Browse entries in the PDBbind-CN Database
HEADER 4XG8_COMPLEX COMPND 4XG8_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 15 ASP ARG LYS LEU LEU THR LEU GLU ASP LYS GLU LEU GLY SEQRES 2 A 15 SER GLY SEQRES 1 A 10 GLY THR VAL LYS LYS GLY TYR TYR GLN MET SEQRES 1 A 10 VAL VAL LYS THR VAL ALA VAL LYS ILE LEU SEQRES 1 A 122 ASP PRO ALA LEU LYS ASP GLU LEU LEU ALA GLU ALA ASN SEQRES 2 A 122 VAL MET GLN GLN LEU ASP ASN PRO TYR ILE VAL ARG MET SEQRES 3 A 122 ILE GLY ILE CYS GLU ALA GLU SER TRP MET LEU VAL MET SEQRES 4 A 122 GLU MET ALA GLU LEU GLY PRO LEU ASN LYS TYR LEU GLN SEQRES 5 A 122 GLN ASN ARG HIS VAL LYS ASP LYS ASN ILE ILE GLU LEU SEQRES 6 A 122 VAL HIS GLN VAL SER MET GLY MET LYS TYR LEU GLU GLU SEQRES 7 A 122 SER ASN PHE VAL HIS ARG ASP LEU ALA ALA ARG ASN VAL SEQRES 8 A 122 LEU LEU VAL THR GLN HIS TYR ALA LYS ILE SER ASP PHE SEQRES 9 A 122 GLY LEU SER LYS ALA LEU ARG ALA ASP GLU ASN TYR TYR SEQRES 10 A 122 LYS ALA GLN THR HIS SEQRES 1 A 101 PRO VAL LYS TRP TYR ALA PRO GLU CYS ILE ASN TYR TYR SEQRES 2 A 101 LYS PHE SER SER LYS SER ASP VAL TRP SER PHE GLY VAL SEQRES 3 A 101 LEU MET TRP GLU ALA PHE SER TYR GLY GLN LYS PRO TYR SEQRES 4 A 101 ARG GLY MET LYS GLY SER GLU VAL THR ALA MET LEU GLU SEQRES 5 A 101 LYS GLY GLU ARG MET GLY CYS PRO ALA GLY CYS PRO ARG SEQRES 6 A 101 GLU MET TYR ASP LEU MET ASN LEU CYS TRP THR TYR ASP SEQRES 7 A 101 VAL GLU ASN ARG PRO GLY PHE ALA ALA VAL GLU LEU ARG SEQRES 8 A 101 LEU ARG ASN TYR TYR TYR ASP VAL VAL ASN HET X A 8G 52 ATOM 1 N ASP A 366 -18.677 -11.911 -9.018 1.00 78.89 N ATOM 2 CA ASP A 366 -18.714 -12.565 -10.361 1.00 75.35 C ATOM 3 C ASP A 366 -17.304 -12.669 -10.929 1.00 72.90 C ATOM 4 O ASP A 366 -16.785 -11.682 -11.468 1.00 72.78 O ATOM 5 CB ASP A 366 -19.615 -11.776 -11.315 1.00 76.90 C ATOM 6 CG ASP A 366 -19.517 -12.262 -12.728 1.00 80.17 C ATOM 7 OD1 ASP A 366 -20.080 -13.343 -13.015 1.00 81.22 O ATOM 8 OD2 ASP A 366 -18.859 -11.568 -13.535 1.00 77.73 O ATOM 9 HN3 ASP A 366 -18.273 -10.957 -9.109 1.00 0.00 H ATOM 10 HN2 ASP A 366 -18.089 -12.478 -8.374 1.00 0.00 H ATOM 11 HN1 ASP A 366 -19.643 -11.845 -8.639 1.00 0.00 H ATOM 12 N ARG A 367 -16.717 -13.868 -10.840 1.00 70.78 N ATOM 13 CA ARG A 367 -15.260 -14.069 -11.013 1.00 74.19 C ATOM 14 C ARG A 367 -14.623 -13.481 -12.285 1.00 73.06 C ATOM 15 O ARG A 367 -13.554 -12.870 -12.218 1.00 63.98 O ATOM 16 CB ARG A 367 -14.913 -15.559 -10.930 1.00 78.18 C ATOM 17 CG ARG A 367 -13.442 -15.876 -11.174 1.00 82.32 C ATOM 18 CD ARG A 367 -12.546 -15.264 -10.115 1.00 89.68 C ATOM 19 NE ARG A 367 -11.145 -15.655 -10.268 1.00 98.17 N ATOM 20 CZ ARG A 367 -10.294 -15.155 -11.172 1.00 96.97 C ATOM 21 NH1 ARG A 367 -10.678 -14.229 -12.059 1.00 91.94 N ATOM 22 NH2 ARG A 367 -9.035 -15.594 -11.191 1.00 96.77 N ATOM 23 HE ARG A 367 -10.780 -16.382 -9.620 1.00 0.00 H ATOM 24 HH12 ARG A 367 -9.996 -13.857 -12.751 1.00 0.00 H ATOM 25 HH11 ARG A 367 -11.658 -13.881 -12.056 1.00 0.00 H ATOM 26 HH22 ARG A 367 -8.362 -15.215 -11.888 1.00 0.00 H ATOM 27 HH21 ARG A 367 -8.726 -16.316 -10.509 1.00 0.00 H ATOM 28 H ARG A 367 -17.312 -14.697 -10.640 1.00 0.00 H ATOM 29 N LYS A 368 -15.268 -13.688 -13.434 1.00 77.47 N ATOM 30 CA LYS A 368 -14.769 -13.150 -14.716 1.00 76.49 C ATOM 31 C LYS A 368 -14.656 -11.609 -14.759 1.00 78.20 C ATOM 32 O LYS A 368 -13.930 -11.065 -15.603 1.00 77.28 O ATOM 33 CB LYS A 368 -15.587 -13.677 -15.910 1.00 75.58 C ATOM 34 CG LYS A 368 -17.061 -13.289 -15.949 1.00 75.53 C ATOM 35 CD LYS A 368 -17.663 -13.465 -17.342 1.00 77.65 C ATOM 36 CE LYS A 368 -17.743 -14.920 -17.795 1.00 77.83 C ATOM 37 NZ LYS A 368 -18.578 -15.770 -16.895 1.00 79.98 N ATOM 38 HZ1 LYS A 368 -18.173 -15.760 -15.937 1.00 0.00 H ATOM 39 HZ2 LYS A 368 -19.548 -15.395 -16.867 1.00 0.00 H ATOM 40 HZ3 LYS A 368 -18.593 -16.745 -17.256 1.00 0.00 H ATOM 41 H LYS A 368 -16.147 -14.244 -13.427 1.00 0.00 H ATOM 42 N LEU A 369 -15.356 -10.920 -13.846 1.00 76.97 N ATOM 43 CA LEU A 369 -15.133 -9.488 -13.595 1.00 69.40 C ATOM 44 C LEU A 369 -14.098 -9.211 -12.496 1.00 64.20 C ATOM 45 O LEU A 369 -14.207 -8.223 -11.765 1.00 57.46 O ATOM 46 CB LEU A 369 -16.460 -8.804 -13.270 1.00 69.21 C ATOM 47 CG LEU A 369 -17.486 -8.820 -14.404 1.00 64.52 C ATOM 48 CD1 LEU A 369 -18.673 -7.978 -13.964 1.00 61.74 C ATOM 49 CD2 LEU A 369 -16.920 -8.328 -15.733 1.00 64.23 C ATOM 50 H LEU A 369 -16.084 -11.417 -13.294 1.00 0.00 H ATOM 51 N LEU A 370 -13.098 -10.089 -12.407 1.00 60.49 N ATOM 52 CA LEU A 370 -11.918 -9.889 -11.589 1.00 63.31 C ATOM 53 C LEU A 370 -10.733 -10.429 -12.352 1.00 59.68 C ATOM 54 O LEU A 370 -10.814 -11.533 -12.879 1.00 59.80 O ATOM 55 CB LEU A 370 -12.035 -10.678 -10.288 1.00 65.15 C ATOM 56 CG LEU A 370 -10.831 -10.613 -9.336 1.00 63.86 C ATOM 57 CD1 LEU A 370 -10.954 -9.410 -8.410 1.00 61.71 C ATOM 58 CD2 LEU A 370 -10.711 -11.908 -8.546 1.00 63.87 C ATOM 59 H LEU A 370 -13.169 -10.969 -12.957 1.00 0.00 H ATOM 60 N THR A 371 -9.632 -9.687 -12.366 1.00 56.90 N ATOM 61 CA THR A 371 -8.394 -10.152 -12.998 1.00 60.22 C ATOM 62 C THR A 371 -7.255 -10.153 -11.988 1.00 58.10 C ATOM 63 O THR A 371 -7.220 -9.293 -11.126 1.00 54.49 O ATOM 64 CB THR A 371 -8.042 -9.284 -14.222 1.00 60.58 C ATOM 65 OG1 THR A 371 -9.249 -8.906 -14.895 1.00 57.96 O ATOM 66 CG2 THR A 371 -7.145 -10.068 -15.195 1.00 62.94 C ATOM 67 HG1 THR A 371 -9.026 -8.348 -15.682 1.00 0.00 H ATOM 68 H THR A 371 -9.649 -8.750 -11.916 1.00 0.00 H ATOM 69 N LEU A 372 -6.343 -11.125 -12.093 1.00 61.76 N ATOM 70 CA LEU A 372 -5.244 -11.299 -11.118 1.00 67.96 C ATOM 71 C LEU A 372 -3.857 -11.354 -11.725 1.00 72.17 C ATOM 72 O LEU A 372 -3.696 -11.714 -12.885 1.00 79.49 O ATOM 73 CB LEU A 372 -5.435 -12.594 -10.324 1.00 69.75 C ATOM 74 CG LEU A 372 -6.694 -12.704 -9.474 1.00 75.70 C ATOM 75 CD1 LEU A 372 -6.850 -14.085 -8.841 1.00 74.07 C ATOM 76 CD2 LEU A 372 -6.657 -11.631 -8.406 1.00 80.35 C ATOM 77 H LEU A 372 -6.409 -11.786 -12.893 1.00 0.00 H ATOM 78 N GLU A 373 -2.854 -11.027 -10.911 1.00 76.62 N ATOM 79 CA GLU A 373 -1.452 -11.194 -11.299 1.00 78.07 C ATOM 80 C GLU A 373 -1.042 -12.645 -11.150 1.00 85.25 C ATOM 81 O GLU A 373 -1.586 -13.384 -10.325 1.00 88.64 O ATOM 82 CB GLU A 373 -0.515 -10.310 -10.455 1.00 77.93 C ATOM 83 CG GLU A 373 -0.900 -8.832 -10.389 1.00 76.28 C ATOM 84 CD GLU A 373 -1.447 -8.314 -11.706 1.00 74.25 C ATOM 85 OE1 GLU A 373 -2.689 -8.374 -11.905 1.00 68.69 O ATOM 86 OE2 GLU A 373 -0.626 -7.901 -12.550 1.00 70.85 O ATOM 87 H GLU A 373 -3.074 -10.641 -9.971 1.00 0.00 H ATOM 88 N ASP A 374 -0.090 -13.052 -11.978 1.00 93.78 N ATOM 89 CA ASP A 374 0.589 -14.333 -11.796 1.00 99.60 C ATOM 90 C ASP A 374 1.316 -14.367 -10.438 1.00 98.82 C ATOM 91 O ASP A 374 1.226 -15.360 -9.717 1.00 98.71 O ATOM 92 CB ASP A 374 1.559 -14.622 -12.964 1.00 97.34 C ATOM 93 CG ASP A 374 2.636 -13.546 -13.132 1.00 96.67 C ATOM 94 OD1 ASP A 374 2.397 -12.382 -12.735 1.00 86.55 O ATOM 95 OD2 ASP A 374 3.720 -13.869 -13.664 1.00 97.89 O ATOM 96 H ASP A 374 0.180 -12.444 -12.777 1.00 0.00 H ATOM 97 N LYS A 375 1.987 -13.267 -10.084 1.00 97.29 N ATOM 98 CA LYS A 375 2.824 -13.204 -8.882 1.00 98.00 C ATOM 99 C LYS A 375 2.052 -12.744 -7.647 1.00105.01 C ATOM 100 O LYS A 375 0.942 -12.194 -7.739 1.00110.82 O ATOM 101 CB LYS A 375 4.054 -12.314 -9.118 1.00 95.09 C ATOM 102 CG LYS A 375 3.864 -10.818 -8.875 1.00 90.90 C ATOM 103 CD LYS A 375 4.827 -9.970 -9.701 1.00 88.40 C ATOM 104 CE LYS A 375 6.300 -10.246 -9.401 1.00 85.72 C ATOM 105 NZ LYS A 375 6.738 -9.706 -8.085 1.00 79.01 N ATOM 106 HZ1 LYS A 375 6.601 -8.675 -8.072 1.00 0.00 H ATOM 107 HZ2 LYS A 375 6.174 -10.142 -7.328 1.00 0.00 H ATOM 108 HZ3 LYS A 375 7.744 -9.925 -7.939 1.00 0.00 H ATOM 109 H LYS A 375 1.913 -12.422 -10.685 1.00 0.00 H ATOM 110 N GLU A 376 2.686 -12.960 -6.499 1.00104.12 N ATOM 111 CA GLU A 376 2.066 -12.806 -5.195 1.00101.19 C ATOM 112 C GLU A 376 2.693 -11.640 -4.459 1.00 97.61 C ATOM 113 O GLU A 376 3.925 -11.569 -4.357 1.00 93.89 O ATOM 114 CB GLU A 376 2.288 -14.077 -4.382 1.00104.12 C ATOM 115 CG GLU A 376 1.790 -15.340 -5.070 1.00108.27 C ATOM 116 CD GLU A 376 2.283 -16.617 -4.423 1.00109.70 C ATOM 117 OE1 GLU A 376 2.756 -16.572 -3.266 1.00108.93 O ATOM 118 OE2 GLU A 376 2.176 -17.677 -5.071 1.00112.61 O ATOM 119 H GLU A 376 3.682 -13.256 -6.537 1.00 0.00 H ATOM 120 N LEU A 377 1.844 -10.736 -3.960 1.00 88.15 N ATOM 121 CA LEU A 377 2.261 -9.670 -3.046 1.00 80.14 C ATOM 122 C LEU A 377 3.080 -10.227 -1.876 1.00 81.63 C ATOM 123 O LEU A 377 4.201 -9.788 -1.616 1.00 83.55 O ATOM 124 CB LEU A 377 1.028 -8.944 -2.497 1.00 78.82 C ATOM 125 CG LEU A 377 0.317 -7.982 -3.459 1.00 72.36 C ATOM 126 CD1 LEU A 377 -1.165 -7.879 -3.142 1.00 70.80 C ATOM 127 CD2 LEU A 377 0.965 -6.607 -3.417 1.00 73.29 C ATOM 128 H LEU A 377 0.842 -10.792 -4.233 1.00 0.00 H ATOM 129 N GLY A 378 2.493 -11.197 -1.183 1.00 82.15 N ATOM 130 CA GLY A 378 3.158 -11.920 -0.101 1.00 82.86 C ATOM 131 C GLY A 378 2.624 -13.338 -0.014 1.00 85.73 C ATOM 132 O GLY A 378 1.855 -13.772 -0.881 1.00 84.63 O ATOM 133 H GLY A 378 1.514 -11.454 -1.422 1.00 0.00 H ATOM 134 N SER A 379 3.027 -14.061 1.031 1.00 86.23 N ATOM 135 CA SER A 379 2.595 -15.447 1.211 1.00 89.03 C ATOM 136 C SER A 379 2.689 -15.936 2.659 1.00 89.56 C ATOM 137 O SER A 379 3.155 -15.222 3.559 1.00 87.04 O ATOM 138 CB SER A 379 3.394 -16.372 0.273 1.00 90.42 C ATOM 139 OG SER A 379 4.775 -16.373 0.589 1.00 92.58 O ATOM 140 HG SER A 379 5.254 -16.976 -0.033 1.00 0.00 H ATOM 141 H SER A 379 3.662 -13.631 1.733 1.00 0.00 H ATOM 142 N GLY A 380 2.202 -17.157 2.860 1.00 90.19 N ATOM 143 CA GLY A 380 2.299 -17.863 4.136 1.00 87.75 C ATOM 144 C GLY A 380 1.480 -19.142 4.104 1.00 79.35 C ATOM 145 O GLY A 380 0.965 -19.524 3.053 1.00 74.03 O ATOM 146 H GLY A 380 1.727 -17.635 2.068 1.00 0.00 H TER 147 GLY A 380 ATOM 148 N GLY A 383 -1.885 -19.215 2.633 1.00 80.11 N ATOM 149 CA GLY A 383 -1.900 -19.257 1.173 1.00 82.44 C ATOM 150 C GLY A 383 -1.200 -18.061 0.549 1.00 80.31 C ATOM 151 O GLY A 383 -0.106 -17.686 0.982 1.00 82.08 O ATOM 152 HN3 GLY A 383 -2.369 -18.354 2.959 1.00 0.00 H ATOM 153 HN2 GLY A 383 -0.901 -19.209 2.968 1.00 0.00 H ATOM 154 HN1 GLY A 383 -2.375 -20.052 3.008 1.00 0.00 H ATOM 155 N THR A 384 -1.841 -17.460 -0.455 1.00 76.79 N ATOM 156 CA THR A 384 -1.279 -16.325 -1.182 1.00 76.44 C ATOM 157 C THR A 384 -2.197 -15.091 -1.125 1.00 78.36 C ATOM 158 O THR A 384 -3.420 -15.197 -0.971 1.00 76.05 O ATOM 159 CB THR A 384 -0.979 -16.696 -2.650 1.00 73.74 C ATOM 160 OG1 THR A 384 -2.204 -16.879 -3.364 1.00 73.49 O ATOM 161 CG2 THR A 384 -0.146 -17.985 -2.723 1.00 75.94 C ATOM 162 HG1 THR A 384 -2.004 -17.117 -4.304 1.00 0.00 H ATOM 163 H THR A 384 -2.779 -17.814 -0.731 1.00 0.00 H ATOM 164 N VAL A 385 -1.567 -13.923 -1.240 1.00 79.20 N ATOM 165 CA VAL A 385 -2.251 -12.636 -1.332 1.00 74.43 C ATOM 166 C VAL A 385 -1.850 -11.985 -2.650 1.00 70.42 C ATOM 167 O VAL A 385 -0.646 -11.894 -2.968 1.00 64.63 O ATOM 168 CB VAL A 385 -1.837 -11.705 -0.190 1.00 77.16 C ATOM 169 CG1 VAL A 385 -2.642 -10.402 -0.244 1.00 74.84 C ATOM 170 CG2 VAL A 385 -2.001 -12.416 1.152 1.00 81.18 C ATOM 171 H VAL A 385 -0.527 -13.928 -1.266 1.00 0.00 H ATOM 172 N LYS A 386 -2.859 -11.534 -3.400 1.00 64.34 N ATOM 173 CA LYS A 386 -2.661 -11.056 -4.761 1.00 63.48 C ATOM 174 C LYS A 386 -3.466 -9.803 -5.082 1.00 62.48 C ATOM 175 O LYS A 386 -4.614 -9.634 -4.657 1.00 60.04 O ATOM 176 CB LYS A 386 -2.984 -12.155 -5.779 1.00 64.01 C ATOM 177 CG LYS A 386 -1.986 -13.295 -5.760 1.00 65.21 C ATOM 178 CD LYS A 386 -2.322 -14.397 -6.754 1.00 70.61 C ATOM 179 CE LYS A 386 -1.303 -15.534 -6.664 1.00 67.79 C ATOM 180 NZ LYS A 386 -1.581 -16.679 -7.566 1.00 68.25 N ATOM 181 HZ1 LYS A 386 -2.510 -17.084 -7.333 1.00 0.00 H ATOM 182 HZ2 LYS A 386 -1.582 -16.349 -8.552 1.00 0.00 H ATOM 183 HZ3 LYS A 386 -0.845 -17.403 -7.442 1.00 0.00 H ATOM 184 H LYS A 386 -3.818 -11.524 -2.998 1.00 0.00 H ATOM 185 N LYS A 387 -2.803 -8.935 -5.838 1.00 58.40 N ATOM 186 CA LYS A 387 -3.384 -7.758 -6.434 1.00 55.07 C ATOM 187 C LYS A 387 -4.263 -8.135 -7.618 1.00 56.02 C ATOM 188 O LYS A 387 -3.881 -8.959 -8.471 1.00 52.20 O ATOM 189 CB LYS A 387 -2.251 -6.884 -6.952 1.00 57.61 C ATOM 190 CG LYS A 387 -2.676 -5.587 -7.592 1.00 59.74 C ATOM 191 CD LYS A 387 -1.456 -4.828 -8.052 1.00 61.77 C ATOM 192 CE LYS A 387 -1.835 -3.400 -8.375 1.00 63.47 C ATOM 193 NZ LYS A 387 -0.662 -2.695 -8.935 1.00 62.93 N ATOM 194 HZ1 LYS A 387 0.110 -2.701 -8.238 1.00 0.00 H ATOM 195 HZ2 LYS A 387 -0.351 -3.177 -9.802 1.00 0.00 H ATOM 196 HZ3 LYS A 387 -0.923 -1.713 -9.157 1.00 0.00 H ATOM 197 H LYS A 387 -1.794 -9.117 -6.012 1.00 0.00 H ATOM 198 N GLY A 388 -5.420 -7.496 -7.692 1.00 51.85 N ATOM 199 CA GLY A 388 -6.297 -7.651 -8.821 1.00 50.38 C ATOM 200 C GLY A 388 -7.071 -6.390 -9.106 1.00 55.41 C ATOM 201 O GLY A 388 -6.935 -5.389 -8.408 1.00 60.42 O ATOM 202 H GLY A 388 -5.702 -6.866 -6.914 1.00 0.00 H ATOM 203 N TYR A 389 -7.883 -6.448 -10.152 1.00 56.43 N ATOM 204 CA TYR A 389 -8.706 -5.330 -10.572 1.00 58.24 C ATOM 205 C TYR A 389 -10.108 -5.917 -10.656 1.00 59.53 C ATOM 206 O TYR A 389 -10.292 -7.013 -11.226 1.00 53.06 O ATOM 207 CB TYR A 389 -8.211 -4.764 -11.929 1.00 56.50 C ATOM 208 CG TYR A 389 -6.702 -4.618 -11.977 1.00 57.13 C ATOM 209 CD1 TYR A 389 -5.890 -5.717 -12.312 1.00 56.85 C ATOM 210 CD2 TYR A 389 -6.067 -3.414 -11.621 1.00 56.97 C ATOM 211 CE1 TYR A 389 -4.506 -5.625 -12.317 1.00 55.87 C ATOM 212 CE2 TYR A 389 -4.669 -3.314 -11.625 1.00 56.33 C ATOM 213 CZ TYR A 389 -3.896 -4.430 -11.977 1.00 62.10 C ATOM 214 OH TYR A 389 -2.514 -4.405 -12.013 1.00 67.98 O ATOM 215 HH TYR A 389 -2.176 -5.295 -12.285 1.00 0.00 H ATOM 216 H TYR A 389 -7.932 -7.334 -10.695 1.00 0.00 H ATOM 217 N TYR A 390 -11.070 -5.228 -10.041 1.00 55.85 N ATOM 218 CA TYR A 390 -12.469 -5.622 -10.124 1.00 63.29 C ATOM 219 C TYR A 390 -13.256 -4.560 -10.886 1.00 68.16 C ATOM 220 O TYR A 390 -13.367 -3.406 -10.434 1.00 61.00 O ATOM 221 CB TYR A 390 -13.072 -5.865 -8.733 1.00 64.57 C ATOM 222 CG TYR A 390 -14.418 -6.584 -8.777 1.00 66.34 C ATOM 223 CD1 TYR A 390 -14.478 -7.962 -9.005 1.00 67.28 C ATOM 224 CD2 TYR A 390 -15.630 -5.888 -8.600 1.00 60.09 C ATOM 225 CE1 TYR A 390 -15.699 -8.628 -9.063 1.00 70.09 C ATOM 226 CE2 TYR A 390 -16.859 -6.547 -8.648 1.00 57.97 C ATOM 227 CZ TYR A 390 -16.892 -7.917 -8.880 1.00 65.83 C ATOM 228 OH TYR A 390 -18.088 -8.614 -8.933 1.00 68.25 O ATOM 229 HH TYR A 390 -17.903 -9.571 -9.107 1.00 0.00 H ATOM 230 H TYR A 390 -10.814 -4.386 -9.487 1.00 0.00 H ATOM 231 N GLN A 391 -13.776 -4.961 -12.054 1.00 76.73 N ATOM 232 CA GLN A 391 -14.667 -4.122 -12.858 1.00 83.53 C ATOM 233 C GLN A 391 -15.977 -3.983 -12.094 1.00 79.13 C ATOM 234 O GLN A 391 -16.647 -4.980 -11.811 1.00 72.73 O ATOM 235 CB GLN A 391 -14.896 -4.711 -14.269 1.00 91.70 C ATOM 236 CG GLN A 391 -15.660 -3.788 -15.227 1.00 99.58 C ATOM 237 CD GLN A 391 -15.717 -4.298 -16.666 1.00111.53 C ATOM 238 OE1 GLN A 391 -15.071 -5.296 -17.023 1.00106.08 O ATOM 239 NE2 GLN A 391 -16.499 -3.607 -17.505 1.00111.81 N ATOM 240 HE22 GLN A 391 -17.023 -2.776 -17.163 1.00 0.00 H ATOM 241 HE21 GLN A 391 -16.583 -3.901 -18.499 1.00 0.00 H ATOM 242 H GLN A 391 -13.536 -5.910 -12.405 1.00 0.00 H ATOM 243 N MET A 392 -16.296 -2.739 -11.738 1.00 79.98 N ATOM 244 CA MET A 392 -17.450 -2.409 -10.904 1.00 77.69 C ATOM 245 C MET A 392 -18.661 -2.124 -11.786 1.00 74.60 C ATOM 246 O MET A 392 -19.625 -1.483 -11.355 1.00 73.36 O ATOM 247 CB MET A 392 -17.125 -1.190 -10.017 1.00 77.74 C ATOM 248 CG MET A 392 -16.084 -1.455 -8.936 1.00 76.87 C ATOM 249 SD MET A 392 -16.763 -2.321 -7.503 1.00 77.02 S ATOM 250 CE MET A 392 -17.201 -0.944 -6.431 1.00 70.71 C ATOM 251 H MET A 392 -15.691 -1.961 -12.072 1.00 0.00 H TER 252 MET A 392 ATOM 253 N VAL A 395 -15.880 2.029 -14.363 1.00 77.53 N ATOM 254 CA VAL A 395 -14.552 2.244 -13.768 1.00 78.12 C ATOM 255 C VAL A 395 -14.105 1.029 -12.961 1.00 76.75 C ATOM 256 O VAL A 395 -14.767 0.653 -12.005 1.00 76.49 O ATOM 257 CB VAL A 395 -14.525 3.489 -12.848 1.00 72.81 C ATOM 258 CG1 VAL A 395 -13.212 3.600 -12.087 1.00 76.08 C ATOM 259 CG2 VAL A 395 -14.737 4.749 -13.662 1.00 73.25 C ATOM 260 HN3 VAL A 395 -16.574 1.859 -13.607 1.00 0.00 H ATOM 261 HN2 VAL A 395 -15.846 1.204 -14.996 1.00 0.00 H ATOM 262 HN1 VAL A 395 -16.156 2.872 -14.905 1.00 0.00 H ATOM 263 N VAL A 396 -12.984 0.429 -13.356 1.00 78.87 N ATOM 264 CA VAL A 396 -12.327 -0.597 -12.538 1.00 81.94 C ATOM 265 C VAL A 396 -11.789 0.018 -11.242 1.00 78.05 C ATOM 266 O VAL A 396 -11.375 1.180 -11.218 1.00 75.59 O ATOM 267 CB VAL A 396 -11.174 -1.327 -13.276 1.00 83.57 C ATOM 268 CG1 VAL A 396 -11.716 -2.130 -14.443 1.00 86.41 C ATOM 269 CG2 VAL A 396 -10.095 -0.361 -13.750 1.00 87.26 C ATOM 270 H VAL A 396 -12.563 0.695 -14.269 1.00 0.00 H ATOM 271 N LYS A 397 -11.838 -0.762 -10.169 1.00 69.28 N ATOM 272 CA LYS A 397 -11.180 -0.415 -8.924 1.00 61.84 C ATOM 273 C LYS A 397 -10.069 -1.421 -8.703 1.00 55.84 C ATOM 274 O LYS A 397 -10.227 -2.583 -9.048 1.00 52.90 O ATOM 275 CB LYS A 397 -12.177 -0.456 -7.779 1.00 59.51 C ATOM 276 CG LYS A 397 -11.601 0.003 -6.450 1.00 59.12 C ATOM 277 CD LYS A 397 -12.492 1.045 -5.794 1.00 59.23 C ATOM 278 CE LYS A 397 -12.053 1.316 -4.376 1.00 56.62 C ATOM 279 NZ LYS A 397 -10.636 1.743 -4.301 1.00 56.59 N ATOM 280 HZ1 LYS A 397 -10.028 0.994 -4.691 1.00 0.00 H ATOM 281 HZ2 LYS A 397 -10.509 2.616 -4.852 1.00 0.00 H ATOM 282 HZ3 LYS A 397 -10.380 1.918 -3.308 1.00 0.00 H ATOM 283 H LYS A 397 -12.368 -1.655 -10.223 1.00 0.00 H ATOM 284 N THR A 398 -8.943 -0.970 -8.150 1.00 54.13 N ATOM 285 CA THR A 398 -7.847 -1.881 -7.801 1.00 56.52 C ATOM 286 C THR A 398 -8.221 -2.533 -6.481 1.00 55.45 C ATOM 287 O THR A 398 -8.850 -1.898 -5.634 1.00 58.52 O ATOM 288 CB THR A 398 -6.466 -1.190 -7.682 1.00 56.96 C ATOM 289 OG1 THR A 398 -6.227 -0.363 -8.831 1.00 61.22 O ATOM 290 CG2 THR A 398 -5.331 -2.239 -7.588 1.00 57.24 C ATOM 291 HG1 THR A 398 -5.342 0.073 -8.744 1.00 0.00 H ATOM 292 H THR A 398 -8.839 0.048 -7.962 1.00 0.00 H ATOM 293 N VAL A 399 -7.861 -3.806 -6.333 1.00 56.79 N ATOM 294 CA VAL A 399 -8.302 -4.626 -5.214 1.00 58.87 C ATOM 295 C VAL A 399 -7.261 -5.674 -4.834 1.00 61.68 C ATOM 296 O VAL A 399 -6.354 -6.000 -5.604 1.00 67.04 O ATOM 297 CB VAL A 399 -9.645 -5.304 -5.520 1.00 63.61 C ATOM 298 CG1 VAL A 399 -10.787 -4.280 -5.515 1.00 62.83 C ATOM 299 CG2 VAL A 399 -9.581 -6.067 -6.844 1.00 64.26 C ATOM 300 H VAL A 399 -7.238 -4.233 -7.048 1.00 0.00 H ATOM 301 N ALA A 400 -7.393 -6.171 -3.616 1.00 65.08 N ATOM 302 CA ALA A 400 -6.499 -7.181 -3.078 1.00 66.01 C ATOM 303 C ALA A 400 -7.379 -8.362 -2.791 1.00 68.27 C ATOM 304 O ALA A 400 -8.484 -8.185 -2.261 1.00 70.78 O ATOM 305 CB ALA A 400 -5.841 -6.689 -1.803 1.00 62.20 C ATOM 306 H ALA A 400 -8.170 -5.824 -3.018 1.00 0.00 H ATOM 307 N VAL A 401 -6.914 -9.548 -3.171 1.00 67.56 N ATOM 308 CA VAL A 401 -7.649 -10.781 -2.901 1.00 67.10 C ATOM 309 C VAL A 401 -6.756 -11.693 -2.077 1.00 63.76 C ATOM 310 O VAL A 401 -5.573 -11.854 -2.379 1.00 60.52 O ATOM 311 CB VAL A 401 -8.189 -11.494 -4.172 1.00 68.99 C ATOM 312 CG1 VAL A 401 -7.450 -11.062 -5.417 1.00 70.26 C ATOM 313 CG2 VAL A 401 -8.158 -13.013 -4.039 1.00 67.35 C ATOM 314 H VAL A 401 -6.005 -9.599 -3.673 1.00 0.00 H ATOM 315 N LYS A 402 -7.337 -12.267 -1.028 1.00 62.01 N ATOM 316 CA LYS A 402 -6.692 -13.315 -0.246 1.00 59.30 C ATOM 317 C LYS A 402 -7.149 -14.670 -0.785 1.00 56.08 C ATOM 318 O LYS A 402 -8.346 -14.999 -0.728 1.00 45.27 O ATOM 319 CB LYS A 402 -7.085 -13.188 1.221 1.00 65.51 C ATOM 320 CG LYS A 402 -6.409 -14.188 2.142 1.00 67.57 C ATOM 321 CD LYS A 402 -6.994 -14.135 3.547 1.00 69.05 C ATOM 322 CE LYS A 402 -6.245 -15.071 4.487 1.00 69.47 C ATOM 323 NZ LYS A 402 -4.812 -14.692 4.699 1.00 70.82 N ATOM 324 HZ1 LYS A 402 -4.313 -14.704 3.787 1.00 0.00 H ATOM 325 HZ2 LYS A 402 -4.764 -13.737 5.109 1.00 0.00 H ATOM 326 HZ3 LYS A 402 -4.367 -15.372 5.348 1.00 0.00 H ATOM 327 H LYS A 402 -8.291 -11.956 -0.754 1.00 0.00 H ATOM 328 N ILE A 403 -6.188 -15.447 -1.293 1.00 58.21 N ATOM 329 CA ILE A 403 -6.467 -16.731 -1.954 1.00 59.75 C ATOM 330 C ILE A 403 -6.182 -17.877 -0.994 1.00 56.50 C ATOM 331 O ILE A 403 -5.067 -18.024 -0.486 1.00 58.27 O ATOM 332 CB ILE A 403 -5.648 -16.899 -3.259 1.00 63.13 C ATOM 333 CG1 ILE A 403 -6.003 -15.790 -4.266 1.00 65.30 C ATOM 334 CG2 ILE A 403 -5.891 -18.256 -3.915 1.00 62.13 C ATOM 335 CD1 ILE A 403 -5.074 -14.603 -4.224 1.00 64.61 C ATOM 336 H ILE A 403 -5.200 -15.130 -1.218 1.00 0.00 H ATOM 337 N LEU A 404 -7.200 -18.695 -0.768 1.00 59.21 N ATOM 338 CA LEU A 404 -7.119 -19.812 0.169 1.00 63.31 C ATOM 339 C LEU A 404 -6.349 -20.997 -0.431 1.00 65.29 C ATOM 340 O LEU A 404 -6.599 -21.388 -1.578 1.00 74.27 O ATOM 341 CB LEU A 404 -8.539 -20.238 0.542 1.00 67.86 C ATOM 342 CG LEU A 404 -8.704 -21.050 1.828 1.00 68.82 C ATOM 343 CD1 LEU A 404 -8.985 -20.122 3.008 1.00 70.71 C ATOM 344 CD2 LEU A 404 -9.813 -22.078 1.662 1.00 65.26 C ATOM 345 H LEU A 404 -8.092 -18.535 -1.278 1.00 0.00 H TER 346 LEU A 404 ATOM 347 N ASP A 410 -9.649 -29.787 3.301 1.00 98.80 N ATOM 348 CA ASP A 410 -10.214 -29.556 4.631 1.00101.29 C ATOM 349 C ASP A 410 -11.441 -28.623 4.570 1.00102.98 C ATOM 350 O ASP A 410 -11.339 -27.522 4.022 1.00106.23 O ATOM 351 CB ASP A 410 -9.147 -28.960 5.558 1.00 99.43 C ATOM 352 CG ASP A 410 -9.688 -28.625 6.942 1.00 97.98 C ATOM 353 OD1 ASP A 410 -10.363 -29.486 7.549 1.00 94.69 O ATOM 354 OD2 ASP A 410 -9.445 -27.497 7.417 1.00 90.65 O ATOM 355 HN3 ASP A 410 -9.353 -28.879 2.889 1.00 0.00 H ATOM 356 HN2 ASP A 410 -10.368 -30.227 2.692 1.00 0.00 H ATOM 357 HN1 ASP A 410 -8.826 -30.418 3.380 1.00 0.00 H ATOM 358 N PRO A 411 -12.592 -29.042 5.144 1.00101.65 N ATOM 359 CA PRO A 411 -13.780 -28.179 5.039 1.00100.44 C ATOM 360 C PRO A 411 -13.797 -26.949 5.962 1.00 98.49 C ATOM 361 O PRO A 411 -14.598 -26.043 5.734 1.00101.72 O ATOM 362 CB PRO A 411 -14.944 -29.126 5.400 1.00103.05 C ATOM 363 CG PRO A 411 -14.353 -30.499 5.507 1.00104.23 C ATOM 364 CD PRO A 411 -12.915 -30.291 5.858 1.00102.12 C ATOM 365 N ALA A 412 -12.944 -26.918 6.988 1.00 96.53 N ATOM 366 CA ALA A 412 -12.954 -25.833 7.987 1.00 91.99 C ATOM 367 C ALA A 412 -12.557 -24.451 7.438 1.00 92.36 C ATOM 368 O ALA A 412 -13.115 -23.428 7.852 1.00 85.95 O ATOM 369 CB ALA A 412 -12.065 -26.197 9.172 1.00 88.01 C ATOM 370 H ALA A 412 -12.249 -27.685 7.086 1.00 0.00 H ATOM 371 N LEU A 413 -11.608 -24.420 6.507 1.00 89.37 N ATOM 372 CA LEU A 413 -11.023 -23.151 6.066 1.00 88.02 C ATOM 373 C LEU A 413 -11.987 -22.213 5.328 1.00 85.33 C ATOM 374 O LEU A 413 -11.866 -20.989 5.457 1.00 87.27 O ATOM 375 CB LEU A 413 -9.753 -23.387 5.239 1.00 87.21 C ATOM 376 CG LEU A 413 -8.428 -23.355 6.010 1.00 93.05 C ATOM 377 CD1 LEU A 413 -8.073 -21.925 6.430 1.00 91.93 C ATOM 378 CD2 LEU A 413 -8.418 -24.300 7.208 1.00 88.63 C ATOM 379 H LEU A 413 -11.276 -25.311 6.085 1.00 0.00 H ATOM 380 N LYS A 414 -12.932 -22.767 4.570 1.00 77.79 N ATOM 381 CA LYS A 414 -13.955 -21.942 3.915 1.00 75.82 C ATOM 382 C LYS A 414 -14.674 -21.147 4.983 1.00 74.82 C ATOM 383 O LYS A 414 -14.699 -19.920 4.946 1.00 81.80 O ATOM 384 CB LYS A 414 -14.964 -22.795 3.124 1.00 75.78 C ATOM 385 CG LYS A 414 -16.210 -22.033 2.661 1.00 73.39 C ATOM 386 CD LYS A 414 -17.092 -22.832 1.705 1.00 77.29 C ATOM 387 CE LYS A 414 -18.222 -23.595 2.397 1.00 77.49 C ATOM 388 NZ LYS A 414 -19.204 -24.127 1.410 1.00 73.11 N ATOM 389 HZ1 LYS A 414 -19.618 -23.337 0.875 1.00 0.00 H ATOM 390 HZ2 LYS A 414 -18.720 -24.775 0.756 1.00 0.00 H ATOM 391 HZ3 LYS A 414 -19.957 -24.639 1.913 1.00 0.00 H ATOM 392 H LYS A 414 -12.945 -23.799 4.440 1.00 0.00 H ATOM 393 N ASP A 415 -15.202 -21.881 5.957 1.00 75.22 N ATOM 394 CA ASP A 415 -16.008 -21.337 7.055 1.00 70.20 C ATOM 395 C ASP A 415 -15.316 -20.146 7.717 1.00 68.51 C ATOM 396 O ASP A 415 -15.971 -19.160 8.073 1.00 67.16 O ATOM 397 CB ASP A 415 -16.283 -22.424 8.116 1.00 70.12 C ATOM 398 CG ASP A 415 -16.853 -23.723 7.519 1.00 68.80 C ATOM 399 OD1 ASP A 415 -17.797 -23.651 6.708 1.00 61.65 O ATOM 400 OD2 ASP A 415 -16.349 -24.814 7.858 1.00 68.75 O ATOM 401 H ASP A 415 -15.033 -22.907 5.940 1.00 0.00 H ATOM 402 N GLU A 416 -13.994 -20.257 7.866 1.00 66.70 N ATOM 403 CA GLU A 416 -13.160 -19.208 8.462 1.00 66.12 C ATOM 404 C GLU A 416 -13.083 -17.974 7.569 1.00 67.28 C ATOM 405 O GLU A 416 -13.399 -16.863 8.006 1.00 56.01 O ATOM 406 CB GLU A 416 -11.749 -19.735 8.757 1.00 62.26 C ATOM 407 CG GLU A 416 -11.740 -20.794 9.842 1.00 60.25 C ATOM 408 CD GLU A 416 -10.363 -21.106 10.361 1.00 59.04 C ATOM 409 OE1 GLU A 416 -10.274 -21.564 11.520 1.00 62.69 O ATOM 410 OE2 GLU A 416 -9.383 -20.911 9.613 1.00 57.15 O ATOM 411 H GLU A 416 -13.532 -21.131 7.543 1.00 0.00 H ATOM 412 N LEU A 417 -12.683 -18.184 6.315 1.00 69.02 N ATOM 413 CA LEU A 417 -12.673 -17.116 5.312 1.00 63.77 C ATOM 414 C LEU A 417 -14.045 -16.454 5.228 1.00 59.26 C ATOM 415 O LEU A 417 -14.155 -15.230 5.104 1.00 62.25 O ATOM 416 CB LEU A 417 -12.285 -17.659 3.934 1.00 63.80 C ATOM 417 CG LEU A 417 -11.721 -16.623 2.957 1.00 63.62 C ATOM 418 CD1 LEU A 417 -10.218 -16.520 3.142 1.00 64.56 C ATOM 419 CD2 LEU A 417 -12.043 -16.990 1.513 1.00 67.23 C ATOM 420 H LEU A 417 -12.368 -19.136 6.040 1.00 0.00 H ATOM 421 N LEU A 418 -15.085 -17.272 5.296 1.00 55.54 N ATOM 422 CA LEU A 418 -16.455 -16.781 5.218 1.00 58.91 C ATOM 423 C LEU A 418 -16.866 -15.991 6.454 1.00 57.75 C ATOM 424 O LEU A 418 -17.624 -15.012 6.355 1.00 51.42 O ATOM 425 CB LEU A 418 -17.424 -17.955 5.006 1.00 63.42 C ATOM 426 CG LEU A 418 -17.374 -18.758 3.694 1.00 64.67 C ATOM 427 CD1 LEU A 418 -18.766 -19.257 3.308 1.00 65.01 C ATOM 428 CD2 LEU A 418 -16.785 -17.966 2.534 1.00 67.71 C ATOM 429 H LEU A 418 -14.919 -18.293 5.408 1.00 0.00 H ATOM 430 N ALA A 419 -16.383 -16.434 7.617 1.00 58.69 N ATOM 431 CA ALA A 419 -16.601 -15.712 8.877 1.00 56.56 C ATOM 432 C ALA A 419 -15.750 -14.449 8.917 1.00 55.29 C ATOM 433 O ALA A 419 -16.237 -13.362 9.291 1.00 55.75 O ATOM 434 CB ALA A 419 -16.278 -16.604 10.059 1.00 55.51 C ATOM 435 H ALA A 419 -15.835 -17.318 7.631 1.00 0.00 H ATOM 436 N GLU A 420 -14.485 -14.600 8.522 1.00 51.10 N ATOM 437 CA GLU A 420 -13.562 -13.463 8.320 1.00 51.56 C ATOM 438 C GLU A 420 -14.238 -12.341 7.533 1.00 52.16 C ATOM 439 O GLU A 420 -14.109 -11.177 7.884 1.00 51.35 O ATOM 440 CB GLU A 420 -12.275 -13.931 7.602 1.00 47.56 C ATOM 441 CG GLU A 420 -11.270 -12.852 7.209 1.00 46.63 C ATOM 442 CD GLU A 420 -9.961 -13.429 6.689 1.00 49.70 C ATOM 443 OE1 GLU A 420 -9.903 -14.634 6.351 1.00 51.45 O ATOM 444 OE2 GLU A 420 -8.970 -12.679 6.626 1.00 46.77 O ATOM 445 H GLU A 420 -14.131 -15.562 8.348 1.00 0.00 H ATOM 446 N ALA A 421 -14.965 -12.726 6.486 1.00 55.16 N ATOM 447 CA ALA A 421 -15.677 -11.797 5.605 1.00 58.10 C ATOM 448 C ALA A 421 -16.964 -11.214 6.189 1.00 55.14 C ATOM 449 O ALA A 421 -17.348 -10.091 5.860 1.00 52.64 O ATOM 450 CB ALA A 421 -15.980 -12.498 4.289 1.00 62.28 C ATOM 451 H ALA A 421 -15.031 -13.744 6.282 1.00 0.00 H ATOM 452 N ASN A 422 -17.645 -11.986 7.032 1.00 59.50 N ATOM 453 CA ASN A 422 -18.875 -11.528 7.684 1.00 59.07 C ATOM 454 C ASN A 422 -18.632 -10.340 8.607 1.00 57.92 C ATOM 455 O ASN A 422 -19.456 -9.436 8.672 1.00 57.21 O ATOM 456 CB ASN A 422 -19.525 -12.673 8.471 1.00 63.95 C ATOM 457 CG ASN A 422 -20.900 -12.305 9.031 1.00 65.69 C ATOM 458 OD1 ASN A 422 -21.621 -11.477 8.477 1.00 63.87 O ATOM 459 ND2 ASN A 422 -21.256 -12.915 10.151 1.00 71.37 N ATOM 460 HD22 ASN A 422 -20.619 -13.610 10.590 1.00 0.00 H ATOM 461 HD21 ASN A 422 -22.173 -12.699 10.592 1.00 0.00 H ATOM 462 H ASN A 422 -17.294 -12.944 7.234 1.00 0.00 H ATOM 463 N VAL A 423 -17.491 -10.348 9.303 1.00 55.91 N ATOM 464 CA VAL A 423 -17.129 -9.251 10.196 1.00 48.62 C ATOM 465 C VAL A 423 -16.853 -7.981 9.406 1.00 48.85 C ATOM 466 O VAL A 423 -17.381 -6.918 9.740 1.00 45.97 O ATOM 467 CB VAL A 423 -15.885 -9.581 11.045 1.00 47.73 C ATOM 468 CG1 VAL A 423 -15.476 -8.371 11.887 1.00 50.27 C ATOM 469 CG2 VAL A 423 -16.132 -10.779 11.954 1.00 45.99 C ATOM 470 H VAL A 423 -16.844 -11.157 9.206 1.00 0.00 H ATOM 471 N MET A 424 -16.018 -8.086 8.373 1.00 50.24 N ATOM 472 CA MET A 424 -15.628 -6.901 7.595 1.00 52.83 C ATOM 473 C MET A 424 -16.850 -6.179 7.059 1.00 54.18 C ATOM 474 O MET A 424 -16.951 -4.954 7.158 1.00 58.09 O ATOM 475 CB MET A 424 -14.716 -7.280 6.446 1.00 53.81 C ATOM 476 CG MET A 424 -13.361 -7.796 6.888 1.00 54.82 C ATOM 477 SD MET A 424 -12.205 -8.008 5.516 1.00 56.71 S ATOM 478 CE MET A 424 -11.580 -6.340 5.379 1.00 58.83 C ATOM 479 H MET A 424 -15.637 -9.018 8.114 1.00 0.00 H ATOM 480 N GLN A 425 -17.797 -6.964 6.561 1.00 56.72 N ATOM 481 CA GLN A 425 -19.053 -6.458 6.011 1.00 64.09 C ATOM 482 C GLN A 425 -19.795 -5.522 6.946 1.00 60.39 C ATOM 483 O GLN A 425 -20.406 -4.548 6.508 1.00 62.64 O ATOM 484 CB GLN A 425 -19.959 -7.636 5.715 1.00 68.27 C ATOM 485 CG GLN A 425 -21.266 -7.280 5.034 1.00 71.85 C ATOM 486 CD GLN A 425 -21.972 -8.497 4.452 1.00 73.64 C ATOM 487 OE1 GLN A 425 -22.735 -8.374 3.492 1.00 67.43 O ATOM 488 NE2 GLN A 425 -21.728 -9.683 5.030 1.00 74.23 N ATOM 489 HE22 GLN A 425 -21.077 -9.743 5.839 1.00 0.00 H ATOM 490 HE21 GLN A 425 -22.190 -10.542 4.669 1.00 0.00 H ATOM 491 H GLN A 425 -17.637 -7.992 6.562 1.00 0.00 H ATOM 492 N GLN A 426 -19.724 -5.839 8.231 1.00 56.38 N ATOM 493 CA GLN A 426 -20.428 -5.103 9.253 1.00 55.39 C ATOM 494 C GLN A 426 -19.742 -3.845 9.674 1.00 55.84 C ATOM 495 O GLN A 426 -20.295 -3.110 10.479 1.00 52.65 O ATOM 496 CB GLN A 426 -20.553 -5.956 10.487 1.00 56.74 C ATOM 497 CG GLN A 426 -21.257 -7.267 10.236 1.00 56.14 C ATOM 498 CD GLN A 426 -21.676 -7.877 11.534 1.00 56.22 C ATOM 499 OE1 GLN A 426 -22.241 -7.190 12.395 1.00 62.21 O ATOM 500 NE2 GLN A 426 -21.381 -9.150 11.716 1.00 56.84 N ATOM 501 HE22 GLN A 426 -20.905 -9.686 10.963 1.00 0.00 H ATOM 502 HE21 GLN A 426 -21.624 -9.617 12.613 1.00 0.00 H ATOM 503 H GLN A 426 -19.138 -6.650 8.514 1.00 0.00 H ATOM 504 N LEU A 427 -18.536 -3.605 9.166 1.00 58.55 N ATOM 505 CA LEU A 427 -17.715 -2.507 9.638 1.00 59.33 C ATOM 506 C LEU A 427 -17.625 -1.447 8.583 1.00 55.50 C ATOM 507 O LEU A 427 -17.487 -1.745 7.409 1.00 55.29 O ATOM 508 CB LEU A 427 -16.312 -3.012 9.980 1.00 58.41 C ATOM 509 CG LEU A 427 -16.328 -4.227 10.905 1.00 57.15 C ATOM 510 CD1 LEU A 427 -14.937 -4.832 10.985 1.00 56.51 C ATOM 511 CD2 LEU A 427 -16.844 -3.877 12.284 1.00 55.09 C ATOM 512 H LEU A 427 -18.173 -4.221 8.411 1.00 0.00 H ATOM 513 N ASP A 428 -17.656 -0.205 9.039 1.00 55.68 N ATOM 514 CA ASP A 428 -17.676 0.960 8.184 1.00 55.57 C ATOM 515 C ASP A 428 -16.826 2.043 8.828 1.00 54.57 C ATOM 516 O ASP A 428 -17.295 2.771 9.718 1.00 57.16 O ATOM 517 CB ASP A 428 -19.125 1.425 8.027 1.00 60.08 C ATOM 518 CG ASP A 428 -19.259 2.617 7.132 1.00 64.31 C ATOM 519 OD1 ASP A 428 -18.562 2.638 6.088 1.00 63.66 O ATOM 520 OD2 ASP A 428 -20.059 3.520 7.480 1.00 62.24 O ATOM 521 H ASP A 428 -17.667 -0.059 10.069 1.00 0.00 H ATOM 522 N ASN A 429 -15.560 2.125 8.406 1.00 51.20 N ATOM 523 CA ASN A 429 -14.626 3.075 8.996 1.00 48.73 C ATOM 524 C ASN A 429 -13.507 3.450 8.046 1.00 47.82 C ATOM 525 O ASN A 429 -12.999 2.582 7.344 1.00 46.01 O ATOM 526 CB ASN A 429 -13.993 2.479 10.257 1.00 49.49 C ATOM 527 CG ASN A 429 -13.191 3.504 11.056 1.00 51.27 C ATOM 528 OD1 ASN A 429 -11.978 3.650 10.868 1.00 51.34 O ATOM 529 ND2 ASN A 429 -13.875 4.260 11.906 1.00 48.46 N ATOM 530 HD22 ASN A 429 -14.895 4.105 12.035 1.00 0.00 H ATOM 531 HD21 ASN A 429 -13.391 5.008 12.443 1.00 0.00 H ATOM 532 H ASN A 429 -15.236 1.499 7.642 1.00 0.00 H ATOM 533 N PRO A 430 -13.088 4.739 8.054 1.00 50.19 N ATOM 534 CA PRO A 430 -11.922 5.195 7.256 1.00 51.02 C ATOM 535 C PRO A 430 -10.649 4.378 7.472 1.00 49.87 C ATOM 536 O PRO A 430 -9.903 4.121 6.535 