.00 O ATOM 1576 CB THR A 475 4.791 12.150 -14.275 1.00 11.14 C ATOM 1577 OG1 THR A 475 4.877 11.262 -13.155 1.00 11.17 O ATOM 1578 CG2 THR A 475 5.917 11.825 -15.345 1.00 9.92 C ATOM 1579 HG1 THR A 475 4.862 10.326 -13.476 1.00 0.00 H ATOM 1580 H THR A 475 5.266 14.747 -15.615 1.00 0.00 H ATOM 1581 N LEU A 476 6.410 13.549 -11.903 1.00 9.23 N ATOM 1582 CA LEU A 476 7.763 13.697 -11.350 1.00 8.18 C ATOM 1583 C LEU A 476 8.746 12.926 -12.256 1.00 8.33 C ATOM 1584 O LEU A 476 8.440 11.774 -12.666 1.00 7.99 O ATOM 1585 CB LEU A 476 7.769 13.075 -9.906 1.00 9.31 C ATOM 1586 CG LEU A 476 7.060 14.013 -8.927 1.00 9.93 C ATOM 1587 CD1 LEU A 476 6.753 13.121 -7.639 1.00 11.45 C ATOM 1588 CD2 LEU A 476 7.887 15.292 -8.612 1.00 12.11 C ATOM 1589 H LEU A 476 5.635 13.172 -11.320 1.00 0.00 H ATOM 1590 N LYS A 477 9.930 13.495 -12.517 1.00 8.74 N ATOM 1591 CA LYS A 477 10.839 12.882 -13.559 1.00 8.48 C ATOM 1592 C LYS A 477 11.222 11.471 -13.120 1.00 10.11 C ATOM 1593 O LYS A 477 11.633 11.251 -11.960 1.00 9.21 O ATOM 1594 CB LYS A 477 12.090 13.695 -13.705 1.00 7.54 C ATOM 1595 CG LYS A 477 11.849 15.016 -14.478 1.00 9.31 C ATOM 1596 CD LYS A 477 13.071 15.897 -14.359 1.00 10.78 C ATOM 1597 CE LYS A 477 12.914 17.058 -15.408 1.00 17.55 C ATOM 1598 NZ LYS A 477 14.265 17.595 -15.711 1.00 18.71 N ATOM 1599 HZ1 LYS A 477 14.696 17.958 -14.837 1.00 0.00 H ATOM 1600 HZ2 LYS A 477 14.858 16.836 -16.103 1.00 0.00 H ATOM 1601 HZ3 LYS A 477 14.183 18.366 -16.404 1.00 0.00 H ATOM 1602 H LYS A 477 10.222 14.353 -12.007 1.00 0.00 H ATOM 1603 N GLY A 478 10.995 10.535 -14.036 1.00 7.83 N ATOM 1604 CA GLY A 478 11.329 9.171 -13.794 1.00 11.41 C ATOM 1605 C GLY A 478 10.213 8.360 -13.155 1.00 9.15 C ATOM 1606 O GLY A 478 10.368 7.174 -13.052 1.00 13.56 O ATOM 1607 H GLY A 478 10.566 10.803 -14.945 1.00 0.00 H ATOM 1608 N VAL A 479 9.145 8.966 -12.659 1.00 8.56 N ATOM 1609 CA VAL A 479 8.135 8.176 -11.935 1.00 7.72 C ATOM 1610 C VAL A 479 6.897 7.962 -12.756 1.00 7.55 C ATOM 1611 O VAL A 479 6.456 8.894 -13.440 1.00 8.00 O ATOM 1612 CB VAL A 479 7.671 8.984 -10.651 1.00 7.81 C ATOM 1613 CG1 VAL A 479 6.571 8.266 -9.913 1.00 11.03 C ATOM 1614 CG2 VAL A 479 8.903 9.384 -9.793 1.00 8.52 C ATOM 1615 H VAL A 479 9.021 9.991 -12.780 1.00 0.00 H ATOM 1616 N VAL A 480 6.336 6.758 -12.769 1.00 8.17 N ATOM 1617 CA VAL A 480 5.060 6.510 -13.428 1.00 9.31 C ATOM 1618 C VAL A 480 4.273 5.521 -12.583 1.00 9.05 C ATOM 1619 O VAL A 480 4.860 4.752 -11.813 1.00 8.73 O ATOM 1620 CB VAL A 480 5.314 5.777 -14.776 1.00 10.48 C ATOM 1621 CG1 VAL A 480 5.419 6.773 -15.904 1.00 11.39 C ATOM 1622 CG2 VAL A 480 6.619 4.883 -14.649 1.00 14.64 C ATOM 1623 H VAL A 480 6.821 5.970 -12.295 1.00 0.00 H ATOM 1624 N VAL A 481 2.971 5.482 -12.806 1.00 8.60 N ATOM 1625 CA VAL A 481 2.092 4.688 -12.009 1.00 9.44 C ATOM 1626 C VAL A 481 1.211 3.809 -12.873 1.00 11.73 C ATOM 1627 O VAL A 481 0.635 4.259 -13.899 1.00 11.39 O ATOM 1628 CB VAL A 