1.00 46.87 O ATOM 537 CB PRO A 430 -11.681 6.628 7.737 1.00 49.55 C ATOM 538 CG PRO A 430 -12.918 7.051 8.453 1.00 49.90 C ATOM 539 CD PRO A 430 -13.801 5.860 8.693 1.00 48.11 C ATOM 540 N TYR A 431 -10.425 3.977 8.714 1.00 53.19 N ATOM 541 CA TYR A 431 -9.188 3.333 9.133 1.00 50.02 C ATOM 542 C TYR A 431 -9.325 1.822 9.314 1.00 48.63 C ATOM 543 O TYR A 431 -8.567 1.210 10.059 1.00 47.25 O ATOM 544 CB TYR A 431 -8.746 3.998 10.409 1.00 51.31 C ATOM 545 CG TYR A 431 -8.764 5.498 10.273 1.00 54.64 C ATOM 546 CD1 TYR A 431 -7.825 6.141 9.485 1.00 55.96 C ATOM 547 CD2 TYR A 431 -9.742 6.275 10.902 1.00 58.90 C ATOM 548 CE1 TYR A 431 -7.830 7.513 9.346 1.00 57.63 C ATOM 549 CE2 TYR A 431 -9.753 7.662 10.771 1.00 55.93 C ATOM 550 CZ TYR A 431 -8.788 8.269 9.988 1.00 55.56 C ATOM 551 OH TYR A 431 -8.748 9.628 9.821 1.00 58.19 O ATOM 552 HH TYR A 431 -7.990 9.865 9.230 1.00 0.00 H ATOM 553 H TYR A 431 -11.169 4.129 9.425 1.00 0.00 H ATOM 554 N ILE A 432 -10.314 1.244 8.634 1.00 47.51 N ATOM 555 CA ILE A 432 -10.487 -0.178 8.510 1.00 47.28 C ATOM 556 C ILE A 432 -10.583 -0.445 7.011 1.00 50.52 C ATOM 557 O ILE A 432 -11.286 0.276 6.303 1.00 54.03 O ATOM 558 CB ILE A 432 -11.806 -0.645 9.155 1.00 47.79 C ATOM 559 CG1 ILE A 432 -11.863 -0.287 10.654 1.00 49.17 C ATOM 560 CG2 ILE A 432 -12.037 -2.134 8.885 1.00 48.79 C ATOM 561 CD1 ILE A 432 -11.686 -1.401 11.650 1.00 50.20 C ATOM 562 H ILE A 432 -11.006 1.861 8.162 1.00 0.00 H ATOM 563 N VAL A 433 -9.906 -1.497 6.555 1.00 49.61 N ATOM 564 CA VAL A 433 -9.962 -1.951 5.173 1.00 50.57 C ATOM 565 C VAL A 433 -11.373 -2.349 4.810 1.00 54.49 C ATOM 566 O VAL A 433 -11.994 -3.120 5.538 1.00 55.52 O ATOM 567 CB VAL A 433 -9.032 -3.167 4.953 1.00 50.12 C ATOM 568 CG1 VAL A 433 -9.371 -3.934 3.671 1.00 50.75 C ATOM 569 CG2 VAL A 433 -7.584 -2.709 4.925 1.00 49.89 C ATOM 570 H VAL A 433 -9.305 -2.022 7.222 1.00 0.00 H ATOM 571 N ARG A 434 -11.867 -1.837 3.681 1.00 58.47 N ATOM 572 CA ARG A 434 -13.217 -2.168 3.205 1.00 57.25 C ATOM 573 C ARG A 434 -13.127 -3.384 2.306 1.00 57.45 C ATOM 574 O ARG A 434 -12.331 -3.417 1.383 1.00 58.05 O ATOM 575 CB ARG A 434 -13.876 -0.991 2.486 1.00 59.51 C ATOM 576 CG ARG A 434 -14.581 -0.056 3.461 1.00 68.61 C ATOM 577 CD ARG A 434 -15.073 1.232 2.821 1.00 69.43 C ATOM 578 NE ARG A 434 -15.861 2.010 3.786 1.00 71.10 N ATOM 579 CZ ARG A 434 -15.403 2.990 4.579 1.00 68.71 C ATOM 580 NH1 ARG A 434 -14.131 3.381 4.545 1.00 67.32 N ATOM 581 NH2 ARG A 434 -16.242 3.599 5.429 1.00 68.12 N ATOM 582 HE ARG A 434 -16.872 1.779 3.862 1.00 0.00 H ATOM 583 HH12 ARG A 434 -13.805 4.144 5.172 1.00 0.00 H ATOM 584 HH11 ARG A 434 -13.464 2.924 3.891 1.00 0.00 H ATOM 585 HH22 ARG A 434 -15.894 4.360 6.047 1.00 0.00 H ATOM 586 HH21 ARG A 434 -17.240 3.311 5.470 1.00 0.00 H ATOM 587 H ARG A 434 -11.280 -1.185 3.122 1.00 0.00 H ATOM 588 N MET A 435 -13.915 -4.405 2.616 1.00 58.43 N ATOM 589 CA MET A 435 -14.049 -5.572 1.738 1.00 61.29 C ATOM 590 C MET A 435 -15.048 -5.241 0.612 1.00 57.08 C ATOM 591 O MET A 435 -15.931 -4.369 0.777 1.00 53.41 O ATOM 592 CB MET A 435 -14.499 -6.813 2.518 1.00 63.18 C ATOM 593 CG MET A 435 -15.920 -6.725 3.065 1.00 70.04 C ATOM 594 SD MET A 435 -16.477 -8.256 3.814 1.00 87.56 S ATOM 595 CE MET A 435 -16.597 -9.335 2.404 1.00 76.54 C ATOM 596 H MET A 435 -14.452 -4.377 3.506 1.00 0.00 H ATOM 597 N ILE A 436 -14.883 -5.917 -0.524 1.00 48.72 N ATOM 598 CA ILE A 436 -15.848 -5.842 -1.631 1.00 47.58 C ATOM 599 C ILE A 436 -16.790 -7.034 -1.547 1.00 53.36 C ATOM 600 O ILE A 436 -18.014 -6.860 -1.539 1.00 53.49 O ATOM 601 CB ILE A 436 -15.131 -5.821 -2.998 1.00 40.10 C ATOM 602 CG1 ILE A 436 -14.118 -4.669 -3.063 1.00 39.68 C ATOM 603 CG2 ILE A 436 -16.102 -5.655 -4.148 1.00 39.42 C ATOM 604 CD1 ILE A 436 -14.702 -3.279 -2.788 1.00 40.46 C ATOM 605 H ILE A 436 -14.042 -6.519 -0.632 1.00 0.00 H ATOM 606 N GLY A 437 -16.206 -8.235 -1.465 1.00 58.87 N ATOM 607 CA GLY A 437 -16.967 -9.473 -1.319 1.00 60.19 C ATOM 608 C GLY A 437 -16.086 -10.710 -1.423 1.00 68.17 C ATOM 609 O GLY A 437 -14.858 -10.632 -1.303 1.00 73.60 O ATOM 610 H GLY A 437 -15.168 -8.289 -1.507 1.00 0.00 H ATOM 611 N ILE A 438 -16.725 -11.853 -1.649 1.00 73.20 N ATOM 612 CA ILE A 438 -16.041 -13.141 -1.708 1.00 77.73 C ATOM 613 C ILE A 438 -16.221 -13.711 -3.106 1.00 79.02 C ATOM 614 O ILE A 438 -17.260 -13.504 -3.746 1.00 69.83 O ATOM 615 CB ILE A 438 -16.610 -14.134 -0.670 1.00 83.54 C ATOM 616 CG1 ILE A 438 -16.741 -13.465 0.711 1.00 87.99 C ATOM 617 CG2 ILE A 438 -15.721 -15.373 -0.551 1.00 85.88 C ATOM 618 CD1 ILE A 438 -17.746 -14.127 1.627 1.00 89.82 C ATOM 619 H ILE A 438 -17.755 -11.829 -1.790 1.00 0.00 H ATOM 620 N CYS A 439 -15.206 -14.429 -3.575 1.00 83.04 N ATOM 621 CA CYS A 439 -15.252 -15.025 -4.902 1.00 83.30 C ATOM 622 C CYS A 439 -15.043 -16.535 -4.891 1.00 79.29 C ATOM 623 O CYS A 439 -13.985 -17.034 -4.499 1.00 73.80 O ATOM 624 CB CYS A 439 -14.233 -14.382 -5.827 1.00 83.50 C ATOM 625 SG CYS A 439 -14.607 -14.784 -7.541 1.00 86.08 S ATOM 626 H CYS A 439 -14.363 -14.568 -2.983 1.00 0.00 H ATOM 627 N GLU A 440 -16.073 -17.240 -5.344 1.00 79.19 N ATOM 628 CA GLU A 440 -16.033 -18.671 -5.524 1.00 80.49 C ATOM 629 C GLU A 440 -15.731 -18.912 -6.988 1.00 74.54 C ATOM 630 O GLU A 440 -16.541 -18.595 -7.854 1.00 68.18 O ATOM 631 CB GLU A 440 -17.379 -19.266 -5.149 1.00 84.91 C ATOM 632 CG GLU A 440 -17.378 -20.777 -4.987 1.00 87.36 C ATOM 633 CD GLU A 440 -18.757 -21.319 -4.636 1.00 88.09 C ATOM 634 OE1 GLU A 440 -19.774 -20.646 -4.945 1.00 84.13 O ATOM 635 OE2 GLU A 440 -18.828 -22.424 -4.049 1.00 82.42 O ATOM 636 H GLU A 440 -16.951 -16.736 -5.581 1.00 0.00 H ATOM 637 N ALA A 441 -14.547 -19.452 -7.241 1.00 75.69 N ATOM 638 CA ALA A 441 -14.026 -19.651 -8.581 1.00 73.51 C ATOM 639 C ALA A 441 -13.046 -20.825 -8.506 1.00 77.62 C ATOM 640 O ALA A 441 -13.287 -21.771 -7.760 1.00 83.59 O ATOM 641 CB ALA A 441 -13.344 -18.380 -9.043 1.00 72.42 C ATOM 642 H ALA A 441 -13.960 -19.749 -6.436 1.00 0.00 H ATOM 643 N GLU A 442 -11.964 -20.775 -9.285 1.00 79.95 N ATOM 644 CA GLU A 442 -10.829 -21.723 -9.192 1.00 78.23 C ATOM 645 C GLU A 442 -10.420 -22.085 -7.757 1.00 81.44 C ATOM 646 O GLU A 442 -10.168 -23.251 -7.460 1.00 84.55 O ATOM 647 CB GLU A 442 -9.599 -21.183 -9.960 1.00 77.24 C ATOM 648 CG GLU A 442 -9.481 -19.653 -10.025 1.00 77.49 C ATOM 649 CD GLU A 442 -8.069 -19.138 -10.186 1.00 76.83 C ATOM 650 OE1 GLU A 442 -7.859 -18.281 -11.065 1.00 76.92 O ATOM 651 OE2 GLU A 442 -7.177 -19.557 -9.419 1.00 77.87 O ATOM 652 H GLU A 442 -11.914 -20.024 -10.002 1.00 0.00 H ATOM 653 N SER A 443 -10.340 -21.070 -6.896 1.00 84.46 N ATOM 654 CA SER A 443 -10.115 -21.224 -5.454 1.00 77.49 C ATOM 655 C SER A 443 -11.099 -20.306 -4.700 1.00 77.41 C ATOM 656 O SER A 443 -11.834 -19.530 -5.324 1.00 70.56 O ATOM 657 CB SER A 443 -8.660 -20.882 -5.111 1.00 75.37 C ATOM 658 OG SER A 443 -7.893 -22.050 -4.911 1.00 73.99 O ATOM 659 HG SER A 443 -6.961 -21.798 -4.692 1.00 0.00 H ATOM 660 H SER A 443 -10.444 -20.106 -7.271 1.00 0.00 H ATOM 661 N TRP A 444 -11.145 -20.428 -3.371 1.00 78.71 N ATOM 662 CA TRP A 444 -11.897 -19.475 -2.536 1.00 77.03 C ATOM 663 C TRP A 444 -11.050 -18.252 -2.287 1.00 72.71 C ATOM 664 O TRP A 444 -9.882 -18.358 -1.898 1.00 73.04 O ATOM 665 CB TRP A 444 -12.297 -20.057 -1.184 1.00 79.23 C ATOM 666 CG TRP A 444 -13.354 -21.085 -1.268 1.00 78.91 C ATOM 667 CD1 TRP A 444 -13.168 -22.438 -1.285 1.00 78.77 C ATOM 668 CD2 TRP A 444 -14.771 -20.866 -1.340 1.00 74.95 C ATOM 669 NE1 TRP A 444 -14.381 -23.077 -1.364 1.00 80.43 N ATOM 670 CE2 TRP A 444 -15.381 -22.138 -1.403 1.00 77.26 C ATOM 671 CE3 TRP A 444 -15.584 -19.720 -1.361 1.00 73.50 C ATOM 672 CZ2 TRP A 444 -16.768 -22.301 -1.491 1.00 78.28 C ATOM 673 CZ3 TRP A 444 -16.968 -19.882 -1.438 1.00 74.97 C ATOM 674 CH2 TRP A 444 -17.544 -21.165 -1.501 1.00 74.98 C ATOM 675 HE1 TRP A 444 -14.520 -24.107 -1.390 1.00 0.00 H ATOM 676 H TRP A 444 -10.639 -21.214 -2.915 1.00 0.00 H ATOM 677 N MET A 445 -11.670 -17.093 -2.477 1.00 73.18 N ATOM 678 CA MET A 445 -10.954 -15.836 -2.623 1.00 73.41 C ATOM 679 C MET A 445 -11.708 -14.711 -1.931 1.00 70.01 C ATOM 680 O MET A 445 -12.946 -14.646 -1.995 1.00 67.50 O ATOM 681 CB MET A 445 -10.803 -15.512 -4.108 1.00 76.47 C ATOM 682 CG MET A 445 -9.876 -16.446 -4.869 1.00 81.04 C ATOM 683 SD MET A 445 -9.920 -16.185 -6.654 1.00 92.84 S ATOM 684 CE MET A 445 -8.652 -17.342 -7.183 1.00 90.87 C ATOM 685 H MET A 445 -12.709 -17.084 -2.523 1.00 0.00 H ATOM 686 N LEU A 446 -10.949 -13.829 -1.282 1.00 66.05 N ATOM 687 CA LEU A 446 -11.502 -12.684 -0.575 1.00 68.69 C ATOM 688 C LEU A 446 -10.965 -11.389 -1.159 1.00 66.39 C ATOM 689 O LEU A 446 -9.759 -11.180 -1.170 1.00 61.50 O ATOM 690 CB LEU A 446 -11.123 -12.747 0.903 1.00 72.88 C ATOM 691 CG LEU A 446 -11.585 -11.554 1.743 1.00 77.76 C ATOM 692 CD1 LEU A 446 -13.107 -11.433 1.766 1.00 74.34 C ATOM 693 CD2 LEU A 446 -11.006 -11.667 3.149 1.00 83.63 C ATOM 694 H LEU A 446 -9.918 -13.965 -1.281 1.00 0.00 H ATOM 695 N VAL A 447 -11.871 -10.493 -1.538 1.00 64.30 N ATOM 696 CA VAL A 447 -11.538 -9.314 -2.316 1.00 65.52 C ATOM 697 C VAL A 447 -11.870 -8.062 -1.535 1.00 62.96 C ATOM 698 O VAL A 447 -13.040 -7.853 -1.199 1.00 64.84 O ATOM 699 CB VAL A 447 -12.334 -9.317 -3.638 1.00 72.60 C ATOM 700 CG1 VAL A 447 -12.104 -8.029 -4.428 1.00 73.33 C ATOM 701 CG2 VAL A 447 -11.941 -10.533 -4.482 1.00 71.06 C ATOM 702 H VAL A 447 -12.863 -10.644 -1.265 1.00 0.00 H ATOM 703 N MET A 448 -10.849 -7.228 -1.287 1.00 62.19 N ATOM 704 CA MET A 448 -10.976 -5.985 -0.496 1.00 60.83 C ATOM 705 C MET A 448 -10.487 -4.732 -1.231 1.00 58.12 C ATOM 706 O MET A 448 -9.730 -4.807 -2.207 1.00 54.83 O ATOM 707 CB MET A 448 -10.179 -6.098 0.810 1.00 61.96 C ATOM 708 CG MET A 448 -10.577 -7.239 1.741 1.00 64.48 C ATOM 709 SD MET A 448 -9.154 -8.036 2.520 1.00 66.33 S ATOM 710 CE MET A 448 -8.392 -8.863 1.131 1.00 67.10 C ATOM 711 H MET A 448 -9.914 -7.470 -1.673 1.00 0.00 H ATOM 712 N GLU A 449 -10.919 -3.574 -0.730 1.00 59.12 N ATOM 713 CA GLU A 449 -10.395 -2.278 -1.164 1.00 58.61 C ATOM 714 C GLU A 449 -8.913 -2.292 -0.834 1.00 59.13 C ATOM 715 O GLU A 449 -8.540 -2.503 0.319 1.00 56.04 O ATOM 716 CB GLU A 449 -11.091 -1.130 -0.440 1.00 65.36 C ATOM 717 CG GLU A 449 -10.767 0.242 -1.011 1.00 71.37 C ATOM 718 CD GLU A 449 -11.103 1.397 -0.085 1.00 73.82 C ATOM 719 OE1 GLU A 449 -11.391 2.490 -0.618 1.00 75.82 O ATOM 720 OE2 GLU A 449 -11.060 1.236 1.158 1.00 76.28 O ATOM 721 H GLU A 449 -11.660 -3.593 -0.000 1.00 0.00 H ATOM 722 N MET A 450 -8.086 -2.080 -1.856 1.00 59.44 N ATOM 723 CA MET A 450 -6.636 -2.358 -1.816 1.00 58.11 C ATOM 724 C MET A 450 -5.815 -1.130 -1.405 1.00 54.66 C ATOM 725 O MET A 450 -6.056 -0.035 -1.870 1.00 49.82 O ATOM 726 CB MET A 450 -6.176 -2.953 -3.166 1.00 56.70 C ATOM 727 CG MET A 450 -4.878 -2.475 -3.794 1.00 54.56 C ATOM 728 SD MET A 450 -3.405 -2.960 -2.911 1.00 57.33 S ATOM 729 CE MET A 450 -2.978 -4.555 -3.619 1.00 52.88 C ATOM 730 H MET A 450 -8.485 -1.695 -2.736 1.00 0.00 H ATOM 731 N ALA A 451 -4.844 -1.369 -0.525 1.00 58.01 N ATOM 732 CA ALA A 451 -3.961 -0.362 0.053 1.00 53.38 C ATOM 733 C ALA A 451 -2.608 -0.622 -0.580 1.00 52.97 C ATOM 734 O ALA A 451 -1.913 -1.576 -0.200 1.00 53.01 O ATOM 735 CB ALA A 451 -3.888 -0.538 1.564 1.00 51.61 C ATOM 736 H ALA A 451 -4.704 -2.355 -0.225 1.00 0.00 H ATOM 737 N GLU A 452 -2.256 0.204 -1.568 1.00 53.71 N ATOM 738 CA GLU A 452 -1.096 -0.055 -2.443 1.00 55.05 C ATOM 739 C GLU A 452 0.182 -0.244 -1.610 1.00 54.06 C ATOM 740 O GLU A 452 0.962 -1.184 -1.835 1.00 49.22 O ATOM 741 CB GLU A 452 -0.873 1.073 -3.476 1.00 56.76 C ATOM 742 CG GLU A 452 -2.104 1.651 -4.193 1.00 54.69 C ATOM 743 CD GLU A 452 -2.657 0.795 -5.318 1.00 54.82 C ATOM 744 OE1 GLU A 452 -3.686 1.208 -5.923 1.00 55.10 O ATOM 745 OE2 GLU A 452 -2.079 -0.273 -5.605 1.00 53.57 O ATOM 746 H GLU A 452 -2.821 1.063 -1.727 1.00 0.00 H ATOM 747 N LEU A 453 0.357 0.625 -0.616 1.00 53.69 N ATOM 748 CA LEU A 453 1.610 0.698 0.157 1.00 56.61 C ATOM 749 C LEU A 453 1.867 -0.425 1.176 1.00 53.67 C ATOM 750 O LEU A 453 2.989 -0.546 1.672 1.00 53.40 O ATOM 751 CB LEU A 453 1.745 2.069 0.840 1.00 59.72 C ATOM 752 CG LEU A 453 2.386 3.189 0.026 1.00 62.33 C ATOM 753 CD1 LEU A 453 1.674 3.423 -1.299 1.00 64.29 C ATOM 754 CD2 LEU A 453 2.360 4.443 0.882 1.00 63.20 C ATOM 755 H LEU A 453 -0.418 1.276 -0.377 1.00 0.00 H ATOM 756 N GLY A 454 0.854 -1.223 1.507 1.00 54.20 N ATOM 757 CA GLY A 454 1.109 -2.550 2.125 1.00 52.88 C ATOM 758 C GLY A 454 1.334 -2.508 3.633 1.00 51.37 C ATOM 759 O GLY A 454 1.044 -1.473 4.252 1.00 48.04 O ATOM 760 H GLY A 454 -0.124 -0.915 1.332 1.00 0.00 H ATOM 761 N PRO A 455 1.839 -3.630 4.229 1.00 45.94 N ATOM 762 CA PRO A 455 2.032 -3.747 5.680 1.00 47.10 C ATOM 763 C PRO A 455 2.921 -2.656 6.280 1.00 53.80 C ATOM 764 O PRO A 455 4.026 -2.416 5.781 1.00 57.67 O ATOM 765 CB PRO A 455 2.672 -5.122 5.856 1.00 47.50 C ATOM 766 CG PRO A 455 2.243 -5.901 4.658 1.00 49.25 C ATOM 767 CD PRO A 455 2.140 -4.899 3.540 1.00 47.49 C ATOM 768 N LEU A 456 2.417 -2.001 7.333 1.00 49.90 N ATOM 769 CA LEU A 456 3.099 -0.884 7.986 1.00 50.58 C ATOM 770 C LEU A 456 4.539 -1.237 8.381 1.00 52.60 C ATOM 771 O LEU A 456 5.445 -0.430 8.200 1.00 52.21 O ATOM 772 CB LEU A 456 2.305 -0.421 9.225 1.00 46.81 C ATOM 773 CG LEU A 456 2.918 0.663 10.120 1.00 47.53 C ATOM 774 CD1 LEU A 456 2.602 2.073 9.624 1.00 50.48 C ATOM 775 CD2 LEU A 456 2.476 0.518 11.565 1.00 48.47 C ATOM 776 H LEU A 456 1.494 -2.302 7.706 1.00 0.00 H ATOM 777 N ASN A 457 4.735 -2.433 8.927 1.00 51.37 N ATOM 778 CA ASN A 457 6.040 -2.829 9.426 1.00 53.03 C ATOM 779 C ASN A 457 7.069 -2.847 8.308 1.00 53.24 C ATOM 780 O ASN A 457 8.002 -2.071 8.373 1.00 50.23 O ATOM 781 CB ASN A 457 6.012 -4.153 10.252 1.00 52.15 C ATOM 782 CG ASN A 457 5.537 -5.360 9.463 1.00 51.22 C ATOM 783 OD1 ASN A 457 4.699 -5.235 8.569 1.00 46.17 O ATOM 784 ND2 ASN A 457 6.075 -6.548 9.793 1.00 50.74 N ATOM 785 HD22 ASN A 457 6.780 -6.606 10.555 1.00 0.00 H ATOM 786 HD21 ASN A 457 5.786 -7.409 9.286 1.00 0.00 H ATOM 787 H ASN A 457 3.938 -3.098 8.998 1.00 0.00 H ATOM 788 N LYS A 458 6.839 -3.650 7.260 1.00 60.72 N ATOM 789 CA LYS A 458 7.776 -3.804 6.131 1.00 58.83 C ATOM 790 C LYS A 458 8.144 -2.458 5.553 1.00 58.73 C ATOM 791 O LYS A 458 9.320 -2.177 5.361 1.00 62.34 O ATOM 792 CB LYS A 458 7.189 -4.672 5.019 1.00 60.07 C ATOM 793 CG LYS A 458 7.052 -6.140 5.379 1.00 67.56 C ATOM 794 CD LYS A 458 6.480 -6.943 4.215 1.00 77.93 C ATOM 795 CE LYS A 458 6.230 -8.399 4.599 1.00 78.36 C ATOM 796 NZ LYS A 458 5.603 -9.165 3.482 1.00 81.29 N ATOM 797 HZ1 LYS A 458 4.691 -8.730 3.234 1.00 0.00 H ATOM 798 HZ2 LYS A 458 6.233 -9.148 2.655 1.00 0.00 H ATOM 799 HZ3 LYS A 458 5.449 -10.149 3.782 1.00 0.00 H ATOM 800 H LYS A 458 5.953 -4.194 7.242 1.00 0.00 H ATOM 801 N TYR A 459 7.130 -1.636 5.288 1.00 58.18 N ATOM 802 CA TYR A 459 7.332 -0.253 4.850 1.00 60.32 C ATOM 803 C TYR A 459 8.308 0.439 5.785 1.00 62.36 C ATOM 804 O TYR A 459 9.451 0.710 5.377 1.00 64.34 O ATOM 805 CB TYR A 459 6.007 0.508 4.796 1.00 62.44 C ATOM 806 CG TYR A 459 6.069 1.947 4.279 1.00 70.06 C ATOM 807 CD1 TYR A 459 6.085 2.230 2.908 1.00 72.88 C ATOM 808 CD2 TYR A 459 6.047 3.032 5.162 1.00 76.15 C ATOM 809 CE1 TYR A 459 6.099 3.547 2.439 1.00 71.98 C ATOM 810 CE2 TYR A 459 6.058 4.354 4.700 1.00 70.37 C ATOM 811 CZ TYR A 459 6.081 4.609 3.342 1.00 70.31 C ATOM 812 OH TYR A 459 6.100 5.916 2.896 1.00 64.88 O ATOM 813 HH TYR A 459 6.115 5.926 1.906 1.00 0.00 H ATOM 814 H TYR A 459 6.158 -1.990 5.396 1.00 0.00 H ATOM 815 N LEU A 460 7.899 0.667 7.039 1.00 56.43 N ATOM 816 CA LEU A 460 8.708 1.456 7.970 1.00 51.68 C ATOM 817 C LEU A 460 10.157 1.017 7.977 1.00 51.17 C ATOM 818 O LEU A 460 11.031 1.892 7.904 1.00 48.18 O ATOM 819 CB LEU A 460 8.160 1.448 9.397 1.00 48.90 C ATOM 820 CG LEU A 460 6.921 2.281 9.674 1.00 49.12 C ATOM 821 CD1 LEU A 460 6.663 2.291 11.170 1.00 47.51 C ATOM 822 CD2 LEU A 460 7.023 3.709 9.152 1.00 49.46 C ATOM 823 H LEU A 460 6.989 0.276 7.358 1.00 0.00 H ATOM 824 N GLN A 461 10.393 -0.304 8.007 1.00 48.07 N ATOM 825 CA GLN A 461 11.760 -0.896 7.940 1.00 54.21 C ATOM 826 C GLN A 461 12.578 -0.354 6.785 1.00 57.01 C ATOM 827 O GLN A 461 13.755 -0.050 6.938 1.00 64.17 O ATOM 828 CB GLN A 461 11.720 -2.413 7.717 1.00 55.05 C ATOM 829 CG GLN A 461 11.092 -3.248 8.807 1.00 58.34 C ATOM 830 CD GLN A 461 10.846 -4.686 8.376 1.00 65.10 C ATOM 831 OE1 GLN A 461 10.740 -4.997 7.188 1.00 73.32 O ATOM 832 NE2 GLN A 461 10.744 -5.575 9.350 1.00 66.20 N ATOM 833 HE22 GLN A 461 10.839 -5.274 10.341 1.00 0.00 H ATOM 834 HE21 GLN A 461 10.569 -6.575 9.125 1.00 0.00 H ATOM 835 H GLN A 461 9.580 -0.948 8.081 1.00 0.00 H ATOM 836 N GLN A 462 11.931 -0.258 5.629 1.00 59.17 N ATOM 837 CA GLN A 462 12.563 0.173 4.393 1.00 63.89 C ATOM 838 C GLN A 462 12.470 1.687 4.148 1.00 63.19 C ATOM 839 O GLN A 462 12.861 2.151 3.077 1.00 62.07 O ATOM 840 CB GLN A 462 11.943 -0.611 3.231 1.00 66.16 C ATOM 841 CG GLN A 462 12.062 -2.114 3.421 1.00 68.25 C ATOM 842 CD GLN A 462 11.524 -2.899 2.246 1.00 79.68 C ATOM 843 OE1 GLN A 462 10.502 -2.532 1.650 1.00 77.88 O ATOM 844 NE2 GLN A 462 12.204 -4.004 1.905 1.00 86.05 N ATOM 845 HE22 GLN A 462 13.058 -4.273 2.435 1.00 0.00 H ATOM 846 HE21 GLN A 462 11.878 -4.591 1.111 1.00 0.00 H ATOM 847 H GLN A 462 10.921 -0.504 5.607 1.00 0.00 H ATOM 848 N ASN A 463 11.971 2.443 5.134 1.00 61.26 N ATOM 849 CA ASN A 463 11.786 3.895 5.038 1.00 63.81 C ATOM 850 C ASN A 463 12.048 4.571 6.411 1.00 65.57 C ATOM 851 O ASN A 463 11.178 5.212 7.011 1.00 62.75 O ATOM 852 CB ASN A 463 10.382 4.235 4.487 1.00 64.73 C ATOM 853 CG ASN A 463 10.132 3.676 3.079 1.00 65.56 C ATOM 854 OD1 ASN A 463 10.555 4.250 2.079 1.00 65.64 O ATOM 855 ND2 ASN A 463 9.429 2.560 3.003 1.00 70.80 N ATOM 856 HD22 ASN A 463 9.087 2.101 3.871 1.00 0.00 H ATOM 857 HD21 ASN A 463 9.218 2.141 2.075 1.00 0.00 H ATOM 858 H ASN A 463 11.698 1.973 6.021 1.00 0.00 H ATOM 859 N ARG A 464 13.289 4.441 6.871 1.00 70.36 N ATOM 860 CA ARG A 464 13.738 4.951 8.184 1.00 67.37 C ATOM 861 C ARG A 464 13.597 6.474 8.354 1.00 62.12 C ATOM 862 O ARG A 464 13.494 6.986 9.468 1.00 59.30 O ATOM 863 CB ARG A 464 15.193 4.540 8.412 1.00 68.79 C ATOM 864 CG ARG A 464 15.447 3.029 8.411 1.00 74.36 C ATOM 865 CD ARG A 464 14.691 2.305 9.514 1.00 77.24 C ATOM 866 NE ARG A 464 14.915 2.960 10.807 1.00 82.06 N ATOM 867 CZ ARG A 464 15.793 2.590 11.747 1.00 82.58 C ATOM 868 NH1 ARG A 464 15.879 3.310 12.865 1.00 78.08 N ATOM 869 NH2 ARG A 464 16.575 1.513 11.611 1.00 87.92 N ATOM 870 HE ARG A 464 14.333 3.796 11.014 1.00 0.00 H ATOM 871 HH12 ARG A 464 16.555 3.039 13.607 1.00 0.00 H ATOM 872 HH11 ARG A 464 15.270 4.143 12.995 1.00 0.00 H ATOM 873 HH22 ARG A 464 17.245 1.258 12.365 1.00 0.00 H ATOM 874 HH21 ARG A 464 16.513 0.930 10.752 1.00 0.00 H ATOM 875 H ARG A 464 13.984 3.952 6.272 1.00 0.00 H ATOM 876 N HIS A 465 13.579 7.173 7.230 1.00 58.44 N ATOM 877 CA HIS A 465 13.393 8.620 7.150 1.00 59.65 C ATOM 878 C HIS A 465 12.018 9.191 7.552 1.00 64.29 C ATOM 879 O HIS A 465 11.767 10.400 7.360 1.00 64.01 O ATOM 880 CB HIS A 465 13.660 9.066 5.696 1.00 61.21 C ATOM 881 CG HIS A 465 12.614 8.613 4.718 1.00 63.83 C ATOM 882 ND1 HIS A 465 12.717 7.431 4.012 1.00 64.04 N ATOM 883 CD2 HIS A 465 11.440 9.181 4.336 1.00 66.97 C ATOM 884 CE1 HIS A 465 11.661 7.299 3.226 1.00 68.67 C ATOM 885 NE2 HIS A 465 10.868 8.344 3.408 1.00 68.66 N ATOM 886 H HIS A 465 13.707 6.654 6.338 1.00 0.00 H ATOM 887 N VAL A 466 11.114 8.360 8.062 1.00 65.56 N ATOM 888 CA VAL A 466 9.758 8.824 8.340 1.00 65.25 C ATOM 889 C VAL A 466 9.747 9.435 9.744 1.00 66.62 C ATOM 890 O VAL A 466 10.275 8.851 10.694 1.00 65.54 O ATOM 891 CB VAL A 466 8.743 7.691 8.132 1.00 61.46 C ATOM 892 CG1 VAL A 466 7.334 8.118 8.498 1.00 63.30 C ATOM 893 CG2 VAL A 466 8.758 7.288 6.674 1.00 63.43 C ATOM 894 H VAL A 466 11.374 7.374 8.264 1.00 0.00 H ATOM 895 N LYS A 467 9.183 10.637 9.847 1.00 64.28 N ATOM 896 CA LYS A 467 9.223 11.421 11.087 1.00 65.29 C ATOM 897 C LYS A 467 8.241 10.865 12.135 1.00 63.19 C ATOM 898 O LYS A 467 7.097 10.513 11.806 1.00 60.56 O ATOM 899 CB LYS A 467 8.896 12.907 10.819 1.00 63.21 C ATOM 900 CG LYS A 467 9.880 13.663 9.926 1.00 63.05 C ATOM 901 CD LYS A 467 9.289 15.019 9.529 1.00 62.88 C ATOM 902 CE LYS A 467 10.147 15.801 8.532 1.00 60.10 C ATOM 903 NZ LYS A 467 11.249 16.538 9.207 1.00 56.91 N ATOM 904 HZ1 LYS A 467 10.847 17.211 9.890 1.00 0.00 H ATOM 905 HZ2 LYS A 467 11.862 15.862 9.705 1.00 0.00 H ATOM 906 HZ3 LYS A 467 11.806 17.054 8.496 1.00 0.00 H ATOM 907 H LYS A 467 8.696 11.035 9.018 1.00 0.00 H ATOM 908 N ASP A 468 8.680 10.836 13.395 1.00 57.83 N ATOM 909 CA ASP A 468 7.827 10.434 14.516 1.00 60.61 C ATOM 910 C ASP A 468 6.454 11.112 14.512 1.00 61.10 C ATOM 911 O ASP A 468 5.456 10.460 14.833 1.00 59.13 O ATOM 912 CB ASP A 468 8.534 10.617 15.882 1.00 64.44 C ATOM 913 CG ASP A 468 8.982 12.063 16.167 1.00 68.19 C ATOM 914 OD1 ASP A 468 8.762 12.970 15.326 1.00 72.77 O ATOM 915 OD2 ASP A 468 9.574 12.290 17.250 1.00 67.12 O ATOM 916 H ASP A 468 9.665 11.109 13.588 1.00 0.00 H ATOM 917 N LYS A 469 6.417 12.393 14.121 1.00 64.45 N ATOM 918 CA LYS A 469 5.162 13.172 13.931 1.00 69.46 C ATOM 919 C LYS A 469 4.147 12.491 13.001 1.00 63.49 C ATOM 920 O LYS A 469 2.935 12.658 13.162 1.00 55.24 O ATOM 921 CB LYS A 469 5.466 14.570 13.354 1.00 80.25 C ATOM 922 CG LYS A 469 6.232 15.504 14.287 1.00 93.61 C ATOM 923 CD LYS A 469 6.488 16.865 13.654 1.00 98.81 C ATOM 924 CE LYS A 469 7.250 17.775 14.604 1.00103.77 C ATOM 925 NZ LYS A 469 7.565 19.087 13.974 1.00102.40 N ATOM 926 HZ1 LYS A 469 8.149 18.932 13.128 1.00 0.00 H ATOM 927 HZ2 LYS A 469 6.680 19.562 13.704 1.00 0.00 H ATOM 928 HZ3 LYS A 469 8.085 19.680 14.652 1.00 0.00 H ATOM 929 H LYS A 469 7.321 12.873 13.939 1.00 0.00 H ATOM 930 N ASN A 470 4.676 11.767 12.015 1.00 59.75 N ATOM 931 CA ASN A 470 3.902 11.012 11.052 1.00 61.35 C ATOM 932 C ASN A 470 3.523 9.632 11.617 1.00 58.09 C ATOM 933 O ASN A 470 2.421 9.144 11.376 1.00 53.15 O ATOM 934 CB ASN A 470 4.712 10.920 9.733 1.00 65.60 C ATOM 935 CG ASN A 470 4.008 10.148 8.613 1.00 68.26 C ATOM 936 OD1 ASN A 470 4.686 9.592 7.740 1.00 64.72 O ATOM 937 ND2 ASN A 470 2.671 10.122 8.608 1.00 66.88 N ATOM 938 HD22 ASN A 470 2.139 10.603 9.361 1.00 0.00 H ATOM 939 HD21 ASN A 470 2.163 9.621 7.851 1.00 0.00 H ATOM 940 H ASN A 470 5.712 11.743 11.932 1.00 0.00 H ATOM 941 N ILE A 471 4.432 9.025 12.382 1.00 56.45 N ATOM 942 CA ILE A 471 4.156 7.760 13.076 1.00 51.86 C ATOM 943 C ILE A 471 3.062 7.953 14.139 1.00 50.45 C ATOM 944 O ILE A 471 2.161 7.130 14.264 1.00 52.61 O ATOM 945 CB ILE A 471 5.458 7.117 13.626 1.00 50.09 C ATOM 946 CG1 ILE A 471 6.408 6.825 12.451 1.00 48.89 C ATOM 947 CG2 ILE A 471 5.162 5.850 14.421 1.00 48.23 C ATOM 948 CD1 ILE A 471 7.566 5.894 12.739 1.00 49.18 C ATOM 949 H ILE A 471 5.369 9.463 12.491 1.00 0.00 H ATOM 950 N ILE A 472 3.111 9.054 14.873 1.00 50.22 N ATOM 951 CA ILE A 472 2.001 9.423 15.755 1.00 51.23 C ATOM 952 C ILE A 472 0.707 9.494 14.954 1.00 50.84 C ATOM 953 O ILE A 472 -0.295 8.912 15.354 1.00 49.14 O ATOM 954 CB ILE A 472 2.251 10.778 16.480 1.00 52.29 C ATOM 955 CG1 ILE A 472 3.285 10.598 17.593 1.00 53.90 C ATOM 956 CG2 ILE A 472 0.973 11.332 17.101 1.00 52.97 C ATOM 957 CD1 ILE A 472 4.094 11.844 17.868 1.00 58.02 C ATOM 958 H ILE A 472 3.950 9.666 14.823 1.00 0.00 H ATOM 959 N GLU A 473 0.733 10.229 13.836 1.00 55.88 N ATOM 960 CA GLU A 473 -0.447 10.388 12.972 1.00 53.72 C ATOM 961 C GLU A 473 -1.041 9.025 12.663 1.00 49.24 C ATOM 962 O GLU A 473 -2.234 8.812 12.880 1.00 54.05 O ATOM 963 CB GLU A 473 -0.111 11.122 11.660 1.00 56.17 C ATOM 964 CG GLU A 473 -1.274 11.122 10.662 1.00 60.24 C ATOM 965 CD GLU A 473 -1.020 11.952 9.426 1.00 59.85 C ATOM 966 OE1 GLU A 473 0.044 11.759 8.802 1.00 61.87 O ATOM 967 OE2 GLU A 473 -1.908 12.767 9.071 1.00 60.31 O ATOM 968 H GLU A 473 1.618 10.704 13.569 1.00 0.00 H ATOM 969 N LEU A 474 -0.186 8.120 12.190 1.00 43.16 N ATOM 970 CA LEU A 474 -0.589 6.779 11.796 1.00 44.05 C ATOM 971 C LEU A 474 -1.166 5.923 12.918 1.00 46.76 C ATOM 972 O LEU A 474 -2.171 5.245 12.703 1.00 49.02 O ATOM 973 CB LEU A 474 0.588 6.038 11.171 1.00 42.67 C ATOM 974 CG LEU A 474 1.075 6.596 9.838 1.00 41.14 C ATOM 975 CD1 LEU A 474 2.398 5.940 9.495 1.00 42.27 C ATOM 976 CD2 LEU A 474 0.052 6.371 8.729 1.00 44.04 C ATOM 977 H LEU A 474 0.816 8.384 12.098 1.00 0.00 H ATOM 978 N VAL A 475 -0.558 5.937 14.103 1.00 46.55 N ATOM 979 CA VAL A 475 -1.080 5.100 15.187 1.00 43.24 C ATOM 980 C VAL A 475 -2.283 5.746 15.879 1.00 42.18 C ATOM 981 O VAL A 475 -3.111 5.050 16.450 1.00 44.31 O ATOM 982 CB VAL A 475 0.011 4.587 16.160 1.00 42.55 C ATOM 983 CG1 VAL A 475 1.154 3.948 15.381 1.00 43.44 C ATOM 984 CG2 VAL A 475 0.537 5.671 17.068 1.00 43.40 C ATOM 985 H VAL A 475 0.278 6.536 14.257 1.00 0.00 H ATOM 986 N HIS A 476 -2.401 7.067 15.829 1.00 46.57 N ATOM 987 CA HIS A 476 -3.674 7.713 16.181 1.00 47.50 C ATOM 988 C HIS A 476 -4.806 7.224 15.249 1.00 48.10 C ATOM 989 O HIS A 476 -5.940 7.046 15.695 1.00 49.26 O ATOM 990 CB HIS A 476 -3.594 9.241 16.135 1.00 45.16 C ATOM 991 CG HIS A 476 -4.919 9.893 16.375 1.00 46.78 C ATOM 992 ND1 HIS A 476 -5.528 10.713 15.454 1.00 47.60 N ATOM 993 CD2 HIS A 476 -5.796 9.758 17.396 1.00 48.73 C ATOM 994 CE1 HIS A 476 -6.699 11.098 15.921 1.00 51.67 C ATOM 995 NE2 HIS A 476 -6.887 10.531 17.098 1.00 49.10 N ATOM 996 H HIS A 476 -1.589 7.648 15.539 1.00 0.00 H ATOM 997 N GLN A 477 -4.485 7.018 13.970 1.00 45.15 N ATOM 998 CA GLN A 477 -5.438 6.477 13.004 1.00 45.95 C ATOM 999 C GLN A 477 -5.846 5.047 13.365 1.00 44.08 C ATOM 1000 O GLN A 477 -7.040 4.720 13.381 1.00 47.88 O ATOM 1001 CB GLN A 477 -4.882 6.568 11.560 1.00 48.82 C ATOM 1002 CG GLN A 477 -4.857 7.990 10.998 1.00 51.48 C ATOM 1003 CD GLN A 477 -4.029 8.173 9.724 1.00 53.45 C ATOM 1004 OE1 GLN A 477 -3.458 7.223 9.167 1.00 60.11 O ATOM 1005 NE2 GLN A 477 -3.953 9.417 9.262 1.00 49.24 N ATOM 1006 HE22 GLN A 477 -4.446 10.187 9.758 1.00 0.00 H ATOM 1007 HE21 GLN A 477 -3.400 9.621 8.405 1.00 0.00 H ATOM 1008 H GLN A 477 -3.523 7.251 13.650 1.00 0.00 H ATOM 1009 N VAL A 478 -4.867 4.211 13.696 1.00 43.17 N ATOM 1010 CA VAL A 478 -5.145 2.839 14.118 1.00 40.93 C ATOM 1011 C VAL A 478 -5.998 2.855 15.380 1.00 39.55 C ATOM 1012 O VAL A 478 -6.961 2.121 15.436 1.00 36.82 O ATOM 1013 CB VAL A 478 -3.855 2.001 14.301 1.00 39.84 C ATOM 1014 CG1 VAL A 478 -4.141 0.618 14.877 1.00 39.27 C ATOM 1015 CG2 VAL A 478 -3.167 1.816 12.970 1.00 39.96 C ATOM 1016 H VAL A 478 -3.881 4.540 13.654 1.00 0.00 H ATOM 1017 N SER A 479 -5.678 3.712 16.356 1.00 42.52 N ATOM 1018 CA SER A 479 -6.468 3.809 17.600 1.00 45.25 C ATOM 1019 C SER A 479 -7.878 4.345 17.337 1.00 48.12 C ATOM 1020 O SER A 479 -8.822 3.982 18.047 1.00 48.08 O ATOM 1021 CB SER A 479 -5.758 4.653 18.676 1.00 48.59 C ATOM 1022 OG SER A 479 -5.907 6.069 18.485 1.00 50.67 O ATOM 1023 HG SER A 479 -5.525 6.324 17.608 1.00 0.00 H ATOM 1024 H SER A 479 -4.849 4.328 16.235 1.00 0.00 H ATOM 1025 N MET A 480 -8.019 5.205 16.326 1.00 52.38 N ATOM 1026 CA MET A 480 -9.347 5.696 15.908 1.00 55.70 C ATOM 1027 C MET A 480 -10.094 4.529 15.283 1.00 51.51 C ATOM 1028 O MET A 480 -11.248 4.257 15.628 1.00 53.75 O ATOM 1029 CB MET A 480 -9.260 6.891 14.929 1.00 60.42 C ATOM 1030 CG MET A 480 -9.070 8.256 15.598 1.00 61.69 C ATOM 1031 SD MET A 480 -9.422 9.697 14.546 1.00 64.31 S ATOM 1032 CE MET A 480 -8.062 9.654 13.375 1.00 62.45 C ATOM 1033 H MET A 480 -7.173 5.537 15.821 1.00 0.00 H ATOM 1034 N GLY A 481 -9.420 3.821 14.386 1.00 46.31 N ATOM 1035 CA GLY A 481 -9.952 2.554 13.855 1.00 46.02 C ATOM 1036 C GLY A 481 -10.311 1.515 14.920 1.00 42.89 C ATOM 1037 O GLY A 481 -11.353 0.821 14.816 1.00 38.83 O ATOM 1038 H GLY A 481 -8.498 4.167 14.051 1.00 0.00 H ATOM 1039 N MET A 482 -9.481 1.417 15.959 1.00 37.62 N ATOM 1040 CA MET A 482 -9.753 0.446 17.013 1.00 38.18 C ATOM 1041 C MET A 482 -10.879 0.862 17.918 1.00 41.08 C ATOM 1042 O MET A 482 -11.648 0.003 18.359 1.00 41.94 O ATOM 1043 CB MET A 482 -8.514 0.109 17.824 1.00 36.36 C ATOM 1044 CG MET A 482 -7.570 -0.822 17.102 1.00 34.61 C ATOM 1045 SD MET A 482 -8.296 -2.359 16.515 1.00 37.06 S ATOM 1046 CE MET A 482 -8.860 -3.152 18.012 1.00 35.27 C ATOM 1047 H MET A 482 -8.643 2.030 16.018 1.00 0.00 H ATOM 1048 N LYS A 483 -10.983 2.166 18.171 1.00 44.18 N ATOM 1049 CA LYS A 483 -12.085 2.752 18.954 1.00 46.93 C ATOM 1050 C LYS A 483 -13.469 2.489 18.360 1.00 46.24 C ATOM 1051 O LYS A 483 -14.423 2.173 19.073 1.00 46.00 O ATOM 1052 CB LYS A 483 -11.868 4.262 19.056 1.00 51.58 C ATOM 1053 CG LYS A 483 -12.845 5.004 19.947 1.00 53.27 C ATOM 1054 CD LYS A 483 -12.549 6.505 19.944 1.00 56.34 C ATOM 1055 CE LYS A 483 -13.828 7.332 19.924 1.00 55.77 C ATOM 1056 NZ LYS A 483 -14.811 6.880 20.950 1.00 58.35 N ATOM 1057 HZ1 LYS A 483 -15.066 5.888 20.771 1.00 0.00 H ATOM 1058 HZ2 LYS A 483 -14.387 6.965 21.896 1.00 0.00 H ATOM 1059 HZ3 LYS A 483 -15.664 7.473 20.897 1.00 0.00 H ATOM 1060 H LYS A 483 -10.250 2.802 17.797 1.00 0.00 H ATOM 1061 N TYR A 484 -13.572 2.642 17.048 1.00 48.14 N ATOM 1062 CA TYR A 484 -14.794 2.317 16.321 1.00 48.37 C ATOM 1063 C TYR A 484 -15.125 0.855 16.553 1.00 50.78 C ATOM 1064 O TYR A 484 -16.273 0.498 16.883 1.00 52.16 O ATOM 1065 CB TYR A 484 -14.641 2.605 14.810 1.00 50.50 C ATOM 1066 CG TYR A 484 -15.741 1.995 13.955 1.00 54.06 C ATOM 1067 CD1 TYR A 484 -17.014 2.551 13.914 1.00 55.75 C ATOM 1068 CD2 TYR A 484 -15.505 0.852 13.207 1.00 54.49 C ATOM 1069 CE1 TYR A 484 -18.017 1.981 13.150 1.00 57.47 C ATOM 1070 CE2 TYR A 484 -16.496 0.276 12.446 1.00 57.29 C ATOM 1071 CZ TYR A 484 -17.752 0.836 12.423 1.00 58.47 C ATOM 1072 OH TYR A 484 -18.709 0.223 11.637 1.00 61.58 O ATOM 1073 HH TYR A 484 -19.562 0.721 11.709 1.00 0.00 H ATOM 1074 H TYR A 484 -12.754 3.006 16.519 1.00 0.00 H ATOM 1075 N LEU A 485 -14.101 0.021 16.381 1.00 48.26 N ATOM 1076 CA LEU A 485 -14.213 -1.417 16.609 1.00 46.55 C ATOM 1077 C LEU A 485 -14.669 -1.773 18.024 1.00 42.30 C ATOM 1078 O LEU A 485 -15.433 -2.714 18.210 1.00 41.67 O ATOM 1079 CB LEU A 485 -12.875 -2.108 16.335 1.00 48.92 C ATOM 1080 CG LEU A 485 -13.003 -3.530 15.832 1.00 49.38 C ATOM 1081 CD1 LEU A 485 -13.558 -3.517 14.420 1.00 51.72 C ATOM 1082 CD2 LEU A 485 -11.653 -4.217 15.840 1.00 51.51 C ATOM 1083 H LEU A 485 -13.187 0.409 16.073 1.00 0.00 H ATOM 1084 N GLU A 486 -14.184 -1.032 19.002 1.00 38.02 N ATOM 1085 CA GLU A 486 -14.636 -1.188 20.369 1.00 42.70 C ATOM 1086 C GLU A 486 -16.121 -0.861 20.486 1.00 45.52 C ATOM 1087 O GLU A 486 -16.900 -1.699 20.946 1.00 44.06 O ATOM 1088 CB GLU A 486 -13.824 -0.306 21.344 1.00 42.46 C ATOM 1089 CG GLU A 486 -14.492 -0.195 22.709 1.00 43.63 C ATOM 1090 CD GLU A 486 -13.557 0.107 23.846 1.00 43.67 C ATOM 1091 OE1 GLU A 486 -12.389 0.452 23.627 1.00 44.38 O ATOM 1092 OE2 GLU A 486 -14.014 -0.027 24.992 1.00 46.34 O ATOM 1093 H GLU A 486 -13.459 -0.318 18.786 1.00 0.00 H ATOM 1094 N GLU A 487 -16.498 0.346 20.054 1.00 47.85 N ATOM 1095 CA GLU A 487 -17.916 0.786 20.067 1.00 47.09 C ATOM 1096 C GLU A 487 -18.842 -0.212 19.379 1.00 46.94 C ATOM 1097 O GLU A 487 -19.964 -0.425 19.808 1.00 46.93 O ATOM 1098 CB GLU A 487 -18.098 2.100 19.320 1.00 47.05 C ATOM 1099 CG GLU A 487 -17.357 3.296 19.867 1.00 45.51 C ATOM 1100 CD GLU A 487 -17.052 4.275 18.769 1.00 47.50 C ATOM 1101 OE1 GLU A 487 -16.408 5.298 19.064 1.00 54.68 O ATOM 1102 OE2 GLU A 487 -17.472 4.026 17.613 1.00 48.31 O ATOM 1103 H GLU A 487 -15.773 1.000 19.696 1.00 0.00 H ATOM 1104 N SER A 488 -18.362 -0.821 18.301 1.00 47.03 N ATOM 1105 CA SER A 488 -19.118 -1.841 17.610 1.00 45.96 C ATOM 1106 C SER A 488 -18.998 -3.202 18.310 1.00 47.38 C