481 1.177 5.652 -11.181 1.00 8.08 C ATOM 1629 CG1 VAL A 481 0.214 4.810 -10.279 1.00 10.13 C ATOM 1630 CG2 VAL A 481 1.967 6.601 -10.321 1.00 10.44 C ATOM 1631 H VAL A 481 2.575 6.046 -13.585 1.00 0.00 H ATOM 1632 N THR A 482 1.064 2.563 -12.446 1.00 12.30 N ATOM 1633 CA THR A 482 0.254 1.565 -13.199 1.00 13.85 C ATOM 1634 C THR A 482 -1.223 1.895 -13.050 1.00 15.75 C ATOM 1635 O THR A 482 -1.710 2.132 -11.933 1.00 15.18 O ATOM 1636 CB THR A 482 0.485 0.129 -12.690 1.00 14.90 C ATOM 1637 OG1 THR A 482 1.848 -0.226 -12.861 1.00 17.40 O ATOM 1638 CG2 THR A 482 -0.398 -0.886 -13.519 1.00 13.36 C ATOM 1639 HG1 THR A 482 1.991 -1.149 -12.533 1.00 0.00 H ATOM 1640 H THR A 482 1.527 2.274 -11.561 1.00 0.00 H ATOM 1641 N LYS A 483 -1.933 2.034 -14.179 1.00 16.27 N ATOM 1642 CA LYS A 483 -3.402 2.259 -14.077 1.00 19.00 C ATOM 1643 C LYS A 483 -4.084 0.996 -13.526 1.00 21.37 C ATOM 1644 O LYS A 483 -3.803 -0.109 -13.995 1.00 19.27 O ATOM 1645 CB LYS A 483 -4.037 2.598 -15.430 1.00 19.94 C ATOM 1646 CG LYS A 483 -3.532 3.917 -16.064 1.00 20.47 C ATOM 1647 CD LYS A 483 -4.214 4.084 -17.431 1.00 21.51 C ATOM 1648 CE LYS A 483 -3.564 5.210 -18.148 1.00 27.17 C ATOM 1649 NZ LYS A 483 -3.908 6.519 -17.647 1.00 32.81 N ATOM 1650 HZ1 LYS A 483 -4.935 6.661 -17.729 1.00 0.00 H ATOM 1651 HZ2 LYS A 483 -3.625 6.592 -16.649 1.00 0.00 H ATOM 1652 HZ3 LYS A 483 -3.411 7.243 -18.204 1.00 0.00 H ATOM 1653 H LYS A 483 -1.467 1.986 -15.108 1.00 0.00 H ATOM 1654 N ASN A 484 -4.986 1.194 -12.555 1.00 22.59 N ATOM 1655 CA ASN A 484 -5.825 0.101 -12.058 1.00 25.03 C ATOM 1656 C ASN A 484 -6.832 -0.411 -13.121 1.00 25.56 C ATOM 1657 O ASN A 484 -7.258 -1.596 -13.016 1.00 26.23 O ATOM 1658 CB ASN A 484 -6.644 0.525 -10.836 1.00 25.51 C ATOM 1659 CG ASN A 484 -5.790 0.799 -9.591 1.00 29.30 C ATOM 1660 OD1 ASN A 484 -4.768 0.150 -9.355 1.00 31.60 O ATOM 1661 ND2 ASN A 484 -6.267 1.747 -8.751 1.00 34.84 N ATOM 1662 HD22 ASN A 484 -7.134 2.268 -8.994 1.00 0.00 H ATOM 1663 HD21 ASN A 484 -5.767 1.954 -7.863 1.00 0.00 H ATOM 1664 H ASN A 484 -5.093 2.144 -12.146 1.00 0.00 H TER 1665 ASN A 484 HETATM 1666 O HOH 1 6.996 -0.344 4.533 1.00 24.06 O HETATM 1667 O HOH 2 26.472 16.221 13.323 1.00 29.86 O HETATM 1668 O HOH 3 24.232 7.713 -13.391 1.00 15.90 O HETATM 1669 O HOH 4 29.157 5.348 17.401 1.00 9.23 O HETATM 1670 O HOH 5 21.915 3.293 -2.338 1.00 15.39 O HETATM 1671 O HOH 6 7.639 -4.838 -4.773 1.00 10.83 O HETATM 1672 O HOH 7 7.606 -4.639 -7.402 1.00 19.30 O HETATM 1673 O HOH 8 25.527 6.197 4.691 1.00 10.31 O HETATM 1674 O HOH 9 11.825 -10.928 -8.823 1.00 39.11 O HETATM 1675 O HOH 10 24.461 5.762 -6.350 1.00 11.36 O HETATM 1676 O HOH 11 28.348 6.251 4.134 1.00 15.83 O HETATM 1677 O HOH 12 15.298 18.072 -12.713 1.00 19.52 O HETATM 1678 O HOH 13 8.343 -7.619 4.850 1.00 22.06 O HETATM 1679 O HOH 14 14.463 10.826 -12.407 1.00 13.15 O HETATM 1680 O HOH 15 -1.284 11.040 -16.507 1.00 15.64 O HETATM 1681 O HOH 16 25.355 -4.264 -4.940 1.00 19.00 O HETATM 1682 O HOH 17 26.212 3.674 -12.652 1.00 17.53 O HETATM 1683 O HOH 18 -2.394 18.294 -7.389 1.00 16.13 O HETATM 1684 O HOH 19 17.823 13.525 9.803 1.00 16.67 O HETATM 1685 O HOH 20 30.301 7.804 5.303 1.00 17.32 O HETATM 1686 O HOH 21 -2.080 0.473 -9.810 1.00 18.57 O HETATM 1687 O HOH 22 8.132 9.380 -15.939 1.00 13.73 O HETATM 1688 O HOH 23 22.063 -8.456 -13.491 1.00 29.16 O HETATM 1689 O HOH 24 15.897 13.271 -14.589 1.00 28.14 O HETATM 1690 O HOH 25 -1.140 6.889 -20.512 1.00 19.76 O HETATM 1691 O HOH 26 18.111 -8.100 -2.390 1.00 20.62 O HETATM 1692 O HOH 27 0.579 14.007 -20.776 1.00 26.23 O HETATM 1693 O HOH 28 -3.530 1.444 -0.241 1.00 25.06 O HETATM 1694 O HOH 29 11.128 0.597 -13.098 1.00 18.29 O HETATM 1695 O HOH 30 24.218 1.942 -8.112 1.00 14.78 O HETATM 1696 O HOH 31 36.681 6.005 3.437 1.00 17.21 O HETATM 1697 O HOH 32 29.029 16.772 -4.591 1.00 25.47 O HETATM 1698 O HOH 33 8.655 16.043 -21.089 1.00 22.07 O HETATM 1699 O HOH 34 28.705 0.710 8.044 1.00 20.81 O HETATM 1700 O HOH 35 30.933 5.173 -6.524 1.00 18.95 O HETATM 1701 O HOH 36 30.258 10.683 7.175 1.00 27.31 O HETATM 1702 O HOH 37 17.068 19.527 -5.205 1.00 19.93 O HETATM 1703 O HOH 38 -4.578 1.259 4.857 1.00 18.52 O HETATM 1704 O HOH 39 18.845 13.293 13.944 1.00 36.61 O HETATM 1705 O HOH 40 3.803 4.453 -20.883 1.00 23.06 O HETATM 1706 O HOH 41 20.272 -3.744 -13.398 1.00 17.33 O HETATM 1707 O HOH 42 25.361 -7.198 -5.156 1.00 23.50 O HETATM 1708 O HOH 43 19.826 -0.571 4.533 1.00 26.87 O HETATM 1709 O HOH 44 6.105 5.484 -19.581 1.00 23.19 O HETATM 1710 O HOH 45 22.574 12.369 -11.344 1.00 20.32 O HETATM 1711 O HOH 46 22.874 4.600 20.003 1.00 22.54 O HETATM 1712 O HOH 47 22.092 -4.415 -14.946 1.00 29.37 O HETATM 1713 O HOH 48 -2.532 -0.452 -16.461 1.00 17.35 O HETATM 1714 O HOH 49 26.339 4.748 2.093 1.00 19.02 O HETATM 1715 O HOH 50 35.259 12.424 -3.373 1.00 26.14 O HETATM 1716 O HOH 51 20.796 8.240 18.348 1.00 24.98 O HETATM 1717 O HOH 52 -5.707 3.787 -11.975 1.00 30.55 O HETATM 1718 O HOH 53 32.827 14.094 6.081 1.00 24.60 O HETATM 1719 O HOH 54 23.461 4.746 12.109 1.00 25.38 O HETATM 1720 O HOH 55 24.920 19.379 7.767 1.00 28.14 O HETATM 1721 O HOH 56 -5.134 7.146 5.449 1.00 23.14 O HETATM 1722 O HOH 57 5.882 -2.042 -10.376 1.00 21.95 O HETATM 1723 O HOH 58 22.681 15.587 17.097 1.00 40.57 O HETATM 1724 O HOH 59 29.086 15.988 11.890 1.00 31.93 O HETATM 1725 O HOH 60 -5.260 8.000 -0.403 1.00 22.56 O HETATM 1726 O HOH 61 18.124 -5.273 5.575 1.00 21.70 O HETATM 1727 O HOH 62 12.311 -7.618 5.059 1.00 24.18 O HETATM 1728 O HOH 63 -1.487 10.799 -19.265 1.00 29.05 O HETATM 1729 O HOH 64 0.019 19.673 -6.171 1.00 24.09 O HETATM 1730 O HOH 65 19.464 15.244 11.454 1.00 23.31 O HETATM 1731 O HOH 66 12.591 5.910 8.663 1.00 23.52 O HETATM 1732 O HOH 67 9.923 19.710 -9.175 1.00 13.98 O HETATM 1733 O HOH 68 3.733 -1.513 -17.395 1.00 26.83 O HETATM 1734 O HOH 69 37.762 7.997 2.085 1.00 23.45 O HETATM 1735 O HOH 70 