ATOM 1107 O SER A 488 -19.390 -4.232 17.733 1.00 43.73 O ATOM 1108 CB SER A 488 -18.632 -1.936 16.172 1.00 48.11 C ATOM 1109 OG SER A 488 -18.304 -0.641 15.692 1.00 52.74 O ATOM 1110 HG SER A 488 -17.589 -0.253 16.256 1.00 0.00 H ATOM 1111 H SER A 488 -17.421 -0.558 17.946 1.00 0.00 H ATOM 1112 N ASN A 489 -18.463 -3.197 19.543 1.00 45.82 N ATOM 1113 CA ASN A 489 -18.269 -4.389 20.376 1.00 45.15 C ATOM 1114 C ASN A 489 -17.770 -5.612 19.622 1.00 40.64 C ATOM 1115 O ASN A 489 -18.337 -6.688 19.732 1.00 39.41 O ATOM 1116 CB ASN A 489 -19.539 -4.678 21.181 1.00 46.54 C ATOM 1117 CG ASN A 489 -19.682 -3.769 22.387 1.00 49.70 C ATOM 1118 OD1 ASN A 489 -20.587 -2.942 22.430 1.00 58.42 O ATOM 1119 ND2 ASN A 489 -18.807 -3.932 23.386 1.00 52.60 N ATOM 1120 HD22 ASN A 489 -18.055 -4.646 23.307 1.00 0.00 H ATOM 1121 HD21 ASN A 489 -18.879 -3.345 24.241 1.00 0.00 H ATOM 1122 H ASN A 489 -18.165 -2.281 19.935 1.00 0.00 H ATOM 1123 N PHE A 490 -16.704 -5.400 18.855 1.00 41.07 N ATOM 1124 CA PHE A 490 -15.978 -6.445 18.112 1.00 43.92 C ATOM 1125 C PHE A 490 -14.559 -6.459 18.654 1.00 40.51 C ATOM 1126 O PHE A 490 -13.965 -5.391 18.849 1.00 36.09 O ATOM 1127 CB PHE A 490 -15.876 -6.111 16.614 1.00 45.34 C ATOM 1128 CG PHE A 490 -17.020 -6.600 15.783 1.00 45.49 C ATOM 1129 CD1 PHE A 490 -18.063 -5.757 15.453 1.00 47.88 C ATOM 1130 CD2 PHE A 490 -17.031 -7.897 15.295 1.00 47.61 C ATOM 1131 CE1 PHE A 490 -19.109 -6.206 14.673 1.00 47.53 C ATOM 1132 CE2 PHE A 490 -18.071 -8.349 14.509 1.00 45.72 C ATOM 1133 CZ PHE A 490 -19.114 -7.508 14.203 1.00 44.90 C ATOM 1134 H PHE A 490 -16.357 -4.423 18.774 1.00 0.00 H ATOM 1135 N VAL A 491 -14.007 -7.643 18.870 1.00 38.25 N ATOM 1136 CA VAL A 491 -12.625 -7.754 19.326 1.00 39.18 C ATOM 1137 C VAL A 491 -11.782 -8.234 18.158 1.00 36.88 C ATOM 1138 O VAL A 491 -12.130 -9.238 17.522 1.00 42.29 O ATOM 1139 CB VAL A 491 -12.533 -8.692 20.535 1.00 41.07 C ATOM 1140 CG1 VAL A 491 -11.098 -8.978 20.916 1.00 43.66 C ATOM 1141 CG2 VAL A 491 -13.209 -8.039 21.716 1.00 40.82 C ATOM 1142 H VAL A 491 -14.566 -8.506 18.713 1.00 0.00 H ATOM 1143 N HIS A 492 -10.696 -7.518 17.868 1.00 32.39 N ATOM 1144 CA HIS A 492 -9.852 -7.858 16.701 1.00 33.21 C ATOM 1145 C HIS A 492 -9.112 -9.192 16.857 1.00 31.34 C ATOM 1146 O HIS A 492 -9.281 -10.092 16.052 1.00 30.23 O ATOM 1147 CB HIS A 492 -8.869 -6.725 16.412 1.00 33.53 C ATOM 1148 CG HIS A 492 -8.206 -6.829 15.074 1.00 33.83 C ATOM 1149 ND1 HIS A 492 -7.230 -7.757 14.807 1.00 34.85 N ATOM 1150 CD2 HIS A 492 -8.375 -6.127 13.929 1.00 31.95 C ATOM 1151 CE1 HIS A 492 -6.831 -7.639 13.556 1.00 33.76 C ATOM 1152 NE2 HIS A 492 -7.505 -6.650 13.003 1.00 32.50 N ATOM 1153 H HIS A 492 -10.438 -6.710 18.470 1.00 0.00 H ATOM 1154 N ARG A 493 -8.335 -9.292 17.930 1.00 31.06 N ATOM 1155 CA ARG A 493 -7.557 -10.481 18.321 1.00 32.70 C ATOM 1156 C ARG A 493 -6.226 -10.742 17.592 1.00 31.16 C ATOM 1157 O ARG A 493 -5.523 -11.674 17.910 1.00 30.47 O ATOM 1158 CB ARG A 493 -8.401 -11.739 18.353 1.00 33.83 C ATOM 1159 CG ARG A 493 -9.385 -11.697 19.481 1.00 35.71 C ATOM 1160 CD ARG A 493 -10.286 -12.912 19.436 1.00 37.82 C ATOM 1161 NE ARG A 493 -9.558 -14.111 19.839 1.00 42.89 N ATOM 1162 CZ ARG A 493 -9.544 -15.274 19.202 1.00 41.91 C ATOM 1163 NH1 ARG A 493 -10.239 -15.461 18.090 1.00 45.05 N ATOM 1164 NH2 ARG A 493 -8.829 -16.279 19.713 1.00 42.75 N ATOM 1165 HE ARG A 493 -8.995 -14.047 20.711 1.00 0.00 H ATOM 1166 HH12 ARG A 493 -10.212 -16.382 17.609 1.00 0.00 H ATOM 1167 HH11 ARG A 493 -10.812 -14.686 17.698 1.00 0.00 H ATOM 1168 HH22 ARG A 493 -8.805 -17.199 19.229 1.00 0.00 H ATOM 1169 HH21 ARG A 493 -8.296 -16.142 20.595 1.00 0.00 H ATOM 1170 H ARG A 493 -8.270 -8.458 18.548 1.00 0.00 H ATOM 1171 N ASP A 494 -5.857 -9.869 16.686 1.00 30.87 N ATOM 1172 CA ASP A 494 -4.639 -10.024 15.942 1.00 31.98 C ATOM 1173 C ASP A 494 -4.008 -8.692 15.584 1.00 33.22 C ATOM 1174 O ASP A 494 -3.318 -8.566 14.566 1.00 33.96 O ATOM 1175 CB ASP A 494 -4.908 -10.844 14.681 1.00 32.50 C ATOM 1176 CG ASP A 494 -3.652 -11.512 14.143 1.00 31.02 C ATOM 1177 OD1 ASP A 494 -2.625 -11.549 14.846 1.00 30.45 O ATOM 1178 OD2 ASP A 494 -3.686 -11.954 13.001 1.00 30.64 O ATOM 1179 H ASP A 494 -6.462 -9.043 16.502 1.00 0.00 H ATOM 1180 N LEU A 495 -4.206 -7.699 16.447 1.00 35.38 N ATOM 1181 CA LEU A 495 -3.746 -6.355 16.167 1.00 33.57 C ATOM 1182 C LEU A 495 -2.234 -6.389 16.273 1.00 34.83 C ATOM 1183 O LEU A 495 -1.702 -6.815 17.277 1.00 36.24 O ATOM 1184 CB LEU A 495 -4.357 -5.341 17.139 1.00 31.12 C ATOM 1185 CG LEU A 495 -4.245 -3.862 16.724 1.00 30.70 C ATOM 1186 CD1 LEU A 495 -4.808 -3.534 15.344 1.00 28.16 C ATOM 1187 CD2 LEU A 495 -4.928 -3.027 17.787 1.00 32.35 C ATOM 1188 H LEU A 495 -4.701 -7.892 17.341 1.00 0.00 H ATOM 1189 N ALA A 496 -1.554 -5.961 15.211 1.00 36.94 N ATOM 1190 CA ALA A 496 -0.083 -6.043 15.117 1.00 37.09 C ATOM 1191 C ALA A 496 0.360 -5.169 13.964 1.00 34.49 C ATOM 1192 O ALA A 496 -0.449 -4.822 13.122 1.00 34.07 O ATOM 1193 CB ALA A 496 0.353 -7.492 14.874 1.00 37.54 C ATOM 1194 H ALA A 496 -2.082 -5.552 14.414 1.00 0.00 H ATOM 1195 N ALA A 497 1.635 -4.824 13.897 1.00 33.68 N ATOM 1196 CA ALA A 497 2.115 -3.967 12.795 1.00 34.50 C ATOM 1197 C ALA A 497 2.000 -4.549 11.378 1.00 33.27 C ATOM 1198 O ALA A 497 1.883 -3.808 10.434 1.00 34.83 O ATOM 1199 CB ALA A 497 3.530 -3.507 13.054 1.00 35.54 C ATOM 1200 H ALA A 497 2.301 -5.157 14.623 1.00 0.00 H ATOM 1201 N ARG A 498 2.046 -5.868 11.244 1.00 34.87 N ATOM 1202 CA ARG A 498 1.840 -6.561 9.963 1.00 35.45 C ATOM 1203 C ARG A 498 0.407 -6.475 9.455 1.00 35.75 C ATOM 1204 O ARG A 498 0.170 -6.482 8.244 1.00 40.11 O ATOM 1205 CB ARG A 498 2.243 -8.046 10.068 1.00 35.97 C ATOM 1206 CG ARG A 498 1.545 -8.771 11.189 1.00 38.72 C ATOM 1207 CD ARG A 498 1.811 -10.248 11.238 1.00 39.11 C ATOM 1208 NE ARG A 498 1.013 -10.855 12.294 1.00 38.05 N ATOM 1209 CZ ARG A 498 1.242 -10.745 13.601 1.00 36.21 C ATOM 1210 NH1 ARG A 498 2.238 -10.038 14.067 1.00 37.32 N ATOM 1211 NH2 ARG A 498 0.452 -11.360 14.470 1.00 38.87 N ATOM 1212 HE ARG A 498 0.193 -11.424 12.002 1.00 0.00 H ATOM 1213 HH12 ARG A 498 2.392 -9.970 15.093 1.00 0.00 H ATOM 1214 HH11 ARG A 498 2.876 -9.543 13.411 1.00 0.00 H ATOM 1215 HH22 ARG A 498 0.633 -11.272 15.490 1.00 0.00 H ATOM 1216 HH21 ARG A 498 -0.349 -11.930 14.131 1.00 0.00 H ATOM 1217 H ARG A 498 2.238 -6.442 12.089 1.00 0.00 H ATOM 1218 N ASN A 499 -0.542 -6.394 10.382 1.00 36.23 N ATOM 1219 CA ASN A 499 -1.963 -6.306 10.063 1.00 38.23 C ATOM 1220 C ASN A 499 -2.477 -4.863 10.158 1.00 40.26 C ATOM 1221 O ASN A 499 -3.650 -4.636 10.481 1.00 38.02 O ATOM 1222 CB ASN A 499 -2.758 -7.245 10.997 1.00 38.67 C ATOM 1223 CG ASN A 499 -2.264 -8.692 10.944 1.00 37.13 C ATOM 1224 OD1 ASN A 499 -1.651 -9.144 9.975 1.00 35.49 O ATOM 1225 ND2 ASN A 499 -2.525 -9.418 11.990 1.00 41.10 N ATOM 1226 HD22 ASN A 499 -3.044 -9.007 12.792 1.00 0.00 H ATOM 1227 HD21 ASN A 499 -2.214 -10.410 12.025 1.00 0.00 H ATOM 1228 H ASN A 499 -0.258 -6.393 11.383 1.00 0.00 H ATOM 1229 N VAL A 500 -1.578 -3.904 9.926 1.00 40.11 N ATOM 1230 CA VAL A 500 -1.930 -2.546 9.564 1.00 44.47 C ATOM 1231 C VAL A 500 -1.387 -2.321 8.153 1.00 47.54 C ATOM 1232 O VAL A 500 -0.251 -2.661 7.873 1.00 45.27 O ATOM 1233 CB VAL A 500 -1.281 -1.514 10.516 1.00 43.14 C ATOM 1234 CG1 VAL A 500 -1.545 -0.094 10.033 1.00 45.60 C ATOM 1235 CG2 VAL A 500 -1.824 -1.665 11.916 1.00 41.72 C ATOM 1236 H VAL A 500 -0.570 -4.145 10.010 1.00 0.00 H ATOM 1237 N LEU A 501 -2.179 -1.707 7.287 1.00 50.67 N ATOM 1238 CA LEU A 501 -1.775 -1.478 5.900 1.00 54.43 C ATOM 1239 C LEU A 501 -1.893 -0.001 5.548 1.00 53.66 C ATOM 1240 O LEU A 501 -2.783 0.702 6.040 1.00 52.03 O ATOM 1241 CB LEU A 501 -2.643 -2.301 4.948 1.00 55.16 C ATOM 1242 CG LEU A 501 -2.751 -3.797 5.217 1.00 56.84 C ATOM 1243 CD1 LEU A 501 -3.771 -4.364 4.258 1.00 58.81 C ATOM 1244 CD2 LEU A 501 -1.420 -4.526 5.071 1.00 58.35 C ATOM 1245 H LEU A 501 -3.114 -1.379 7.602 1.00 0.00 H ATOM 1246 N LEU A 502 -1.002 0.452 4.675 1.00 53.25 N ATOM 1247 CA LEU A 502 -0.947 1.861 4.307 1.00 58.52 C ATOM 1248 C LEU A 502 -1.598 2.115 2.958 1.00 57.72 C ATOM 1249 O LEU A 502 -1.174 1.576 1.939 1.00 52.25 O ATOM 1250 CB LEU A 502 0.495 2.330 4.272 1.00 59.97 C ATOM 1251 CG LEU A 502 1.143 2.335 5.651 1.00 60.85 C ATOM 1252 CD1 LEU A 502 2.651 2.214 5.510 1.00 62.88 C ATOM 1253 CD2 LEU A 502 0.750 3.582 6.431 1.00 62.25 C ATOM 1254 H LEU A 502 -0.328 -0.213 4.244 1.00 0.00 H ATOM 1255 N VAL A 503 -2.640 2.934 2.970 1.00 60.51 N ATOM 1256 CA VAL A 503 -3.226 3.445 1.740 1.00 62.90 C ATOM 1257 C VAL A 503 -2.189 4.383 1.131 1.00 65.51 C ATOM 1258 O VAL A 503 -1.852 4.289 -0.054 1.00 68.46 O ATOM 1259 CB VAL A 503 -4.522 4.238 2.007 1.00 60.72 C ATOM 1260 CG1 VAL A 503 -5.129 4.768 0.708 1.00 58.58 C ATOM 1261 CG2 VAL A 503 -5.541 3.376 2.742 1.00 65.46 C ATOM 1262 H VAL A 503 -3.050 3.219 3.883 1.00 0.00 H ATOM 1263 N THR A 504 -1.686 5.269 1.989 1.00 66.76 N ATOM 1264 CA THR A 504 -0.648 6.246 1.669 1.00 65.08 C ATOM 1265 C THR A 504 0.272 6.278 2.866 1.00 65.85 C ATOM 1266 O THR A 504 -0.049 5.703 3.902 1.00 68.05 O ATOM 1267 CB THR A 504 -1.228 7.668 1.430 1.00 66.40 C ATOM 1268 OG1 THR A 504 -1.805 8.199 2.637 1.00 60.33 O ATOM 1269 CG2 THR A 504 -2.281 7.640 0.307 1.00 63.62 C ATOM 1270 HG1 THR A 504 -2.166 9.103 2.459 1.00 0.00 H ATOM 1271 H THR A 504 -2.060 5.265 2.959 1.00 0.00 H ATOM 1272 N GLN A 505 1.392 6.975 2.751 1.00 68.49 N ATOM 1273 CA GLN A 505 2.278 7.173 3.907 1.00 72.45 C ATOM 1274 C GLN A 505 1.660 8.011 5.053 1.00 65.56 C ATOM 1275 O GLN A 505 2.248 8.095 6.133 1.00 65.27 O ATOM 1276 CB GLN A 505 3.581 7.832 3.469 1.00 83.48 C ATOM 1277 CG GLN A 505 3.418 9.295 3.052 1.00 97.67 C ATOM 1278 CD GLN A 505 4.726 9.962 2.681 1.00108.00 C ATOM 1279 OE1 GLN A 505 5.770 9.301 2.558 1.00112.88 O ATOM 1280 NE2 GLN A 505 4.681 11.287 2.503 1.00109.00 N ATOM 1281 HE22 GLN A 505 3.782 11.797 2.617 1.00 0.00 H ATOM 1282 HE21 GLN A 505 5.545 11.807 2.250 1.00 0.00 H ATOM 1283 H GLN A 505 1.648 7.387 1.831 1.00 0.00 H ATOM 1284 N HIS A 506 0.537 8.681 4.795 1.00 61.32 N ATOM 1285 CA HIS A 506 -0.237 9.388 5.833 1.00 61.21 C ATOM 1286 C HIS A 506 -1.600 8.772 6.090 1.00 58.16 C ATOM 1287 O HIS A 506 -2.433 9.368 6.779 1.00 58.08 O ATOM 1288 CB HIS A 506 -0.427 10.855 5.443 1.00 63.24 C ATOM 1289 CG HIS A 506 0.857 11.589 5.261 1.00 66.29 C ATOM 1290 ND1 HIS A 506 1.705 11.854 6.309 1.00 64.42 N ATOM 1291 CD2 HIS A 506 1.448 12.099 4.157 1.00 68.81 C ATOM 1292 CE1 HIS A 506 2.769 12.493 5.862 1.00 66.16 C ATOM 1293 NE2 HIS A 506 2.635 12.661 4.560 1.00 68.77 N ATOM 1294 H HIS A 506 0.190 8.707 3.815 1.00 0.00 H ATOM 1295 N TYR A 507 -1.831 7.572 5.562 1.00 61.10 N ATOM 1296 CA TYR A 507 -3.121 6.924 5.714 1.00 59.44 C ATOM 1297 C TYR A 507 -2.950 5.448 6.037 1.00 55.75 C ATOM 1298 O TYR A 507 -2.386 4.673 5.245 1.00 57.02 O ATOM 1299 CB TYR A 507 -3.933 7.118 4.446 1.00 61.70 C ATOM 1300 CG TYR A 507 -5.403 6.788 4.536 1.00 64.45 C ATOM 1301 CD1 TYR A 507 -6.225 7.032 3.453 1.00 64.00 C ATOM 1302 CD2 TYR A 507 -5.985 6.255 5.690 1.00 64.52 C ATOM 1303 CE1 TYR A 507 -7.574 6.752 3.501 1.00 66.56 C ATOM 1304 CE2 TYR A 507 -7.328 5.973 5.746 1.00 67.45 C ATOM 1305 CZ TYR A 507 -8.121 6.222 4.646 1.00 68.95 C ATOM 1306 OH TYR A 507 -9.469 5.939 4.679 1.00 70.91 O ATOM 1307 HH TYR A 507 -9.598 4.972 4.849 1.00 0.00 H ATOM 1308 H TYR A 507 -1.076 7.091 5.033 1.00 0.00 H ATOM 1309 N ALA A 508 -3.447 5.078 7.216 1.00 48.89 N ATOM 1310 CA ALA A 508 -3.352 3.730 7.727 1.00 43.64 C ATOM 1311 C ALA A 508 -4.722 3.127 7.855 1.00 42.25 C ATOM 1312 O ALA A 508 -5.694 3.823 8.209 1.00 38.26 O ATOM 1313 CB ALA A 508 -2.704 3.766 9.089 1.00 45.83 C ATOM 1314 H ALA A 508 -3.927 5.795 7.797 1.00 0.00 H ATOM 1315 N LYS A 509 -4.778 1.824 7.602 1.00 40.87 N ATOM 1316 CA LYS A 509 -5.962 1.006 7.851 1.00 40.52 C ATOM 1317 C LYS A 509 -5.572 -0.339 8.510 1.00 38.80 C ATOM 1318 O LYS A 509 -4.549 -0.949 8.175 1.00 34.12 O ATOM 1319 CB LYS A 509 -6.670 0.708 6.535 1.00 43.13 C ATOM 1320 CG LYS A 509 -7.438 1.865 5.935 1.00 43.48 C ATOM 1321 CD LYS A 509 -8.075 1.404 4.628 1.00 44.51 C ATOM 1322 CE LYS A 509 -8.816 2.511 3.887 1.00 44.15 C ATOM 1323 NZ LYS A 509 -10.292 2.497 4.104 1.00 45.26 N ATOM 1324 HZ1 LYS A 509 -10.681 1.590 3.775 1.00 0.00 H ATOM 1325 HZ2 LYS A 509 -10.493 2.615 5.118 1.00 0.00 H ATOM 1326 HZ3 LYS A 509 -10.727 3.276 3.570 1.00 0.00 H ATOM 1327 H LYS A 509 -3.935 1.362 7.206 1.00 0.00 H ATOM 1328 N ILE A 510 -6.418 -0.775 9.434 1.00 38.19 N ATOM 1329 CA ILE A 510 -6.332 -2.067 10.113 1.00 37.99 C ATOM 1330 C ILE A 510 -6.897 -3.154 9.199 1.00 38.27 C ATOM 1331 O ILE A 510 -7.992 -3.007 8.681 1.00 40.97 O ATOM 1332 CB ILE A 510 -7.210 -2.061 11.386 1.00 37.47 C ATOM 1333 CG1 ILE A 510 -6.745 -0.989 12.378 1.00 38.59 C ATOM 1334 CG2 ILE A 510 -7.208 -3.405 12.077 1.00 36.72 C ATOM 1335 CD1 ILE A 510 -7.837 -0.527 13.315 1.00 37.96 C ATOM 1336 H ILE A 510 -7.205 -0.148 9.696 1.00 0.00 H ATOM 1337 N SER A 511 -6.173 -4.256 9.066 1.00 38.79 N ATOM 1338 CA SER A 511 -6.592 -5.405 8.275 1.00 41.77 C ATOM 1339 C SER A 511 -6.702 -6.684 9.138 1.00 41.42 C ATOM 1340 O SER A 511 -6.507 -6.631 10.351 1.00 42.46 O ATOM 1341 CB SER A 511 -5.572 -5.614 7.148 1.00 42.11 C ATOM 1342 OG SER A 511 -4.281 -5.935 7.656 1.00 42.92 O ATOM 1343 HG SER A 511 -3.961 -5.196 8.232 1.00 0.00 H ATOM 1344 H SER A 511 -5.255 -4.303 9.553 1.00 0.00 H ATOM 1345 N ASP A 512 -7.035 -7.801 8.481 1.00 39.73 N ATOM 1346 CA ASP A 512 -6.940 -9.174 9.005 1.00 42.39 C ATOM 1347 C ASP A 512 -7.877 -9.492 10.143 1.00 42.98 C ATOM 1348 O ASP A 512 -7.452 -9.745 11.271 1.00 43.81 O ATOM 1349 CB ASP A 512 -5.505 -9.555 9.392 1.00 44.73 C ATOM 1350 CG ASP A 512 -4.620 -9.767 8.200 1.00 46.50 C ATOM 1351 OD1 ASP A 512 -5.088 -9.820 7.081 1.00 50.21 O ATOM 1352 OD2 ASP A 512 -3.425 -9.894 8.376 1.00 56.50 O ATOM 1353 H ASP A 512 -7.394 -7.689 7.511 1.00 0.00 H ATOM 1354 N PHE A 513 -9.159 -9.528 9.801 1.00 42.64 N ATOM 1355 CA PHE A 513 -10.210 -9.843 10.745 1.00 41.16 C ATOM 1356 C PHE A 513 -10.489 -11.349 10.846 1.00 42.19 C ATOM 1357 O PHE A 513 -11.467 -11.748 11.457 1.00 40.29 O ATOM 1358 CB PHE A 513 -11.451 -8.995 10.421 1.00 41.14 C ATOM 1359 CG PHE A 513 -11.201 -7.516 10.600 1.00 38.87 C ATOM 1360 CD1 PHE A 513 -11.493 -6.885 11.789 1.00 37.58 C ATOM 1361 CD2 PHE A 513 -10.595 -6.777 9.603 1.00 41.67 C ATOM 1362 CE1 PHE A 513 -11.231 -5.530 11.978 1.00 38.21 C ATOM 1363 CE2 PHE A 513 -10.316 -5.427 9.786 1.00 42.86 C ATOM 1364 CZ PHE A 513 -10.632 -4.804 10.985 1.00 38.39 C ATOM 1365 H PHE A 513 -9.419 -9.322 8.815 1.00 0.00 H ATOM 1366 N GLY A 514 -9.576 -12.177 10.323 1.00 44.60 N ATOM 1367 CA GLY A 514 -9.633 -13.642 10.422 1.00 42.83 C ATOM 1368 C GLY A 514 -9.910 -14.234 11.786 1.00 42.69 C ATOM 1369 O GLY A 514 -10.565 -15.273 11.872 1.00 44.96 O ATOM 1370 H GLY A 514 -8.774 -11.755 9.813 1.00 0.00 H ATOM 1371 N LEU A 515 -9.399 -13.582 12.835 1.00 42.01 N ATOM 1372 CA LEU A 515 -9.617 -13.983 14.237 1.00 40.06 C ATOM 1373 C LEU A 515 -10.697 -13.183 14.995 1.00 39.17 C ATOM 1374 O LEU A 515 -10.988 -13.483 16.146 1.00 40.11 O ATOM 1375 CB LEU A 515 -8.304 -13.879 15.008 1.00 39.95 C ATOM 1376 CG LEU A 515 -7.229 -14.927 14.705 1.00 42.12 C ATOM 1377 CD1 LEU A 515 -5.921 -14.580 15.407 1.00 40.51 C ATOM 1378 CD2 LEU A 515 -7.683 -16.315 15.150 1.00 43.81 C ATOM 1379 H LEU A 515 -8.813 -12.742 12.651 1.00 0.00 H ATOM 1380 N SER A 516 -11.296 -12.188 14.365 1.00 38.69 N ATOM 1381 CA SER A 516 -12.166 -11.250 15.077 1.00 44.21 C ATOM 1382 C SER A 516 -13.463 -11.880 15.531 1.00 41.74 C ATOM 1383 O SER A 516 -13.987 -12.750 14.864 1.00 42.88 O ATOM 1384 CB SER A 516 -12.499 -10.049 14.191 1.00 47.16 C ATOM 1385 OG SER A 516 -11.313 -9.356 13.830 1.00 55.24 O ATOM 1386 HG SER A 516 -10.857 -9.037 14.648 1.00 0.00 H ATOM 1387 H SER A 516 -11.146 -12.069 13.343 1.00 0.00 H ATOM 1388 N LYS A 517 -13.979 -11.435 16.666 1.00 40.48 N ATOM 1389 CA LYS A 517 -15.259 -11.934 17.162 1.00 39.86 C ATOM 1390 C LYS A 517 -16.145 -10.757 17.488 1.00 39.59 C ATOM 1391 O LYS A 517 -15.657 -9.710 17.927 1.00 43.19 O ATOM 1392 CB LYS A 517 -15.048 -12.805 18.396 1.00 40.18 C ATOM 1393 CG LYS A 517 -14.045 -13.933 18.202 1.00 41.61 C ATOM 1394 CD LYS A 517 -14.549 -15.009 17.252 1.00 42.43 C ATOM 1395 CE LYS A 517 -13.553 -16.169 17.158 1.00 43.51 C ATOM 1396 NZ LYS A 517 -14.076 -17.311 16.349 1.00 42.89 N ATOM 1397 HZ1 LYS A 517 -14.948 -17.673 16.785 1.00 0.00 H ATOM 1398 HZ2 LYS A 517 -14.280 -16.985 15.383 1.00 0.00 H ATOM 1399 HZ3 LYS A 517 -13.363 -18.067 16.318 1.00 0.00 H ATOM 1400 H LYS A 517 -13.464 -10.717 17.214 1.00 0.00 H ATOM 1401 N ALA A 518 -17.440 -10.915 17.218 1.00 41.31 N ATOM 1402 CA ALA A 518 -18.474 -9.975 17.679 1.00 38.16 C ATOM 1403 C ALA A 518 -18.752 -10.425 19.060 1.00 35.93 C ATOM 1404 O ALA A 518 -18.995 -11.602 19.267 1.00 37.20 O ATOM 1405 CB ALA A 518 -19.749 -10.071 16.850 1.00 38.35 C ATOM 1406 H ALA A 518 -17.733 -11.740 16.656 1.00 0.00 H ATOM 1407 N LEU A 519 -18.675 -9.512 20.010 1.00 37.21 N ATOM 1408 CA LEU A 519 -18.961 -9.840 21.387 1.00 40.74 C ATOM 1409 C LEU A 519 -20.464 -10.016 21.580 1.00 42.22 C ATOM 1410 O LEU A 519 -21.275 -9.341 20.932 1.00 45.93 O ATOM 1411 CB LEU A 519 -18.479 -8.725 22.316 1.00 40.51 C ATOM 1412 CG LEU A 519 -16.986 -8.378 22.366 1.00 39.38 C ATOM 1413 CD1 LEU A 519 -16.798 -7.008 23.015 1.00 41.04 C ATOM 1414 CD2 LEU A 519 -16.181 -9.401 23.133 1.00 37.19 C ATOM 1415 H LEU A 519 -18.404 -8.539 19.763 1.00 0.00 H ATOM 1416 N ARG A 520 -20.819 -10.933 22.467 1.00 43.09 N ATOM 1417 CA ARG A 520 -22.165 -11.034 23.016 1.00 44.24 C ATOM 1418 C ARG A 520 -22.665 -9.726 23.609 1.00 44.40 C ATOM 1419 O ARG A 520 -21.888 -8.939 24.135 1.00 53.02 O ATOM 1420 CB ARG A 520 -22.198 -12.104 24.108 1.00 44.98 C ATOM 1421 CG ARG A 520 -22.218 -13.537 23.594 1.00 45.14 C ATOM 1422 CD ARG A 520 -21.741 -14.495 24.669 1.00 46.90 C ATOM 1423 NE ARG A 520 -22.503 -14.346 25.916 1.00 48.29 N ATOM 1424 CZ ARG A 520 -23.560 -15.082 26.285 1.00 50.35 C ATOM 1425 NH1 ARG A 520 -24.163 -14.824 27.452 1.00 48.31 N ATOM 1426 NH2 ARG A 520 -24.024 -16.076 25.520 1.00 47.55 N ATOM 1427 HE ARG A 520 -22.194 -13.601 26.572 1.00 0.00 H ATOM 1428 HH12 ARG A 520 -24.984 -15.389 27.749 1.00 0.00 H ATOM 1429 HH11 ARG A 520 -23.810 -14.059 28.062 1.00 0.00 H ATOM 1430 HH22 ARG A 520 -24.846 -16.631 25.831 1.00 0.00 H ATOM 1431 HH21 ARG A 520 -23.562 -16.294 24.614 1.00 0.00 H ATOM 1432 H ARG A 520 -20.102 -11.615 22.788 1.00 0.00 H ATOM 1433 N ALA A 521 -23.977 -9.513 23.552 1.00 46.68 N ATOM 1434 CA ALA A 521 -24.602 -8.259 24.044 1.00 43.82 C ATOM 1435 C ALA A 521 -24.481 -8.063 25.541 1.00 43.35 C ATOM 1436 O ALA A 521 -24.575 -6.926 26.017 1.00 47.58 O ATOM 1437 CB ALA A 521 -26.075 -8.212 23.647 1.00 43.17 C ATOM 1438 H ALA A 521 -24.587 -10.252 23.148 1.00 0.00 H ATOM 1439 N ASP A 522 -24.295 -9.166 26.267 1.00 42.09 N ATOM 1440 CA ASP A 522 -24.186 -9.177 27.733 1.00 48.28 C ATOM 1441 C ASP A 522 -22.791 -9.475 28.322 1.00 54.64 C ATOM 1442 O ASP A 522 -22.678 -9.660 29.540 1.00 56.87 O ATOM 1443 CB ASP A 522 -25.166 -10.208 28.315 1.00 45.33 C ATOM 1444 CG ASP A 522 -24.826 -11.629 27.914 1.00 43.24 C ATOM 1445 OD1 ASP A 522 -24.174 -11.808 26.856 1.00 38.86 O ATOM 1446 OD2 ASP A 522 -25.227 -12.566 28.645 1.00 39.98 O ATOM 1447 H ASP A 522 -24.223 -10.074 25.765 1.00 0.00 H ATOM 1448 N GLU A 523 -21.752 -9.556 27.483 1.00 56.95 N ATOM 1449 CA GLU A 523 -20.385 -9.816 27.963 1.00 55.66 C ATOM 1450 C GLU A 523 -19.390 -8.930 27.254 1.00 53.88 C ATOM 1451 O GLU A 523 -19.553 -8.653 26.063 1.00 55.71 O ATOM 1452 CB GLU A 523 -20.015 -11.279 27.740 1.00 57.96 C ATOM 1453 CG GLU A 523 -20.749 -12.252 28.664 1.00 59.05 C ATOM 1454 CD GLU A 523 -20.145 -12.347 30.059 1.00 58.11 C ATOM 1455 OE1 GLU A 523 -20.437 -13.349 30.730 1.00 63.16 O ATOM 1456 OE2 GLU A 523 -19.369 -11.457 30.486 1.00 59.12 O ATOM 1457 H GLU A 523 -21.915 -9.432 26.463 1.00 0.00 H ATOM 1458 N ASN A 524 -18.361 -8.486 27.978 1.00 51.79 N ATOM 1459 CA ASN A 524 -17.313 -7.647 27.391 1.00 52.17 C ATOM 1460 C ASN A 524 -16.092 -8.414 26.826 1.00 45.94 C ATOM 1461 O ASN A 524 -15.137 -7.781 26.378 1.00 46.24 O ATOM 1462 CB ASN A 524 -16.867 -6.581 28.394 1.00 59.17 C ATOM 1463 CG ASN A 524 -15.882 -7.121 29.418 1.00 65.75 C ATOM 1464 OD1 ASN A 524 -16.275 -7.748 30.404 1.00 76.25 O ATOM 1465 ND2 ASN A 524 -14.594 -6.894 29.182 1.00 70.14 N ATOM 1466 HD22 ASN A 524 -14.306 -6.360 28.337 1.00 0.00 H ATOM 1467 HD21 ASN A 524 -13.874 -7.250 29.842 1.00 0.00 H ATOM 1468 H ASN A 524 -18.301 -8.742 28.984 1.00 0.00 H ATOM 1469 N TYR A 525 -16.138 -9.747 26.813 1.00 42.22 N ATOM 1470 CA TYR A 525 -15.021 -10.567 26.345 1.00 41.58 C ATOM 1471 C TYR A 525 -15.494 -11.809 25.616 1.00 39.80 C ATOM 1472 O TYR A 525 -16.563 -12.314 25.915 1.00 36.92 O ATOM 1473 CB TYR A 525 -14.133 -10.982 27.523 1.00 41.14 C ATOM 1474 CG TYR A 525 -14.790 -11.868 28.556 1.00 42.14 C ATOM 1475 CD1 TYR A 525 -14.781 -13.245 28.425 1.00 45.21 C ATOM 1476 CD2 TYR A 525 -15.381 -11.330 29.694 1.00 44.95 C ATOM 1477 CE1 TYR A 525 -15.376 -14.075 29.375 1.00 47.21 C ATOM 1478 CE2 TYR A 525 -15.969 -12.145 30.661 1.00 46.73 C ATOM 1479 CZ TYR A 525 -15.971 -13.525 30.500 1.00 47.13 C ATOM 1480 OH TYR A 525 -16.538 -14.374 31.446 1.00 49.68 O ATOM 1481 HH TYR A 525 -16.079 -14.251 32.315 1.00 0.00 H ATOM 1482 H TYR A 525 -17.001 -10.221 27.148 1.00 0.00 H ATOM 1483 N TYR A 526 -14.681 -12.270 24.665 1.00 40.03 N ATOM 1484 CA TYR A 526 -14.840 -13.571 24.000 1.00 41.75 C ATOM 1485 C TYR A 526 -13.936 -14.575 24.715 1.00 40.36 C ATOM 1486 O TYR A 526 -12.767 -14.287 24.974 1.00 41.83 O ATOM 1487 CB TYR A 526 -14.469 -13.491 22.492 1.00 39.76 C ATOM 1488 CG TYR A 526 -14.290 -14.854 21.839 1.00 40.56 C ATOM 1489 CD1 TYR A 526 -13.011 -15.373 21.575 1.00 41.20 C ATOM 1490 CD2 TYR A 526 -15.399 -15.643 21.506 1.00 40.54 C ATOM 1491 CE1 TYR A 526 -12.848 -16.638 21.017 1.00 41.08 C ATOM 1492 CE2 TYR A 526 -15.253 -16.896 20.943 1.00 40.88 C ATOM 1493 CZ TYR A 526 -13.973 -17.401 20.693 1.00 44.36 C ATOM 1494 OH TYR A 526 -13.805 -18.661 20.121 1.00 43.79 O ATOM 1495 HH TYR A 526 -12.838 -18.850 20.019 1.00 0.00 H ATOM 1496 H TYR A 526 -13.883 -11.670 24.375 1.00 0.00 H ATOM 1497 N LYS A 527 -14.481 -15.747 25.005 1.00 44.25 N ATOM 1498 CA LYS A 527 -13.770 -16.840 25.659 1.00 50.23 C ATOM 1499 C LYS A 527 -13.516 -17.969 24.657 1.00 54.31 C ATOM 1500 O LYS A 527 -14.436 -18.413 23.981 1.00 54.76 O ATOM 1501 CB LYS A 527 -14.603 -17.369 26.811 1.00 54.48 C ATOM 1502 CG LYS A 527 -13.903 -18.399 27.691 1.00 60.35 C ATOM 1503 CD LYS A 527 -13.014 -17.763 28.753 1.00 61.93 C ATOM 1504 CE LYS A 527 -12.566 -18.785 29.790 1.00 65.93 C ATOM 1505 NZ LYS A 527 -11.516 -19.740 29.306 1.00 70.23 N ATOM 1506 HZ1 LYS A 527 -11.883 -20.274 28.492 1.00 0.00 H ATOM 1507 HZ2 LYS A 527 -10.670 -19.207 29.019 1.00 0.00 H ATOM 1508 HZ3 LYS A 527 -11.269 -20.399 30.072 1.00 0.00 H ATOM 1509 H LYS A 527 -15.478 -15.897 24.751 1.00 0.00 H ATOM 1510 N ALA A 528 -12.271 -18.443 24.603 1.00 55.92 N ATOM 1511 CA ALA A 528 -11.819 -19.416 23.610 1.00 58.38 C ATOM 1512 C ALA A 528 -11.560 -20.785 24.237 1.00 65.91 C ATOM 1513 O ALA A 528 -11.623 -20.936 25.455 1.00 68.91 O ATOM 1514 CB ALA A 528 -10.551 -18.900 22.940 1.00 53.40 C ATOM 1515 H ALA A 528 -11.584 -18.102 25.305 1.00 0.00 H ATOM 1516 N GLN A 529 -11.278 -21.767 23.378 1.00 73.58 N ATOM 1517 CA GLN A 529 -10.778 -23.097 23.766 1.00 78.92 C ATOM 1518 C GLN A 529 -9.246 -23.077 23.619 1.00 84.44 C ATOM 1519 O GLN A 529 -8.666 -21.991 23.518 1.00 87.01 O ATOM 1520 CB GLN A 529 -11.440 -24.182 22.893 1.00 81.31 C ATOM 1521 CG GLN A 529 -12.738 -24.743 23.468 1.00 81.14 C ATOM 1522 CD GLN A 529 -13.719 -23.674 23.933 1.00 77.37 C ATOM 1523 OE1 GLN A 529 -14.259 -23.763 25.038 1.00 73.49 O ATOM 1524 NE2 GLN A 529 -13.955 -22.663 23.096 1.00 72.39 N ATOM 1525 HE22 GLN A 529 -13.476 -22.629 22.173 1.00 0.00 H ATOM 1526 HE21 GLN A 529 -14.618 -21.908 23.366 1.00 0.00 H ATOM 1527 H GLN A 529 -11.421 -21.580 22.365 1.00 0.00 H ATOM 1528 N THR A 530 -8.584 -24.239 23.633 1.00 83.96 N ATOM 1529 CA THR A 530 -7.120 -24.313 23.415 1.00 85.92 C ATOM 1530 C THR A 530 -6.650 -23.621 22.120 1.00 81.12 C ATOM 1531 O THR A 530 -7.323 -23.675 21.083 1.00 78.67 O ATOM 1532 CB THR A 530 -6.606 -25.772 23.402 1.00 89.33 C ATOM 1533 OG1 THR A 530 -7.364 -26.540 22.459 1.00 87.53 O ATOM 1534 CG2 THR A 530 -6.698 -26.407 24.800 1.00 90.42 C ATOM 1535 HG1 THR A 530 -7.262 -26.146 21.556 1.00 0.00 H ATOM 1536 H THR A 530 -9.113 -25.118 23.802 1.00 0.00 H ATOM 1537 N HIS A 531 -5.476 -23.000 22.194 1.00 78.25 N ATOM 1538 CA HIS A 531 -5.056 -22.012 21.203 1.00 80.06 C ATOM 1539 C HIS A 531 -4.256 -22.585 20.030 1.00 80.28 C ATOM 1540 O HIS A 531 -3.685 -21.834 19.216 1.00 68.69 O ATOM 1541 CB HIS A 531 -4.250 -20.907 21.896 1.00 85.86 C ATOM 1542 CG HIS A 531 -4.363 -19.586 21.210 1.00 87.34 C ATOM 1543 ND1 HIS A 531 -5.488 -18.801 21.314 1.00 84.67 N ATOM 1544 CD2 HIS A 531 -3.520 -18.937 20.373 1.00 87.65 C ATOM 1545 CE1 HIS A 531 -5.331 -17.718 20.578 1.00 90.10 C ATOM 1546 NE2 HIS A 531 -4.145 -17.775 20.000 1.00 89.98 N ATOM 1547 H HIS A 531 -4.836 -23.225 22.983 1.00 0.00 H TER 1548 HIS A 531 ATOM 1549 N PRO A 535 0.780 -16.616 18.289 1.00 38.52 N ATOM 1550 CA PRO A 535 0.523 -15.176 18.282 1.00 42.03 C ATOM 1551 C PRO A 535 0.906 -14.500 19.622 1.00 43.59 C ATOM 1552 O PRO A 535 0.663 -13.287 19.840 1.00 45.01 O ATOM 1553 CB PRO A 535 -0.983 -15.122 18.059 1.00 43.68 C ATOM 1554 CG PRO A 535 -1.466 -16.334 18.822 1.00 47.01 C ATOM 1555 CD PRO A 535 -0.358 -17.365 18.833 1.00 41.80 C ATOM 1556 HN2 PRO A 535 1.620 -16.806 18.872 1.00 0.00 H ATOM 1557 HN1 PRO A 535 0.958 -16.932 17.314 1.00 0.00 H ATOM 1558 N VAL A 536 1.584 -15.276 20.456 1.00 42.85 N ATOM 1559 CA VAL A 536 1.713 -15.026 21.889 1.00 45.28 C ATOM 1560 C VAL A 536 2.217 -13.617 22.241 1.00 43.11 C ATOM 1561 O VAL A 536 1.779 -13.015 23.225 1.00 42.36 O ATOM 1562 CB VAL A 536 2.640 -16.109 22.508 1.00 47.15 C ATOM 1563 CG1 VAL A 536 3.028 -15.806 23.959 1.00 47.07 C ATOM 1564 CG2 VAL A 536 1.955 -17.468 22.439 1.00 48.94 C ATOM 1565 H VAL A 536 2.054 -16.117 20.065 1.00 0.00 H ATOM 1566 N LYS A 537 3.131 -13.107 21.428 1.00 38.87 N ATOM 1567 CA LYS A 537 3.885 -11.913 21.748 1.00 37.42 C ATOM 1568 C LYS A 537 3.116 -10.609 21.652 1.00 35.51 C ATOM 1569 O LYS A 537 3.661 -9.583 21.960 1.00 33.75 O ATOM 1570 CB LYS A 537 5.124 -11.840 20.849 1.00 39.62 C ATOM 1571 CG LYS A 537 6.246 -12.709 21.367 1.00 41.10 C ATOM 1572 CD LYS A 537 7.431 -12.750 20.418 1.00 45.03 C ATOM 1573 CE LYS A 537 8.335 -13.931 20.760 1.00 43.47 C ATOM 1574 NZ LYS A 537 9.751 -13.556 20.542 1.00 45.89 N ATOM 1575 HZ1 LYS A 537 9.889 -13.293 19.545 1.00 0.00 H ATOM 1576 HZ2 LYS A 537 9.992 -12.749 21.152 1.00 0.00 H ATOM 1577 HZ3 LYS A 537 10.362 -14.364 20.776 1.00 0.00 H ATOM 1578 H LYS A 537 3.314 -13.584 20.522 1.00 0.00 H ATOM 1579 N TRP A 538 1.873 -10.667 21.203 1.00 36.12 N ATOM 1580 CA TRP A 538 0.990 -9.535 21.095 1.00 34.37 C ATOM 1581 C TRP A 538 -0.186 -9.624 22.068 1.00 33.63 C ATOM 1582 O TRP A 538 -1.005 -8.690 22.132 1.00 32.69 O ATOM 1583 CB TRP A 538 0.451 -9.460 19.675 1.00 36.45 C ATOM 1584 CG TRP A 538 1.381 -8.806 18.725 1.00 36.15 C ATOM 1585 CD1 TRP A 538 1.356 -7.509 18.359 1.00 35.19 C ATOM 1586 CD2 TRP A 538 2.464 -9.417 18.006 1.00 34.57 C ATOM 1587 NE1 TRP A 538 2.362 -7.257 17.468 1.00 36.51 N ATOM 1588 CE2 TRP A 538 3.065 -8.408 17.239 1.00 35.09 C ATOM 1589 CE3 TRP A 538 2.982 -10.726 17.934 1.00 35.92 C ATOM 1590 CZ2 TRP A 538 4.171 -8.655 16.390 1.00 37.71 C ATOM 1591 CZ3 TRP A 538 4.092 -10.976 17.101 1.00 34.17 C ATOM 1592 CH2 TRP A 538 4.669 -9.951 16.345 1.00 36.27 C ATOM 1593 HE1 TRP A 538 2.562 -6.334 17.032 1.00 0.00 H ATOM 1594 H TRP A 538 1.508 -11.595 20.907 1.00 0.00 H ATOM 1595 N TYR A 539 -0.227 -10.689 22.868 1.00 31.24 N ATOM 1596 CA TYR A 539 -1.376 -11.041 23.679 1.00 29.03 C ATOM 1597 C TYR A 539 -1.192 -10.716 25.130 1.00 30.70 C ATOM 1598 O TYR A 539 -0.169 -11.060 25.719 1.00 28.68 O ATOM 1599 CB TYR A 539 -1.678 -12.529 23.548 1.00 31.83 C ATOM 1600 CG TYR A 539 -2.470 -12.909 22.329 1.00 31.86 C ATOM 1601 CD1 TYR A 539 -2.956 -14.196 22.179 1.00 31.95 C ATOM 1602 CD2 TYR A 539 -2.765 -11.981 21.349 1.00 33.30 C ATOM 1603 CE1 TYR A 539 -3.702 -14.543 21.067 1.00 33.66 C ATOM 1604 CE2 TYR A 539 -3.510 -12.310 20.252 1.00 35.15 C ATOM 1605 CZ TYR A 539 -3.984 -13.591 20.103 1.00 33.51 C ATOM 1606 OH TYR A 539 -4.722 -13.906 18.974 1.00 32.72 O ATOM 1607 HH TYR A 539 -5.530 -13.336 18.940 1.00 0.00 H ATOM 1608 H TYR A 539 0.612 -11.302 22.913 1.00 0.00 H ATOM 1609 N ALA A 540 -2.244 -10.126 25.728 1.00 32.26 N ATOM 1610 CA ALA A 540 -2.211 -9.725 27.120 1.00 31.61 C ATOM 1611 C ALA A 540 -2.152 -10.953 27.972 1.00 30.84 C ATOM 1612 O ALA A 540 -2.487 -12.042 27.495 1.00 32.78 O ATOM 1613 CB ALA A 540 -3.433 -8.906 27.470 1.00 34.66 C ATOM 1614 H ALA A 540 -3.107 -9.953 25.174 1.00 0.00 H ATOM 1615 N PRO A 541 -1.723 -10.806 29.230 1.00 31.85 N ATOM 1616 CA PRO A 541 -1.713 -11.935 30.162 1.00 32.60 C ATOM 1617 C PRO A 541 -3.030 -12.669 30.316 1.00 33.79 C ATOM 1618 O PRO A 541 -3.032 -13.889 30.365 1.00 41.30 O ATOM 1619 CB PRO A 541 -1.314 -11.262 31.478 1.00 32.52 C ATOM 1620 CG PRO A 541 -0.307 -10.252 31.023 1.00 30.91 C ATOM 1621 CD PRO A 541 -0.933 -9.682 29.769 1.00 32.30 C ATOM 1622 N GLU A 542 -4.138 -11.949 30.378 1.00 32.02 N ATOM 1623 CA GLU A 542 -5.425 -12.582 30.570 1.00 32.24 C ATOM 1624 C GLU A 542 -5.781 -13.484 29.394 1.00 31.77 C ATOM 1625 O GLU A 542 -6.473 -14.454 29.566 1.00 31.87 O ATOM 1626 CB GLU A 542 -6.533 -11.542 30.840 1.00 32.52 C ATOM 1627 CG GLU A 542 -7.053 -10.760 29.637 1.00 31.79 C ATOM 1628 CD GLU A 542 -6.289 -9.486 29.371 1.00 32.32 C ATOM 1629 OE1 GLU A 542 -5.218 -9.256 29.977 1.00 31.67 O ATOM 1630 OE2 GLU A 542 -6.768 -8.682 28.546 1.00 35.43 O ATOM 1631 H GLU A 542 -4.083 -10.914 30.288 1.00 0.00 H ATOM 1632 N CYS A 543 -5.329 -13.141 28.194 1.00 32.95 N ATOM 1633 CA CYS A 543 -5.521 -14.007 27.038 1.00 35.08 C ATOM 1634 C CYS A 543 -4.715 -15.314 27.154 1.00 38.77 C ATOM 1635 O CYS A 543 -5.235 -16.396 26.847 1.00 37.28 O ATOM 1636 CB CYS A 543 -5.113 -13.308 25.757 1.00 36.63 C ATOM 1637 SG CYS A 543 -5.780 -11.649 25.535 1.00 36.38 S ATOM 1638 H CYS A 543 -4.828 -12.237 28.077 1.00 0.00 H ATOM 1639 N ILE A 544 -3.465 -15.203 27.609 1.00 42.58 N ATOM 1640 CA ILE A 544 -2.562 -16.372 27.765 1.00 44.13 C ATOM 1641 C ILE A 544 -3.004 -17.327 28.853 1.00 43.05 C ATOM 1642 O ILE A 544 -2.947 -18.533 28.668 1.00 46.54 O ATOM 1643 CB ILE A 544 -1.109 -15.953 28.089 1.00 42.78 C ATOM 1644 CG1 ILE A 544 -0.528 -15.056 26.994 1.00 40.10 C ATOM 1645 CG2 ILE A 544 -0.216 -17.183 28.264 1.00 46.38 C ATOM 1646 CD1 ILE A 544 -0.958 -15.396 25.589 1.00 41.50 C ATOM 1647 H ILE A 544 -3.109 -14.260 27.865 1.00 0.00 H ATOM 1648 N ASN A 545 -3.462 -16.775 29.966 1.00 45.13 N ATOM 1649 CA ASN A 545 -3.843 -17.549 31.153 1.00 46.29 C ATOM 1650 C ASN A 545 -5.301 -17.991 31.243 1.00 44.37 C ATOM 1651 O ASN A 545 -5.579 -19.057 31.774 1.00 50.20 O ATOM 1652 CB ASN A 545 -3.485 -16.729 32.400 1.00 45.93 C ATOM 1653 CG ASN A 545 -1.993 -16.546 32.540 1.00 47.70 C ATOM 1654 OD1 ASN A 545 -1.249 -17.506 32.405 1.00 55.15 O ATOM 1655 ND2 ASN A 545 -1.541 -15.327 32.792 1.00 50.06 N ATOM 1656 HD22 ASN A 545 -2.209 -14.537 32.900 1.00 0.00 H ATOM 1657 HD21 ASN A 545 -0.518 -15.160 32.882 1.00 0.00 H ATOM 1658 H ASN A 545 -3.557 -15.740 30.001 1.00 0.00 H ATOM 1659 N TYR A 546 -6.218 -17.151 30.782 1.00 43.14 N ATOM 1660 CA TYR A 546 -7.658 -17.376 30.934 1.00 42.56 C ATOM 1661 C TYR A 546 -8.431 -17.466 29.616 1.00 43.27 C ATOM 1662 O TYR A 546 -9.613 -17.813 29.621 1.00 43.95 O ATOM 1663 CB TYR A 546 -8.237 -16.264 31.812 1.00 43.16 C ATOM 1664 CG TYR A 546 -7.650 -16.262 33.199 1.00 44.17 C ATOM 1665 CD1 TYR A 546 -6.706 -15.317 33.598 1.00 44.49 C ATOM 1666 CD2 TYR A 546 -8.009 -17.238 34.105 1.00 46.41 C ATOM 1667 CE1 TYR A 546 -6.164 -15.347 34.887 1.00 46.18 C ATOM 1668 CE2 TYR A 546 -7.482 -17.276 35.382 1.00 46.33 C ATOM 1669 CZ TYR A 546 -6.554 -16.340 35.779 1.00 44.88 C ATOM 1670 OH TYR A 546 -6.037 -16.389 37.067 1.00 45.89 O ATOM 1671 HH TYR A 546 -5.388 -15.651 37.189 1.00 0.00 H ATOM 1672 H TYR A 546 -5.900 -16.292 30.289 1.00 0.00 H ATOM 1673 N TYR A 547 -7.775 -17.161 28.497 1.00 44.45 N ATOM 1674 CA TYR A 547 -8.365 -17.297 27.159 1.00 48.43 C ATOM 1675 C TYR A 547 -9.430 -16.248 26.881 1.00 43.25 C ATOM 1676 O TYR A 547 -10.289 -16.439 26.030 1.00 43.09 O ATOM 1677 CB TYR A 547 -8.930 -18.715 26.910 1.00 51.80 C ATOM 1678 CG TYR A 547 -7.946 -19.861 26.927 1.00 53.66 C ATOM 1679 CD1 TYR A 547 -8.376 -21.150 26.607 1.00 63.97 C ATOM 1680 CD2 TYR A 547 -6.599 -19.683 27.231 1.00 56.93 C ATOM 1681 CE1 TYR A 547 -7.502 -22.229 26.616 1.00 68.45 C ATOM 1682 CE2 TYR A 547 -5.715 -20.754 27.241 1.00 62.26 C ATOM 1683 CZ TYR A 547 -6.166 -22.024 26.931 1.00 66.11 C ATOM 1684 OH TYR A 547 -5.307 -23.098 26.923 1.00 69.22 O ATOM 1685 HH TYR A 547 -5.807 -23.917 26.680 1.00 0.00 H ATOM 1686 H TYR A 547 -6.799 -16.810 28.575 1.00 0.00 H ATOM 1687 N LYS A 548 -9.317 -15.111 27.558 1.00 45.60 N ATOM 1688 CA LYS A 548 -10.303 -14.055 27.504 1.00 44.68 C ATOM 1689 C LYS A 548 -9.784 -12.917 26.607 1.00 41.85 C ATOM 1690 O LYS A 548 -8.748 -12.298 26.873 1.00 42.78 O ATOM 1691 CB LYS A 548 -10.604 -13.567 28.925 1.00 46.52 C ATOM 1692 CG LYS A 548 -10.935 -14.696 29.897 1.00 52.47 C ATOM 1693 CD LYS A 548 -11.264 -14.221 31.316 1.00 54.27 C ATOM 1694 CE LYS A 548 -12.761 -14.041 31.554 1.00 54.92 C ATOM 1695 NZ LYS A 548 -13.116 -14.196 32.998 1.00 58.10 N ATOM 1696 HZ1 LYS A 548 -12.846 -15.147 33.320 1.00 0.00 H ATOM 1697 HZ2 LYS A 548 -12.608 -13.482 33.557 1.00 0.00 H ATOM 1698 HZ3 LYS A 548 -14.141 -14.067 33.118 1.00 0.00 H ATOM 1699 H LYS A 548 -8.478 -14.973 28.157 1.00 0.00 H ATOM 1700 N PHE A 549 -10.534 -12.645 25.555 1.00 38.68 N ATOM 1701 CA PHE A 549 -10.197 -11.640 24.579 1.00 36.88 C ATOM 1702 C PHE A 549 -11.211 -10.502 24.600 1.00 34.83 C ATOM 1703 O PHE A 549 -12.351 -10.666 24.198 1.00 34.43 O ATOM 1704 CB PHE A 549 -10.137 -12.306 23.211 1.00 36.96 C ATOM 1705 CG PHE A 549 -9.040 -13.312 23.110 1.00 38.57 C ATOM 1706 CD1 PHE A 549 -7.772 -12.922 22.715 1.00 37.61 C ATOM 1707 CD2 PHE A 549 -9.264 -14.654 23.442 1.00 39.55 C ATOM 1708 CE1 PHE A 549 -6.745 -13.851 22.645 1.00 40.28 C ATOM 1709 CE2 PHE A 549 -8.237 -15.589 23.381 1.00 37.00 C ATOM 1710 CZ PHE A 549 -6.973 -15.188 22.983 1.00 38.70 C ATOM 1711 H PHE A 549 -11.414 -13.184 25.424 1.00 0.00 H ATOM 1712 N SER A 550 -10.783 -9.345 25.078 1.00 35.66 N ATOM 1713 CA SER A 550 -11.634 -8.154 25.139 1.00 36.42 C ATOM 1714 C SER A 550 -11.028 -6.989 24.356 1.00 36.51 C ATOM 1715 O SER A 550 -9.886 -7.076 23.870 1.00 37.28 O ATOM 1716 CB SER A 550 -11.780 -7.730 26.584 1.00 33.98 C ATOM 1717 OG SER A 550 -10.609 -7.057 26.973 1.00 36.23 O ATOM 1718 HG SER A 550 -9.833 -7.664 26.876 1.00 0.00 H ATOM 1719 H SER A 550 -9.804 -9.278 25.424 1.00 0.00 H ATOM 1720 N SER A 551 -11.778 -5.894 24.260 1.00 32.43 N ATOM 1721 CA SER A 551 -11.223 -4.668 23.697 1.00 36.82 C ATOM 1722 C SER A 551 -9.976 -4.246 24.451 1.00 36.73 C ATOM 1723 O SER A 551 -9.029 -3.751 23.856 1.00 40.47 O ATOM 1724 CB SER A 551 -12.249 -3.513 23.639 1.00 35.98 C ATOM 1725 OG SER A 551 -12.962 -3.591 22.410 1.00 36.17 O ATOM 1726 HG SER A 551 -12.326 -3.513 21.655 1.00 0.00 H ATOM 1727 H SER A 551 -12.765 -5.912 24.588 1.00 0.00 H ATOM 1728 N LYS A 552 -9.968 -4.485 25.752 1.00 37.53 N ATOM 1729 CA LYS A 552 -8.795 -4.223 26.574 1.00 37.27 C ATOM 1730 C LYS A 552 -7.588 -5.084 26.180 1.00 35.34 C ATOM 1731 O LYS A 552 -6.455 -4.624 26.318 1.00 33.23 O ATOM 1732 CB LYS A 552 -9.104 -4.455 28.046 1.00 36.88 C ATOM 1733 CG LYS A 552 -10.182 -3.556 28.624 1.00 36.74 C ATOM 1734 CD LYS A 552 -9.740 -2.117 28.699 1.00 38.11 C ATOM 1735 CE LYS A 552 -10.630 -1.290 29.614 1.00 39.06 C ATOM 1736 NZ LYS A 552 -10.170 -1.252 31.039 1.00 42.99 N ATOM 1737 HZ1 LYS A 552 -10.150 -2.219 31.421 1.00 0.00 H ATOM 1738 HZ2 LYS A 552 -9.216 -0.840 31.083 1.00 0.00 H ATOM 1739 HZ3 LYS A 552 -10.826 -0.671 31.598 1.00 0.00 H ATOM 1740 H LYS A 552 -10.823 -4.871 26.200 1.00 0.00 H ATOM 1741 N SER A 553 -7.803 -6.317 25.713 1.00 34.92 N ATOM 1742 CA SER A 553 -6.676 -7.123 25.241 1.00 34.94 C ATOM 1743 C SER A 553 -6.187 -6.630 23.889 1.00 33.00 C ATOM 1744 O SER A 553 -4.997 -6.593 23.664 1.00 30.89 O ATOM 1745 CB SER A 553 -6.930 -8.624 25.272 1.00 34.94 C ATOM 1746 OG SER A 553 -8.154 -8.986 24.717 1.00 43.49 O ATOM 1747 HG SER A 553 -8.886 -8.548 25.220 1.00 0.00 H ATOM 1748 H SER A 553 -8.768 -6.703 25.685 1.00 0.00 H ATOM 1749 N ASP A 554 -7.078 -6.172 23.020 1.00 33.08 N ATOM 1750 CA ASP A 554 -6.641 -5.373 21.843 1.00 33.02 C ATOM 1751 C ASP A 554 -5.828 -4.092 22.174 1.00 31.80 C ATOM 1752 O ASP A 554 -5.015 -3.642 21.361 1.00 32.02 O ATOM 1753 CB ASP A 554 -7.837 -4.938 20.994 1.00 34.68 C ATOM 1754 CG ASP A 554 -8.421 -6.047 20.195 1.00 33.76 C ATOM 1755 OD1 ASP A 554 -7.777 -7.088 20.033 1.00 35.57 O ATOM 1756 OD2 ASP A 554 -9.552 -5.879 19.717 1.00 36.53 O ATOM 1757 H ASP A 554 -8.089 -6.372 23.162 1.00 0.00 H ATOM 1758 N VAL A 555 -6.062 -3.510 23.334 1.00 27.52 N ATOM 1759 CA VAL A 555 -5.254 -2.396 23.822 1.00 28.51 C ATOM 1760 C VAL A 555 -3.825 -2.843 24.108 1.00 27.90 C ATOM 1761 O VAL A 555 -2.875 -2.120 23.806 1.00 27.60 O ATOM 1762 CB VAL A 555 -5.880 -1.761 25.096 1.00 28.73 C ATOM 1763 CG1 VAL A 555 -4.978 -0.728 25.714 1.00 28.63 C ATOM 1764 CG2 VAL A 555 -7.214 -1.103 24.763 1.00 31.30 C ATOM 1765 H VAL A 555 -6.848 -3.856 23.921 1.00 0.00 H ATOM 1766 N TRP A 556 -3.675 -4.010 24.721 1.00 27.35 N ATOM 1767 CA TRP A 556 -2.360 -4.595 24.935 1.00 26.72 C ATOM 1768 C TRP A 556 -1.606 -4.724 23.624 1.00 25.50 C ATOM 1769 O TRP A 556 -0.465 -4.272 23.512 1.00 26.30 O ATOM 1770 CB TRP A 556 -2.450 -5.967 25.575 1.00 28.10 C ATOM 1771 CG TRP A 556 -1.146 -6.457 26.021 1.00 28.32 C ATOM 1772 CD1 TRP A 556 -0.160 -7.013 25.250 1.00 27.18 C ATOM 1773 CD2 TRP A 556 -0.650 -6.439 27.350 1.00 30.21 C ATOM 1774 NE1 TRP A 556 0.912 -7.353 26.032 1.00 26.91 N ATOM 1775 CE2 TRP A 556 0.649 -7.005 27.323 1.00 28.05 C ATOM 1776 CE3 TRP A 556 -1.172 -6.017 28.568 1.00 30.17 C ATOM 1777 CZ2 TRP A 556 1.422 -7.148 28.464 1.00 28.21 C ATOM 1778 CZ3 TRP A 556 -0.395 -6.162 29.700 1.00 29.03 C ATOM 1779 CH2 TRP A 556 0.886 -6.723 29.638 1.00 29.07 C ATOM 1780 HE1 TRP A 556 1.786 -7.804 25.695 1.00 0.00 H ATOM 1781 H TRP A 556 -4.518 -4.519 25.057 1.00 0.00 H ATOM 1782 N SER A 557 -2.250 -5.329 22.642 1.00 24.82 N ATOM 1783 CA SER A 557 -1.657 -5.491 21.336 1.00 25.73 C ATOM 1784 C SER A 557 -1.315 -4.199 20.667 1.00 24.99 C ATOM 1785 O SER A 557 -0.310 -4.099 20.015 1.00 24.90 O ATOM 1786 CB SER A 557 -2.598 -6.246 20.427 1.00 27.37 C ATOM 1787 OG SER A 557 -2.928 -7.494 20.974 1.00 32.61 O ATOM 1788 HG SER A 557 -2.104 -8.029 21.094 1.00 0.00 H ATOM 1789 H SER A 557 -3.207 -5.697 22.814 1.00 0.00 H ATOM 1790 N PHE A 558 -2.196 -3.224 20.776 1.00 27.18 N ATOM 1791 CA PHE A 558 -1.957 -1.899 20.231 1.00 27.18 C ATOM 1792 C PHE A 558 -0.671 -1.340 20.791 1.00 27.85 C ATOM 1793 O PHE A 558 0.097 -0.694 20.081 1.00 27.34 O ATOM 1794 CB PHE A 558 -3.129 -0.968 20.569 1.00 28.34 C ATOM 1795 CG PHE A 558 -2.963 0.394 20.009 1.00 30.30 C ATOM 1796 CD1 PHE A 558 -3.084 0.612 18.627 1.00 31.25 C ATOM 1797 CD2 PHE A 558 -2.619 1.447 20.829 1.00 30.77 C ATOM 1798 CE1 PHE A 558 -2.855 1.866 18.086 1.00 30.74 C ATOM 1799 CE2 PHE A 558 -2.412 2.710 20.300 1.00 32.16 C ATOM 1800 CZ PHE A 558 -2.531 2.917 18.925 1.00 32.69 C ATOM 1801 H PHE A 558 -3.093 -3.410 21.269 1.00 0.00 H ATOM 1802 N GLY A 559 -0.442 -1.604 22.081 1.00 29.85 N ATOM 1803 CA GLY A 559 0.798 -1.231 22.754 1.00 31.06 C ATOM 1804 C GLY A 559 2.021 -1.819 22.068 1.00 32.25 C ATOM 1805 O GLY A 559 2.991 -1.123 21.802 1.00 34.32 O ATOM 1806 H GLY A 559 -1.178 -2.095 22.628 1.00 0.00 H ATOM 1807 N VAL A 560 1.948 -3.105 21.756 1.00 34.67 N ATOM 1808 CA VAL A 560 3.017 -3.797 21.052 1.00 33.67 C ATOM 1809 C VAL A 560 3.118 -3.240 19.626 1.00 34.52 C ATOM 1810 O VAL A 560 4.223 -3.028 19.118 1.00 33.91 O ATOM 1811 CB VAL A 560 2.786 -5.317 21.056 1.00 34.75 C ATOM 1812 CG1 VAL A 560 3.944 -6.047 20.374 1.00 35.05 C ATOM 1813 CG2 VAL A 560 2.625 -5.830 22.491 1.00 35.74 C ATOM 1814 H VAL A 560 1.096 -3.639 22.024 1.00 0.00 H ATOM 1815 N LEU A 561 1.971 -2.970 18.997 1.00 35.43 N ATOM 1816 CA LEU A 561 1.934 -2.294 17.677 1.00 37.02 C ATOM 1817 C LEU A 561 2.568 -0.889 17.715 1.00 39.28 C ATOM 1818 O LEU A 561 3.234 -0.488 16.775 1.00 44.66 O ATOM 1819 CB LEU A 561 0.491 -2.189 17.177 1.00 36.97 C ATOM 1820 CG LEU A 561 0.150 -1.542 15.819 1.00 34.54 C ATOM 1821 CD1 LEU A 561 -1.118 -2.185 15.302 1.00 33.33 C ATOM 1822 CD2 LEU A 561 -0.054 -0.029 15.869 1.00 34.91 C ATOM 1823 H LEU A 561 1.074 -3.243 19.448 1.00 0.00 H ATOM 1824 N MET A 562 2.341 -0.136 18.785 1.00 38.56 N ATOM 1825 CA MET A 562 3.001 1.137 18.926 1.00 40.46 C ATOM 1826 C MET A 562 4.503 0.935 19.038 1.00 43.74 C ATOM 1827 O MET A 562 5.254 1.657 18.379 1.00 42.38 O ATOM 1828 CB MET A 562 2.482 1.935 20.120 1.00 41.98 C ATOM 1829 CG MET A 562 1.222 2.722 19.812 1.00 44.32 C ATOM 1830 SD MET A 562 0.898 3.909 21.125 1.00 48.41 S ATOM 1831 CE MET A 562 0.270 2.846 22.406 1.00 48.85 C ATOM 1832 H MET A 562 1.686 -0.466 19.522 1.00 0.00 H ATOM 1833 N TRP A 563 4.937 -0.035 19.856 1.00 45.25 N ATOM 1834 CA TRP A 563 6.377 -0.346 20.003 1.00 44.67 C ATOM 1835 C TRP A 563 7.033 -0.650 18.662 1.00 44.34 C ATOM 1836 O TRP A 563 8.018 -0.018 18.286 1.00 49.49 O ATOM 1837 CB TRP A 563 6.616 -1.516 20.957 1.00 43.99 C ATOM 1838 CG TRP A 563 8.071 -1.691 21.285 1.00 44.10 C ATOM 1839 CD1 TRP A 563 8.750 -1.121 22.325 1.00 45.22 C ATOM 1840 CD2 TRP A 563 9.025 -2.472 20.559 1.00 42.75 C ATOM 1841 NE1 TRP A 563 10.069 -1.520 22.307 1.00 45.52 N ATOM 1842 CE2 TRP A 563 10.269 -2.337 21.226 1.00 42.58 C ATOM 1843 CE3 TRP A 563 8.955 -3.269 19.407 1.00 41.46 C ATOM 1844 CZ2 TRP A 563 11.432 -2.965 20.779 1.00 39.17 C ATOM 1845 CZ3 TRP A 563 10.110 -3.909 18.971 1.00 41.80 C ATOM 1846 CH2 TRP A 563 11.335 -3.749 19.659 1.00 40.55 C ATOM 1847 HE1 TRP A 563 10.794 -1.246 23.001 1.00 0.00 H ATOM 1848 H TRP A 563 4.243 -0.584 20.402 1.00 0.00 H ATOM 1849 N GLU A 564 6.459 -1.615 17.957 1.00 46.54 N ATOM 1850 CA GLU A 564 6.827 -1.948 16.574 1.00 44.39 C ATOM 1851 C GLU A 564 6.960 -0.745 15.629 1.00 43.72 C ATOM 1852 O GLU A 564 7.879 -0.699 14.822 1.00 40.25 O ATOM 1853 CB GLU A 564 5.775 -2.884 15.997 1.00 42.48 C ATOM 1854 CG GLU A 564 5.885 -4.308 16.471 1.00 40.27 C ATOM 1855 CD GLU A 564 4.825 -5.174 15.856 1.00 40.33 C ATOM 1856 OE1 GLU A 564 3.692 -5.178 16.373 1.00 44.48 O ATOM 1857 OE2 GLU A 564 5.109 -5.841 14.850 1.00 39.92 O ATOM 1858 H GLU A 564 5.704 -2.169 18.409 1.00 0.00 H ATOM 1859 N ALA A 565 6.025 0.201 15.722 1.00 45.38 N ATOM 1860 CA ALA A 565 6.025 1.401 14.858 1.00 48.92 C ATOM 1861 C ALA A 565 7.234 2.324 15.090 1.00 47.28 C ATOM 1862 O ALA A 565 7.929 2.702 14.137 1.00 44.76 O ATOM 1863 CB ALA A 565 4.729 2.190 15.025 1.00 49.22 C ATOM 1864 H ALA A 565 5.269 0.091 16.427 1.00 0.00 H ATOM 1865 N PHE A 566 7.474 2.684 16.350 1.00 45.32 N ATOM 1866 CA PHE A 566 8.590 3.573 16.704 1.00 44.12 C ATOM 1867 C PHE A 566 9.958 2.863 16.675 1.00 46.42 C ATOM 1868 O PHE A 566 10.991 3.521 16.692 1.00 51.88 O ATOM 1869 CB PHE A 566 8.332 4.231 18.052 1.00 40.38 C ATOM 1870 CG PHE A 566 7.186 5.189 18.035 1.00 39.16 C ATOM 1871 CD1 PHE A 566 7.354 6.491 17.530 1.00 38.71 C ATOM 1872 CD2 PHE A 566 5.947 4.824 18.542 1.00 37.64 C ATOM 1873 CE1 PHE A 566 6.304 7.387 17.514 1.00 36.65 C ATOM 1874 CE2 PHE A 566 4.881 5.719 18.535 1.00 37.84 C ATOM 1875 CZ PHE A 566 5.059 7.000 18.021 1.00 40.69 C ATOM 1876 H PHE A 566 6.854 2.326 17.105 1.00 0.00 H ATOM 1877 N SER A 567 9.954 1.528 16.636 1.00 50.42 N ATOM 1878 CA SER A 567 11.128 0.729 16.286 1.00 48.75 C ATOM 1879 C SER A 567 11.176 0.398 14.778 1.00 48.55 C ATOM 1880 O SER A 567 11.670 -0.657 14.398 1.00 48.04 O ATOM 1881 CB SER A 567 11.137 -0.567 17.100 1.00 51.53 C ATOM 1882 OG SER A 567 11.064 -0.308 18.497 1.00 53.77 O ATOM 1883 HG SER A 567 10.227 0.182 18.697 1.00 0.00 H ATOM 1884 H SER A 567 9.070 1.031 16.866 1.00 0.00 H ATOM 1885 N TYR A 568 10.657 1.305 13.942 1.00 46.76 N ATOM 1886 CA TYR A 568 10.665 1.230 12.479 1.00 46.47 C ATOM 1887 C TYR A 568 10.520 -0.167 11.886 1.00 46.14 C ATOM 1888 O TYR A 568 11.210 -0.521 10.948 1.00 51.18 O ATOM 1889 CB TYR A 568 11.889 2.009 11.921 1.00 48.65 C ATOM 1890 CG TYR A 568 11.735 3.509 12.116 1.00 47.47 C ATOM 1891 CD1 TYR A 568 11.146 4.308 11.135 1.00 48.99 C ATOM 1892 CD2 TYR A 568 12.112 4.110 13.300 1.00 49.55 C ATOM 1893 CE1 TYR A 568 10.960 5.668 11.322 1.00 49.07 C ATOM 1894 CE2 TYR A 568 11.934 5.472 13.506 1.00 52.51 C ATOM 1895 CZ TYR A 568 11.363 6.253 12.514 1.00 53.41 C ATOM 1896 OH TYR A 568 11.201 7.609 12.753 1.00 54.39 O ATOM 1897 HH TYR A 568 10.784 8.035 11.962 1.00 0.00 H ATOM 1898 H TYR A 568 10.207 2.139 14.370 1.00 0.00 H ATOM 1899 N GLY A 569 9.606 -0.956 12.445 1.00 48.07 N ATOM 1900 CA GLY A 569 9.285 -2.291 11.930 1.00 45.44 C ATOM 1901 C GLY A 569 10.048 -3.424 12.576 1.00 47.27 C ATOM 1902 O GLY A 569 9.977 -4.573 12.125 1.00 44.96 O ATOM 1903 H GLY A 569 9.097 -0.611 13.284 1.00 0.00 H ATOM 1904 N GLN A 570 10.764 -3.123 13.647 1.00 50.78 N ATOM 1905 CA GLN A 570 11.434 -4.163 14.409 1.00 58.73 C ATOM 1906 C GLN A 570 10.414 -5.143 15.043 1.00 58.46 C ATOM 1907 O GLN A 570 9.305 -4.756 15.450 1.00 59.52 O ATOM 1908 CB GLN A 570 12.339 -3.541 15.491 1.00 63.53 C ATOM 1909 CG GLN A 570 13.456 -4.456 15.994 1.00 70.24 C ATOM 1910 CD GLN A 570 14.230 -5.108 14.860 1.00 71.97 C ATOM 1911 OE1 GLN A 570 14.307 -6.335 14.787 1.00 78.64 O ATOM 1912 NE2 GLN A 570 14.765 -4.290 13.940 1.00 71.74 N ATOM 1913 HE22 GLN A 570 14.674 -3.259 14.045 1.00 0.00 H ATOM 1914 HE21 GLN A 570 15.271 -4.687 13.122 1.00 0.00 H ATOM 1915 H GLN A 570 10.848 -2.131 13.947 1.00 0.00 H ATOM 1916 N LYS A 571 10.796 -6.409 15.119 1.00 53.74 N ATOM 1917 CA LYS A 571 9.956 -7.418 15.732 1.00 54.48 C ATOM 1918 C LYS A 571 10.004 -7.247 17.252 1.00 55.77 C ATOM 1919 O LYS A 571 11.029 -6.812 17.797 1.00 57.10 O ATOM 1920 CB LYS A 571 10.427 -8.808 15.328 1.00 59.20 C ATOM 1921 CG LYS A 571 10.299 -9.053 13.829 1.00 64.36 C ATOM 1922 CD LYS A 571 10.840 -10.423 13.431 1.00 69.55 C ATOM 1923 CE LYS A 571 10.755 -10.637 11.923 1.00 70.16 C ATOM 1924 NZ LYS A 571 11.264 -11.994 11.556 1.00 77.22 N ATOM 1925 HZ1 LYS A 571 12.256 -12.083 11.855 1.00 0.00 H ATOM 1926 HZ2 LYS A 571 10.691 -12.719 12.033 1.00 0.00 H ATOM 1927 HZ3 LYS A 571 11.198 -12.121 10.526 1.00 0.00 H ATOM 1928 H LYS A 571 11.720 -6.685 14.730 1.00 0.00 H ATOM 1929 N PRO A 572 8.888 -7.542 17.940 1.00 49.80 N ATOM 1930 CA PRO A 572 8.888 -7.355 19.383 1.00 45.98 C ATOM 1931 C PRO A 572 9.558 -8.493 20.091 1.00 42.69 C ATOM 1932 O PRO A 572 9.681 -9.576 19.537 1.00 49.38 O ATOM 1933 CB PRO A 572 7.396 -7.278 19.733 1.00 46.34 C ATOM 1934 CG PRO A 572 6.719 -8.019 18.644 1.00 46.74 C ATOM 1935 CD PRO A 572 7.529 -7.771 17.415 1.00 48.48 C ATOM 1936 N TYR A 573 9.970 -8.250 21.325 1.00 40.60 N ATOM 1937 CA TYR A 573 10.690 -9.247 22.127 1.00 42.29 C ATOM 1938 C TYR A 573 11.681 -10.132 21.330 1.00 42.81 C ATOM 1939 O TYR A 573 