22.643 10.686 22.228 1.00 27.13 O HETATM 1736 O HOH 71 -4.787 1.622 -20.678 1.00 30.08 O HETATM 1737 O HOH 72 30.798 -2.418 -2.614 1.00 21.34 O HETATM 1738 O HOH 73 18.485 20.206 -7.475 1.00 27.05 O HETATM 1739 O HOH 74 15.137 22.016 -1.981 1.00 23.15 O HETATM 1740 O HOH 75 6.712 -0.922 -17.577 1.00 34.57 O HETATM 1741 O HOH 76 13.919 17.323 8.233 1.00 20.13 O HETATM 1742 O HOH 77 31.476 11.113 22.757 1.00 20.46 O HETATM 1743 O HOH 78 11.655 24.209 -9.592 1.00 19.80 O HETATM 1744 O HOH 79 26.288 10.543 -11.209 1.00 34.38 O HETATM 1745 O HOH 80 22.362 11.856 24.747 1.00 32.17 O HETATM 1746 O HOH 81 2.089 18.505 -2.202 1.00 33.31 O HETATM 1747 O HOH 82 13.371 11.307 -17.164 1.00 37.80 O HETATM 1748 O HOH 83 11.677 11.536 9.797 1.00 25.85 O HETATM 1749 O HOH 84 3.198 8.532 6.379 1.00 42.81 O HETATM 1750 O HOH 85 8.108 12.338 -20.733 1.00 28.44 O HETATM 1751 O HOH 86 -4.994 3.576 -25.051 1.00 31.17 O HETATM 1752 O HOH 87 17.697 17.585 10.877 1.00 28.66 O HETATM 1753 O HOH 88 2.415 -1.659 -10.833 1.00 26.89 O HETATM 1754 O HOH 89 5.464 17.200 0.196 1.00 31.77 O HETATM 1755 O HOH 90 15.705 -11.486 -10.910 1.00 27.56 O HETATM 1756 O HOH 91 11.079 0.115 -17.477 1.00 40.93 O HETATM 1757 O HOH 92 4.110 11.924 -23.269 1.00 29.21 O HETATM 1758 O HOH 93 20.165 13.718 -10.984 1.00 19.09 O HETATM 1759 O HOH 94 23.219 -0.194 5.849 1.00 33.69 O HETATM 1760 O HOH 95 -2.143 -2.653 -6.901 1.00 28.21 O HETATM 1761 O HOH 96 23.085 -5.924 -1.677 1.00 41.01 O HETATM 1762 O HOH 97 2.663 7.601 -24.508 1.00 30.19 O HETATM 1763 O HOH 98 14.755 -7.929 5.356 1.00 24.90 O HETATM 1764 O HOH 99 2.606 -1.695 -15.061 1.00 22.44 O HETATM 1765 O HOH 100 31.192 3.849 3.135 1.00 26.30 O HETATM 1766 O HOH 101 24.537 -2.058 4.039 1.00 38.47 O HETATM 1767 O HOH 102 11.612 -6.421 -13.876 1.00 39.42 O HETATM 1768 O HOH 103 6.454 11.653 4.836 1.00 33.48 O HETATM 1769 O HOH 104 23.155 10.081 -14.631 1.00 38.78 O HETATM 1770 O HOH 105 4.556 6.227 -23.216 1.00 38.41 O HETATM 1771 O HOH 106 29.981 24.428 0.408 1.00 45.33 O HETATM 1772 O HOH 107 14.361 26.497 -9.109 1.00 24.47 O HETATM 1773 O HOH 108 -1.363 -2.083 -10.125 1.00 28.86 O HETATM 1774 O HOH 109 19.388 0.873 -13.994 1.00 27.35 O HETATM 1775 O HOH 110 3.516 20.902 -3.009 1.00 25.20 O HETATM 1776 O HOH 111 26.043 16.670 -4.421 1.00 34.78 O HETATM 1777 O HOH 112 -2.090 -0.982 -2.987 1.00 33.69 O HETATM 1778 O HOH 113 11.579 9.249 -17.679 1.00 36.56 O HETATM 1779 O HOH 114 -6.139 14.376 -3.749 1.00 33.33 O HETATM 1780 O HOH 115 33.030 10.769 7.557 1.00 26.05 O HETATM 1781 O HOH 116 15.145 16.244 10.329 1.00 39.64 O HETATM 1782 O HOH 117 -0.251 1.437 4.670 1.00 26.84 O HETATM 1783 O HOH 118 16.877 26.804 -10.016 1.00 43.33 O HETATM 1784 O HOH 119 17.047 20.236 -9.570 1.00 26.98 O HETATM 1785 O HOH 120 32.608 3.015 0.304 1.00 41.57 O HETATM 1786 O HOH 121 17.255 16.777 -13.834 1.00 44.49 O HETATM 1787 O HOH 122 37.188 2.755 -6.137 1.00 48.19 O HETATM 1788 O HOH 123 31.292 15.088 -4.707 1.00 39.35 O HETATM 1789 O HOH 124 -5.355 11.248 -8.927 1.00 25.42 O HETATM 1790 O HOH 125 36.755 10.593 -0.969 1.00 37.88 O HETATM 1791 O HOH 126 20.715 23.269 -3.519 1.00 43.88 O HETATM 1792 O HOH 127 10.642 23.226 0.480 1.00 30.21 O HETATM 1793 O HOH 128 16.604 23.326 -9.503 1.00 35.23 O HETATM 1794 O HOH 129 14.562 10.002 -14.948 1.00 34.24 O HETATM 1795 O HOH 130 32.113 -0.550 3.191 1.00 38.11 O HETATM 1796 O HOH 131 3.633 5.718 4.732 1.00 24.67 O HETATM 1797 O HOH 132 25.722 19.431 -5.768 1.00 45.97 O HETATM 1798 O HOH 133 7.920 19.572 6.744 1.00 47.14 O HETATM 1799 O HOH 134 7.981 8.251 8.582 1.00 31.15 O HETATM 1800 O HOH 135 24.407 -8.180 -7.500 1.00 31.66 O HETATM 1801 O HOH 136 21.064 16.529 -10.771 1.00 32.40 O HETATM 1802 O HOH 137 -4.222 17.615 -3.601 1.00 26.95 O HETATM 1803 O HOH 138 0.251 4.692 5.933 1.00 31.18 O HETATM 1804 O HOH 139 -2.314 21.266 -5.113 1.00 35.18 O HETATM 1805 O HOH 140 6.226 9.945 -18.477 1.00 34.17 O HETATM 1806 O HOH 141 13.584 23.907 -0.681 1.00 38.69 O HETATM 1807 O HOH 142 4.952 19.211 1.950 1.00 39.41 O HETATM 1808 O HOH 143 31.500 20.773 5.049 1.00 33.16 O HETATM 1809 O HOH 144 2.778 -4.030 -1.022 1.00 34.70 O HETATM 1810 O HOH 145 26.714 -3.148 -12.410 1.00 42.93 O HETATM 1811 O HOH 146 -1.915 -6.584 -2.585 1.00 41.77 O HETATM 1812 O HOH 147 18.865 -1.839 -14.348 1.00 38.11 O HETATM 1813 O HOH 148 -6.176 -0.809 2.116 1.00 37.28 O HETATM 1814 O HOH 149 30.152 19.049 -5.514 1.00 36.24 O HETATM 1815 O HOH 150 28.148 -10.066 -6.408 1.00 51.20 O HETATM 1816 O HOH 151 3.795 15.629 -1.018 1.00 43.28 O HETATM 1817 O HOH 152 38.235 12.505 1.026 1.00 41.73 O HETATM 1818 O HOH 153 -3.292 17.022 -15.597 1.00 38.27 O HETATM 1819 O HOH 154 37.025 3.417 -3.307 1.00 34.53 O HETATM 1820 O HOH 155 29.082 14.202 -7.070 1.00 47.69 O HETATM 1821 O HOH 156 19.999 -14.188 -3.493 1.00 51.01 O HETATM 1822 O HOH 157 24.791 13.740 -10.799 1.00 34.47 O HETATM 1823 O HOH 158 -3.233 8.859 -6.354 1.00 40.74 O HETATM 1824 O HOH 159 28.723 5.370 -13.412 1.00 34.74 O HETATM 1825 O HOH 160 26.541 -1.343 -14.147 1.00 34.18 O HETATM 1826 O HOH 161 20.672 4.756 11.546 1.00 27.06 O HETATM 1827 O HOH 162 -3.481 -0.584 -6.777 1.00 36.43 O HETATM 1828 O HOH 163 23.478 20.984 9.334 1.00 33.74 O HETATM 1829 O HOH 164 20.765 24.894 7.128 1.00 32.04 O HETATM 1830 O HOH 165 11.293 -3.910 -14.922 1.00 44.93 O HETATM 1831 O HOH 166 15.575 3.947 14.100 1.00 41.57 O HETATM 1832 O HOH 167 3.176 15.077 2.955 1.00 41.54 O HETATM 1833 O HOH 168 24.370 -7.895 -1.160 1.00 41.35 O HETATM 1834 O HOH 169 6.682 7.766 -19.761 1.00 33.23 O HETATM 1835 O HOH 170 17.574 17.934 13.490 1.00 45.98 O HETATM 1836 O HOH 171 21.131 25.336 -1.836 1.00 45.82 O HETATM 1837 O HOH 172 16.076 23.870 9.280 1.00 38.85 O HETATM 1838 O HOH 173 -4.121 6.876 -4.626 1.00 31.64 O HETATM 1839 O HOH 174 30.723 12.505 -6.376 1.00 45.16 O HETATM 1840 O HOH 175 14.437 26.386 -0.776 1.00 44.57 O HETATM 1841 O HOH 176 21.345 -1.047 7.791 1.00 33.29 O HETATM 1842 O HOH 177 19.061 19.504 -11.281 1.00 42.18 O HETATM 1843 O HOH 178 9.002 11.820 9.809 1.00 39.73 O HETATM 1844 O HOH 179 0.845 -3.665 -15.613 1.00 31.97 O HETATM 1845 O HOH 180 36.051 13.914 4.605 1.00 39.58 O HETATM 1846 O HOH 181 5.731 19.141 -22.851 1.00 46.52 O HETATM 1847 O HOH 182 -3.503 -2.633 -12.734 1.00 26.30 O HETATM 1848 O HOH 183 -7.867 3.824 -10.632 1.00 36.56 O HETATM 1849 O HOH 184 6.907 10.582 7.354 1.00 40.34 O HETATM 1850 O HOH 185 -2.701 -3.399 -3.749 1.00 41.23 O HETATM 1851 O HOH 186 -1.768 13.338 -19.911 1.00 39.15 O HETATM 1852 O HOH 187 5.242 1.773 6.206 1.00 37.63 O HETATM 1853 O HOH 188 14.861 17.696 -5.588 1.00 32.25 O HETATM 1854 O HOH 189 12.428 14.799 -19.107 1.00 43.68 O HETATM 1855 O HOH 190 6.045 4.727 10.969 1.00 40.86 O HETATM 1856 O HOH 191 -4.766 0.180 -18.126 1.00 24.98 O HETATM 1857 O HOH 192 26.706 -1.593 2.788 1.00 35.08 O HETATM 1858 O HOH 193 23.664 16.494 -11.924 1.00 37.33 O HETATM 1859 O HOH 194 26.609 -1.120 6.217 1.00 31.70 O HETATM 1860 O HOH 195 12.625 13.254 11.800 1.00 36.41 O HETATM 1861 O HOH 196 3.246 10.112 -25.438 1.00 23.76 O HETATM 1862 O HOH 197 16.965 25.935 -6.334 1.00 45.19 O HETATM 1863 O HOH 198 -4.634 19.700 -4.834 1.00 26.89 O HETATM 1864 O HOH 199 14.900 12.574 13.139 1.00 36.05 O HETATM 1865 O HOH 200 23.020 23.856 8.089 1.00 32.74 O HETATM 1866 O HOH 201 5.001 2.511 10.104 1.00 36.89 O HETATM 1867 O HOH 202 -5.894 19.139 -7.587 1.00 27.16 O HETATM 1868 O HOH 203 -5.778 16.982 -9.112 1.00 28.87 O HETATM 1869 O HOH 204 7.147 20.522 -2.575 1.00 30.47 O HETATM 1870 O HOH 205 13.733 -10.520 -7.413 1.00 33.27 O HETATM 1871 O HOH 206 7.417 15.689 4.501 1.00 30.31 O HETATM 1872 O HOH 207 36.323 4.288 -1.137 1.00 29.49 O HETATM 1873 O HOH 208 23.388 7.579 23.000 1.00 32.05 O HETATM 1874 O HOH 209 20.565 12.713 20.059 1.00 38.30 O HETATM 1875 O HOH 210 34.806 -0.485 -4.654 1.00 44.91 O HETATM 1876 O HOH 211 28.015 -5.426 -2.320 1.00 30.78 O HETATM 1877 O HOH 212 16.537 -6.628 6.937 1.00 43.24 O HETATM 1878 PB GDP A 213 28.236 2.764 4.984 1.00 0.21 P HETATM 1879 O1B GDP A 213 28.653 3.805 5.972 1.00 -0.59 O HETATM 1880 O2B GDP A 213 29.095 1.535 5.154 1.00 -0.59 O HETATM 1881 O3B GDP A 213 28.287 3.373 3.643 1.00 -0.59 O HETATM 1882 O3A GDP A 213 26.844 2.128 5.453 1.00 -0.15 O HETATM 1883 PA GDP A 213 25.444 2.723 5.760 1.00 0.33 P HETATM 1884 O1A GDP A 213 25.401 4.065 6.469 1.00 -0.56 O HETATM 1885 O2A GDP A 213 24.661 1.619 6.359 1.00 -0.56 O HETATM 1886 O5' GDP A 213 24.715 2.979 4.368 1.00 -0.24 O HETATM 1887 C5' GDP A 213 24.626 1.955 3.368 1.00 0.11 C HETATM 1888 C4' GDP A 213 23.579 2.441 2.332 1.00 0.12 C HETATM 1889 O4' GDP A 213 23.693 1.537 1.218 1.00 -0.33 O HETATM 1890 C1' GDP A 213 22.429 0.971 0.882 1.00 0.22 C HETATM 1891 C2' GDP A 213 21.769 0.865 2.278 1.00 0.14 C HETATM 1892 C3' GDP A 213 22.156 2.285 2.817 1.00 0.12 C HETATM 1893 O3' GDP A 213 21.394 3.394 2.231 1.00 -0.39 O HETATM 1894 H5 GDP A 213 20.488 3.337 2.510 1.00 0.21 H HETATM 1895 H4 GDP A 213 22.081 2.317 3.914 1.00 0.06 H HETATM 1896 O2' GDP A 213 20.370 0.742 2.060 1.00 -0.38 O HETATM 1897 H7 GDP A 213 19.909 0.885 2.878 1.00 0.21 H HETATM 1898 H6 GDP A 213 22.155 0.045 2.901 1.00 0.07 H HETATM 1899 N9 GDP A 213 22.736 -0.349 0.297 1.00 -0.10 N HETATM 1900 C8 GDP A 213 23.113 -1.553 0.905 1.00 0.19 C HETATM 1901 N7 GDP A 213 23.337 -2.465 -0.106 1.00 -0.19 N HETATM 1902 C5 GDP A 213 23.150 -1.836 -1.312 1.00 0.26 C HETATM 1903 C6 GDP A 213 23.280 -2.245 -2.729 1.00 0.26 C HETATM 1904 O6 GDP A 213 23.618 -3.437 -3.000 1.00 -0.36 O HETATM 1905 N1 GDP A 213 23.042 -1.306 -3.668 1.00 -0.25 N HETATM 1906 C2 GDP A 213 22.668 -0.017 -3.378 1.00 0.20 C HETATM 1907 N2 GDP A 213 22.422 0.878 -4.364 1.00 -0.33 N HETATM 1908 H11 GDP A 213 22.142 1.841 -4.128 1.00 0.18 H HETATM 1909 H12 GDP A 213 22.515 0.596 -5.350 1.00 0.18 H HETATM 1910 N3 GDP A 213 22.520 0.425 -2.076 1.00 -0.19 N HETATM 1911 C4 GDP A 213 22.770 -0.469 -1.045 1.00 0.33 C HETATM 1912 H13 GDP A 213 22.231 1.393 -1.877 1.00 0.25 H HETATM 1913 H10 GDP A 213 23.144 -1.563 -4.629 1.00 0.18 H HETATM 1914 H9 GDP A 213 23.211 -1.735 1.974 1.00 0.18 H HETATM 1915 H8 GDP A 213 21.838 1.588 0.189 1.00 0.10 H HETATM 1916 H3 GDP A 213 23.778 3.483 2.043 1.00 0.07 H HETATM 1917 H1 GDP A 213 24.300 1.008 3.822 1.00 0.06 H HETATM 1918 H2 GDP A 213 25.603 1.812 2.883 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1878 1879 1880 1881 1882 CONECT 1879 1878 CONECT 1880 1878 CONECT 1881 1878 CONECT 1882 1878 1883 CONECT 1883 1882 1884 1885 1886 CONECT 1884 1883 CONECT 1885 1883 CONECT 1886 1883 1887 CONECT 1887 1886 1888 1917 1918 CONECT 1888 1887 1889 1892 1916 CONECT 1889 1888 1890 CONECT 1890 1889 1891 1899 1915 CONECT 1891 1890 1892 1896 1898 CONECT 1892 1888 1891 1893 1895 CONECT 1893 1892 1894 CONECT 1894 1893 CONECT 1895 1892 CONECT 1896 1891 1897 CONECT 1897 1896 CONECT 1898 1891 CONECT 1899 1890 1900 1911 CONECT 1900 1899 1901 1914 CONECT 1901 1900 1902 CONECT 1902 1901 1903 1911 CONECT 1903 1902 1904 1905 CONECT 1904 1903 CONECT 1905 1903 1906 1913 CONECT 1906 1905 1907 1910 CONECT 1907 1906 1908 1909 CONECT 1908 1907 CONECT 1909 1907 CONECT 1910 1906 1911 1912 CONECT 1911 1899 1902 1910 CONECT 1912 1910 CONECT 1913 1905 CONECT 1914 1900 CONECT 1915 1890 CONECT 1916 1888 CONECT 1917 1887 CONECT 1918 1887 MASTER 0 0 0 0 0 0 0 0 1917 1 45 13 END
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Related entries of code: 4q46
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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Complexes with the same small molecule ligand
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Ligand Name
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PDBbind
GDP
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1fzq
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PDBbind
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PDBbind
GDP
2qm7
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PDBbind
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RCSB PDB
PDBbind
GDP
2wib
RCSB PDB
PDBbind
GDP
2wjg
RCSB PDB
PDBbind
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PDBbind
GDP
2y4k
RCSB PDB
PDBbind
GDP
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RCSB PDB
PDBbind
GDP
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RCSB PDB
PDBbind
GDP
3a1t
RCSB PDB
PDBbind
GDP
3bbf
RCSB PDB
PDBbind
GDP
3cph
RCSB PDB
PDBbind
GDP
3cpj
RCSB PDB
PDBbind
GDP
3d7m
RCSB PDB
PDBbind
GDP
3lzz
RCSB PDB
PDBbind
GDP
3okc
RCSB PDB
PDBbind
GDP
3zy2
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PDBbind
GDP
4dcs
RCSB PDB
PDBbind
GDP
4ido
RCSB PDB
PDBbind
GDP
4jyc
RCSB PDB
PDBbind
GDP
4kv9
RCSB PDB
PDBbind
GDP
4lhv
RCSB PDB
PDBbind
GDP
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RCSB PDB
PDBbind
GDP
4lps
RCSB PDB
PDBbind
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PDBbind
GDP
4nxv
RCSB PDB
PDBbind
GDP
4or6
RCSB PDB
PDBbind
GDP
4p4t
RCSB PDB
PDBbind
GDP
4pde
RCSB PDB
PDBbind
GDP
4rcg
RCSB PDB
PDBbind
GDP
4rd0
RCSB PDB
PDBbind
GDP
4rd3
RCSB PDB
PDBbind
GDP
4rd6
RCSB PDB
PDBbind
GDP
5aqk
RCSB PDB
PDBbind
GDP
5goe
RCSB PDB
PDBbind
GDP
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RCSB PDB
PDBbind
GDP
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PDBbind
GDP
5mi3
RCSB PDB
PDBbind
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PDBbind
GDP
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RCSB PDB
PDBbind
GDP
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PDBbind
GDP
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PDBbind
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PDBbind
GDP
5mi9
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PDBbind
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PDBbind
GDP
Entry Information
PDB ID
4q46
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Influenza B PB2 cap-binding domain
Ligand Name
GDP
EC.Number
E.C.-.-.-.-
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
Kd=169uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Biol.Chem. Vol. 290: pp.9144-9149
Ligand Properties
Formula
C
1
0
H
1
8
N
5
O
1
1
P
2
Molecular Weight
446.224
Exact Mass
446.048
No. of atoms
46
No. of bonds
48
Polar Surface Area
287.32
LOGP Value
-4.43 (
Computed with XLOGP3
)
-3.33 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 3
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(O)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1[nH]c(N)[nH+]c2=O
InChI String
InChI=1S/C10H19N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17,19-23,27-28H,1H2,(H3,11,13,14,18)/p+1/t3-,5-,6-,9-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
A0A0J9X1Z6
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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