11.638 -11.350 21.428 1.00 41.44 O ATOM 1940 CB TYR A 573 9.691 -10.146 22.853 1.00 41.80 C ATOM 1941 CG TYR A 573 8.591 -9.441 23.627 1.00 39.82 C ATOM 1942 CD1 TYR A 573 7.337 -9.224 23.043 1.00 39.22 C ATOM 1943 CD2 TYR A 573 8.778 -9.051 24.957 1.00 39.11 C ATOM 1944 CE1 TYR A 573 6.315 -8.606 23.747 1.00 39.79 C ATOM 1945 CE2 TYR A 573 7.749 -8.433 25.679 1.00 39.11 C ATOM 1946 CZ TYR A 573 6.524 -8.209 25.065 1.00 38.50 C ATOM 1947 OH TYR A 573 5.511 -7.612 25.773 1.00 36.95 O ATOM 1948 HH TYR A 573 4.712 -7.526 25.195 1.00 0.00 H ATOM 1949 H TYR A 573 9.776 -7.317 21.742 1.00 0.00 H ATOM 1950 N ARG A 574 12.578 -9.505 20.567 1.00 47.29 N ATOM 1951 CA ARG A 574 13.458 -10.221 19.612 1.00 49.35 C ATOM 1952 C ARG A 574 14.267 -11.353 20.263 1.00 47.04 C ATOM 1953 O ARG A 574 14.845 -11.177 21.338 1.00 46.52 O ATOM 1954 CB ARG A 574 14.403 -9.238 18.906 1.00 53.01 C ATOM 1955 CG ARG A 574 15.245 -9.854 17.793 1.00 58.70 C ATOM 1956 CD ARG A 574 16.255 -8.868 17.216 1.00 61.49 C ATOM 1957 NE ARG A 574 17.203 -8.372 18.222 1.00 59.81 N ATOM 1958 CZ ARG A 574 18.045 -7.358 18.036 1.00 59.11 C ATOM 1959 NH1 ARG A 574 18.840 -6.980 19.026 1.00 58.96 N ATOM 1960 NH2 ARG A 574 18.102 -6.716 16.870 1.00 62.69 N ATOM 1961 HE ARG A 574 17.218 -8.848 19.147 1.00 0.00 H ATOM 1962 HH12 ARG A 574 19.501 -6.189 18.889 1.00 0.00 H ATOM 1963 HH11 ARG A 574 18.803 -7.475 19.940 1.00 0.00 H ATOM 1964 HH22 ARG A 574 18.766 -5.926 16.743 1.00 0.00 H ATOM 1965 HH21 ARG A 574 17.482 -7.005 16.086 1.00 0.00 H ATOM 1966 H ARG A 574 12.664 -8.471 20.645 1.00 0.00 H ATOM 1967 N GLY A 575 14.257 -12.518 19.623 1.00 49.65 N ATOM 1968 CA GLY A 575 15.047 -13.678 20.064 1.00 54.69 C ATOM 1969 C GLY A 575 14.501 -14.578 21.162 1.00 55.97 C ATOM 1970 O GLY A 575 15.108 -15.615 21.446 1.00 58.27 O ATOM 1971 H GLY A 575 13.665 -12.614 18.773 1.00 0.00 H ATOM 1972 N MET A 576 13.363 -14.213 21.766 1.00 57.27 N ATOM 1973 CA MET A 576 12.787 -14.967 22.902 1.00 55.47 C ATOM 1974 C MET A 576 11.703 -15.944 22.462 1.00 51.67 C ATOM 1975 O MET A 576 11.118 -15.800 21.389 1.00 54.63 O ATOM 1976 CB MET A 576 12.197 -14.003 23.928 1.00 53.50 C ATOM 1977 CG MET A 576 13.204 -13.000 24.465 1.00 53.09 C ATOM 1978 SD MET A 576 12.424 -11.692 25.420 1.00 47.38 S ATOM 1979 CE MET A 576 11.676 -12.635 26.731 1.00 46.55 C ATOM 1980 H MET A 576 12.865 -13.367 21.424 1.00 0.00 H ATOM 1981 N LYS A 577 11.452 -16.942 23.293 1.00 52.59 N ATOM 1982 CA LYS A 577 10.332 -17.867 23.102 1.00 55.90 C ATOM 1983 C LYS A 577 9.107 -17.268 23.794 1.00 55.33 C ATOM 1984 O LYS A 577 9.226 -16.752 24.912 1.00 55.30 O ATOM 1985 CB LYS A 577 10.643 -19.234 23.732 1.00 60.95 C ATOM 1986 CG LYS A 577 11.860 -19.968 23.177 1.00 63.90 C ATOM 1987 CD LYS A 577 12.167 -21.206 24.022 1.00 66.89 C ATOM 1988 CE LYS A 577 13.267 -22.070 23.412 1.00 69.40 C ATOM 1989 NZ LYS A 577 13.056 -23.516 23.712 1.00 71.47 N ATOM 1990 HZ1 LYS A 577 13.058 -23.659 24.742 1.00 0.00 H ATOM 1991 HZ2 LYS A 577 12.142 -23.820 23.320 1.00 0.00 H ATOM 1992 HZ3 LYS A 577 13.822 -24.073 23.282 1.00 0.00 H ATOM 1993 H LYS A 577 12.075 -17.075 24.115 1.00 0.00 H ATOM 1994 N GLY A 578 7.934 -17.367 23.166 1.00 50.60 N ATOM 1995 CA GLY A 578 6.679 -16.848 23.745 1.00 50.26 C ATOM 1996 C GLY A 578 6.487 -17.127 25.230 1.00 48.99 C ATOM 1997 O GLY A 578 5.910 -16.323 25.959 1.00 49.00 O ATOM 1998 H GLY A 578 7.903 -17.827 22.234 1.00 0.00 H ATOM 1999 N SER A 579 6.981 -18.276 25.672 1.00 48.33 N ATOM 2000 CA SER A 579 7.007 -18.650 27.088 1.00 45.56 C ATOM 2001 C SER A 579 7.902 -17.759 27.949 1.00 43.52 C ATOM 2002 O SER A 579 7.620 -17.514 29.120 1.00 47.30 O ATOM 2003 CB SER A 579 7.520 -20.083 27.195 1.00 44.13 C ATOM 2004 OG SER A 579 8.709 -20.235 26.416 1.00 43.87 O ATOM 2005 HG SER A 579 9.035 -21.167 26.491 1.00 0.00 H ATOM 2006 H SER A 579 7.370 -18.946 24.978 1.00 0.00 H ATOM 2007 N GLU A 580 9.026 -17.342 27.397 1.00 42.78 N ATOM 2008 CA GLU A 580 9.942 -16.484 28.123 1.00 43.80 C ATOM 2009 C GLU A 580 9.330 -15.101 28.238 1.00 45.18 C ATOM 2010 O GLU A 580 9.386 -14.470 29.298 1.00 47.86 O ATOM 2011 CB GLU A 580 11.302 -16.442 27.426 1.00 42.77 C ATOM 2012 CG GLU A 580 12.078 -17.743 27.601 1.00 41.09 C ATOM 2013 CD GLU A 580 13.118 -17.987 26.536 1.00 42.31 C ATOM 2014 OE1 GLU A 580 13.003 -17.452 25.408 1.00 40.43 O ATOM 2015 OE2 GLU A 580 14.062 -18.746 26.827 1.00 46.73 O ATOM 2016 H GLU A 580 9.258 -17.633 26.426 1.00 0.00 H ATOM 2017 N VAL A 581 8.727 -14.663 27.135 1.00 42.35 N ATOM 2018 CA VAL A 581 8.002 -13.416 27.074 1.00 39.47 C ATOM 2019 C VAL A 581 6.938 -13.356 28.183 1.00 40.72 C ATOM 2020 O VAL A 581 6.800 -12.317 28.866 1.00 35.42 O ATOM 2021 CB VAL A 581 7.400 -13.219 25.674 1.00 40.11 C ATOM 2022 CG1 VAL A 581 6.336 -12.115 25.654 1.00 42.07 C ATOM 2023 CG2 VAL A 581 8.517 -12.904 24.693 1.00 40.53 C ATOM 2024 H VAL A 581 8.781 -15.247 26.276 1.00 0.00 H ATOM 2025 N THR A 582 6.228 -14.470 28.371 1.00 38.18 N ATOM 2026 CA THR A 582 5.196 -14.562 29.397 1.00 40.17 C ATOM 2027 C THR A 582 5.812 -14.534 30.801 1.00 45.66 C ATOM 2028 O THR A 582 5.256 -13.914 31.727 1.00 48.73 O ATOM 2029 CB THR A 582 4.295 -15.801 29.176 1.00 35.87 C ATOM 2030 OG1 THR A 582 3.487 -15.584 28.008 1.00 37.69 O ATOM 2031 CG2 THR A 582 3.380 -16.084 30.361 1.00 33.60 C ATOM 2032 HG1 THR A 582 4.074 -15.451 27.222 1.00 0.00 H ATOM 2033 H THR A 582 6.416 -15.296 27.768 1.00 0.00 H ATOM 2034 N ALA A 583 6.953 -15.195 30.961 1.00 44.69 N ATOM 2035 CA ALA A 583 7.657 -15.154 32.240 1.00 45.17 C ATOM 2036 C ALA A 583 8.116 -13.721 32.548 1.00 42.39 C ATOM 2037 O ALA A 583 7.974 -13.238 33.666 1.00 45.13 O ATOM 2038 CB ALA A 583 8.837 -16.117 32.238 1.00 46.17 C ATOM 2039 H ALA A 583 7.347 -15.745 30.171 1.00 0.00 H ATOM 2040 N MET A 584 8.648 -13.054 31.540 1.00 38.66 N ATOM 2041 CA MET A 584 9.124 -11.680 31.663 1.00 40.88 C ATOM 2042 C MET A 584 8.027 -10.709 32.128 1.00 41.46 C ATOM 2043 O MET A 584 8.249 -9.913 33.039 1.00 44.72 O ATOM 2044 CB MET A 584 9.679 -11.238 30.314 1.00 41.30 C ATOM 2045 CG MET A 584 10.188 -9.824 30.267 1.00 43.56 C ATOM 2046 SD MET A 584 10.609 -9.426 28.581 1.00 45.31 S ATOM 2047 CE MET A 584 10.664 -7.651 28.747 1.00 43.05 C ATOM 2048 H MET A 584 8.731 -13.529 30.618 1.00 0.00 H ATOM 2049 N LEU A 585 6.849 -10.806 31.519 1.00 39.01 N ATOM 2050 CA LEU A 585 5.745 -9.884 31.814 1.00 38.98 C ATOM 2051 C LEU A 585 5.245 -10.011 33.238 1.00 39.51 C ATOM 2052 O LEU A 585 5.016 -9.001 33.909 1.00 41.13 O ATOM 2053 CB LEU A 585 4.564 -10.078 30.852 1.00 33.42 C ATOM 2054 CG LEU A 585 4.855 -9.765 29.399 1.00 31.42 C ATOM 2055 CD1 LEU A 585 3.651 -10.122 28.559 1.00 31.72 C ATOM 2056 CD2 LEU A 585 5.222 -8.318 29.187 1.00 32.24 C ATOM 2057 H LEU A 585 6.705 -11.556 30.813 1.00 0.00 H ATOM 2058 N GLU A 586 5.089 -11.246 33.685 1.00 41.86 N ATOM 2059 CA GLU A 586 4.702 -11.537 35.068 1.00 45.10 C ATOM 2060 C GLU A 586 5.787 -11.215 36.094 1.00 43.35 C ATOM 2061 O GLU A 586 5.511 -11.227 37.274 1.00 52.73 O ATOM 2062 CB GLU A 586 4.267 -13.005 35.228 1.00 49.82 C ATOM 2063 CG GLU A 586 2.798 -13.155 35.566 1.00 54.58 C ATOM 2064 CD GLU A 586 2.401 -14.601 35.641 1.00 62.57 C ATOM 2065 OE1 GLU A 586 2.234 -15.198 34.554 1.00 64.88 O ATOM 2066 OE2 GLU A 586 2.275 -15.130 36.775 1.00 64.58 O ATOM 2067 H GLU A 586 5.247 -12.039 33.031 1.00 0.00 H ATOM 2068 N LYS A 587 7.013 -10.954 35.666 1.00 39.11 N ATOM 2069 CA LYS A 587 7.998 -10.373 36.567 1.00 42.95 C ATOM 2070 C LYS A 587 7.826 -8.840 36.691 1.00 41.42 C ATOM 2071 O LYS A 587 8.479 -8.228 37.524 1.00 35.70 O ATOM 2072 CB LYS A 587 9.437 -10.732 36.138 1.00 44.98 C ATOM 2073 CG LYS A 587 9.775 -12.207 36.366 1.00 49.48 C ATOM 2074 CD LYS A 587 11.236 -12.557 36.112 1.00 53.57 C ATOM 2075 CE LYS A 587 11.623 -12.396 34.652 1.00 58.48 C ATOM 2076 NZ LYS A 587 13.007 -12.875 34.419 1.00 64.22 N ATOM 2077 HZ1 LYS A 587 13.667 -12.324 35.004 1.00 0.00 H ATOM 2078 HZ2 LYS A 587 13.072 -13.881 34.675 1.00 0.00 H ATOM 2079 HZ3 LYS A 587 13.250 -12.755 33.415 1.00 0.00 H ATOM 2080 H LYS A 587 7.273 -11.165 34.681 1.00 0.00 H ATOM 2081 N GLY A 588 6.937 -8.241 35.890 1.00 38.17 N ATOM 2082 CA GLY A 588 6.745 -6.811 35.871 1.00 36.59 C ATOM 2083 C GLY A 588 7.586 -6.142 34.814 1.00 35.76 C ATOM 2084 O GLY A 588 7.672 -4.931 34.765 1.00 34.91 O ATOM 2085 H GLY A 588 6.361 -8.830 35.255 1.00 0.00 H ATOM 2086 N GLU A 589 8.191 -6.904 33.930 1.00 35.86 N ATOM 2087 CA GLU A 589 9.124 -6.299 33.012 1.00 37.00 C ATOM 2088 C GLU A 589 8.440 -6.054 31.668 1.00 35.85 C ATOM 2089 O GLU A 589 7.468 -6.718 31.330 1.00 34.16 O ATOM 2090 CB GLU A 589 10.396 -7.135 32.899 1.00 40.21 C ATOM 2091 CG GLU A 589 11.211 -7.210 34.195 1.00 40.48 C ATOM 2092 CD GLU A 589 12.332 -8.264 34.148 1.00 43.95 C ATOM 2093 OE1 GLU A 589 12.626 -8.810 33.065 1.00 41.65 O ATOM 2094 OE2 GLU A 589 12.952 -8.530 35.210 1.00 43.81 O ATOM 2095 H GLU A 589 8.000 -7.926 33.893 1.00 0.00 H ATOM 2096 N ARG A 590 8.920 -5.028 30.965 1.00 35.99 N ATOM 2097 CA ARG A 590 8.419 -4.598 29.667 1.00 35.79 C ATOM 2098 C ARG A 590 9.612 -4.241 28.759 1.00 37.92 C ATOM 2099 O ARG A 590 10.758 -4.200 29.218 1.00 39.58 O ATOM 2100 CB ARG A 590 7.508 -3.369 29.843 1.00 33.84 C ATOM 2101 CG ARG A 590 6.344 -3.557 30.824 1.00 32.61 C ATOM 2102 CD ARG A 590 5.286 -4.505 30.267 1.00 31.69 C ATOM 2103 NE ARG A 590 4.072 -4.563 31.081 1.00 30.12 N ATOM 2104 CZ ARG A 590 3.879 -5.341 32.139 1.00 29.77 C ATOM 2105 NH1 ARG A 590 4.819 -6.185 32.536 1.00 32.92 N ATOM 2106 NH2 ARG A 590 2.707 -5.305 32.782 1.00 27.76 N ATOM 2107 HE ARG A 590 3.288 -3.937 30.806 1.00 0.00 H ATOM 2108 HH12 ARG A 590 4.658 -6.790 33.366 1.00 0.00 H ATOM 2109 HH11 ARG A 590 5.719 -6.243 32.018 1.00 0.00 H ATOM 2110 HH22 ARG A 590 2.550 -5.912 33.612 1.00 0.00 H ATOM 2111 HH21 ARG A 590 1.952 -4.670 32.453 1.00 0.00 H ATOM 2112 H ARG A 590 9.713 -4.494 31.375 1.00 0.00 H ATOM 2113 N MET A 591 9.326 -3.992 27.482 1.00 40.88 N ATOM 2114 CA MET A 591 10.333 -3.629 26.488 1.00 39.33 C ATOM 2115 C MET A 591 10.750 -2.181 26.729 1.00 45.03 C ATOM 2116 O MET A 591 9.969 -1.350 27.212 1.00 48.02 O ATOM 2117 CB MET A 591 9.790 -3.781 25.055 1.00 38.10 C ATOM 2118 CG MET A 591 9.241 -5.158 24.687 1.00 37.21 C ATOM 2119 SD MET A 591 8.819 -5.406 22.936 1.00 37.88 S ATOM 2120 CE MET A 591 7.131 -4.807 22.830 1.00 38.43 C ATOM 2121 H MET A 591 8.334 -4.060 27.177 1.00 0.00 H ATOM 2122 N GLY A 592 11.995 -1.877 26.396 1.00 47.32 N ATOM 2123 CA GLY A 592 12.512 -0.535 26.551 1.00 45.88 C ATOM 2124 C GLY A 592 11.968 0.401 25.502 1.00 49.33 C ATOM 2125 O GLY A 592 11.308 -0.030 24.529 1.00 49.16 O ATOM 2126 H GLY A 592 12.615 -2.620 26.014 1.00 0.00 H ATOM 2127 N CYS A 593 12.240 1.686 25.724 1.00 51.32 N ATOM 2128 CA CYS A 593 11.924 2.740 24.779 1.00 53.42 C ATOM 2129 C CYS A 593 12.699 2.511 23.479 1.00 54.20 C ATOM 2130 O CYS A 593 13.871 2.141 23.516 1.00 56.51 O ATOM 2131 CB CYS A 593 12.268 4.094 25.365 1.00 56.33 C ATOM 2132 SG CYS A 593 11.589 5.453 24.419 1.00 65.52 S ATOM 2133 H CYS A 593 12.702 1.946 26.619 1.00 0.00 H ATOM 2134 N PRO A 594 12.015 2.618 22.328 1.00 53.95 N ATOM 2135 CA PRO A 594 12.676 2.643 21.024 1.00 52.50 C ATOM 2136 C PRO A 594 13.350 3.963 20.715 1.00 48.22 C ATOM 2137 O PRO A 594 12.744 5.009 20.872 1.00 55.75 O ATOM 2138 CB PRO A 594 11.511 2.452 20.049 1.00 51.00 C ATOM 2139 CG PRO A 594 10.540 1.654 20.833 1.00 53.98 C ATOM 2140 CD PRO A 594 10.583 2.295 22.177 1.00 53.18 C ATOM 2141 N ALA A 595 14.574 3.913 20.216 1.00 46.32 N ATOM 2142 CA ALA A 595 15.304 5.133 19.862 1.00 44.45 C ATOM 2143 C ALA A 595 14.432 6.132 19.105 1.00 45.07 C ATOM 2144 O ALA A 595 13.795 5.790 18.114 1.00 52.63 O ATOM 2145 CB ALA A 595 16.497 4.787 19.014 1.00 39.40 C ATOM 2146 H ALA A 595 15.028 2.988 20.072 1.00 0.00 H ATOM 2147 N GLY A 596 14.407 7.361 19.577 1.00 43.90 N ATOM 2148 CA GLY A 596 13.696 8.432 18.900 1.00 49.56 C ATOM 2149 C GLY A 596 12.250 8.576 19.310 1.00 57.35 C ATOM 2150 O GLY A 596 11.544 9.416 18.769 1.00 62.88 O ATOM 2151 H GLY A 596 14.912 7.572 20.462 1.00 0.00 H ATOM 2152 N CYS A 597 11.813 7.796 20.291 1.00 58.29 N ATOM 2153 CA CYS A 597 10.407 7.696 20.595 1.00 58.36 C ATOM 2154 C CYS A 597 9.972 8.757 21.606 1.00 56.75 C ATOM 2155 O CYS A 597 10.427 8.730 22.746 1.00 59.03 O ATOM 2156 CB CYS A 597 10.140 6.311 21.146 1.00 59.68 C ATOM 2157 SG CYS A 597 8.425 5.970 21.506 1.00 62.92 S ATOM 2158 H CYS A 597 12.497 7.247 20.850 1.00 0.00 H ATOM 2159 N PRO A 598 9.080 9.688 21.204 1.00 56.05 N ATOM 2160 CA PRO A 598 8.572 10.672 22.165 1.00 58.37 C ATOM 2161 C PRO A 598 8.166 9.997 23.477 1.00 63.72 C ATOM 2162 O PRO A 598 7.372 9.055 23.464 1.00 68.09 O ATOM 2163 CB PRO A 598 7.342 11.262 21.458 1.00 53.38 C ATOM 2164 CG PRO A 598 7.609 11.074 20.018 1.00 52.46 C ATOM 2165 CD PRO A 598 8.421 9.822 19.891 1.00 55.42 C ATOM 2166 N ARG A 599 8.718 10.458 24.593 1.00 62.47 N ATOM 2167 CA ARG A 599 8.471 9.810 25.884 1.00 64.01 C ATOM 2168 C ARG A 599 6.983 9.571 26.149 1.00 58.58 C ATOM 2169 O ARG A 599 6.610 8.574 26.742 1.00 56.25 O ATOM 2170 CB ARG A 599 9.051 10.652 27.030 1.00 69.69 C ATOM 2171 CG ARG A 599 9.220 9.911 28.363 1.00 70.89 C ATOM 2172 CD ARG A 599 10.063 8.630 28.284 1.00 68.85 C ATOM 2173 NE ARG A 599 11.255 8.743 27.429 1.00 67.19 N ATOM 2174 CZ ARG A 599 12.238 7.836 27.332 1.00 68.56 C ATOM 2175 NH1 ARG A 599 13.268 8.065 26.504 1.00 69.28 N ATOM 2176 NH2 ARG A 599 12.217 6.710 28.045 1.00 64.81 N ATOM 2177 HE ARG A 599 11.343 9.602 26.849 1.00 0.00 H ATOM 2178 HH12 ARG A 599 14.035 7.367 26.422 1.00 0.00 H ATOM 2179 HH11 ARG A 599 13.300 8.940 25.944 1.00 0.00 H ATOM 2180 HH22 ARG A 599 12.991 6.022 27.953 1.00 0.00 H ATOM 2181 HH21 ARG A 599 11.427 6.520 28.694 1.00 0.00 H ATOM 2182 H ARG A 599 9.336 11.293 24.550 1.00 0.00 H ATOM 2183 N GLU A 600 6.152 10.500 25.696 1.00 58.66 N ATOM 2184 CA GLU A 600 4.702 10.463 25.910 1.00 61.77 C ATOM 2185 C GLU A 600 4.053 9.238 25.255 1.00 56.27 C ATOM 2186 O GLU A 600 3.107 8.648 25.802 1.00 51.06 O ATOM 2187 CB GLU A 600 4.068 11.741 25.352 1.00 66.82 C ATOM 2188 CG GLU A 600 4.426 13.012 26.127 1.00 71.40 C ATOM 2189 CD GLU A 600 5.683 13.729 25.635 1.00 74.57 C ATOM 2190 OE1 GLU A 600 6.420 13.215 24.754 1.00 81.17 O ATOM 2191 OE2 GLU A 600 5.934 14.837 26.142 1.00 74.57 O ATOM 2192 H GLU A 600 6.550 11.298 25.160 1.00 0.00 H ATOM 2193 N MET A 601 4.589 8.874 24.092 1.00 50.34 N ATOM 2194 CA MET A 601 4.185 7.678 23.360 1.00 47.87 C ATOM 2195 C MET A 601 4.679 6.419 24.063 1.00 47.07 C ATOM 2196 O MET A 601 3.938 5.457 24.167 1.00 46.67 O ATOM 2197 CB MET A 601 4.709 7.730 21.917 1.00 46.90 C ATOM 2198 CG MET A 601 4.173 8.913 21.104 1.00 46.09 C ATOM 2199 SD MET A 601 2.444 8.715 20.680 1.00 48.53 S ATOM 2200 CE MET A 601 1.561 9.444 22.048 1.00 48.95 C ATOM 2201 H MET A 601 5.335 9.473 23.684 1.00 0.00 H ATOM 2202 N TYR A 602 5.920 6.424 24.550 1.00 47.08 N ATOM 2203 CA TYR A 602 6.413 5.308 25.358 1.00 49.32 C ATOM 2204 C TYR A 602 5.631 5.139 26.682 1.00 47.94 C ATOM 2205 O TYR A 602 5.385 4.013 27.117 1.00 47.02 O ATOM 2206 CB TYR A 602 7.916 5.398 25.636 1.00 49.36 C ATOM 2207 CG TYR A 602 8.384 4.219 26.464 1.00 51.63 C ATOM 2208 CD1 TYR A 602 8.267 2.915 25.966 1.00 52.83 C ATOM 2209 CD2 TYR A 602 8.891 4.383 27.759 1.00 49.95 C ATOM 2210 CE1 TYR A 602 8.651 1.809 26.714 1.00 51.48 C ATOM 2211 CE2 TYR A 602 9.288 3.280 28.514 1.00 48.86 C ATOM 2212 CZ TYR A 602 9.168 1.989 27.986 1.00 50.22 C ATOM 2213 OH TYR A 602 9.532 0.863 28.715 1.00 46.88 O ATOM 2214 HH TYR A 602 9.372 0.052 28.170 1.00 0.00 H ATOM 2215 H TYR A 602 6.546 7.231 24.353 1.00 0.00 H ATOM 2216 N ASP A 603 5.228 6.250 27.296 1.00 46.89 N ATOM 2217 CA ASP A 603 4.347 6.208 28.472 1.00 46.58 C ATOM 2218 C ASP A 603 3.008 5.539 28.153 1.00 44.69 C ATOM 2219 O ASP A 603 2.422 4.849 28.995 1.00 42.62 O ATOM 2220 CB ASP A 603 4.074 7.618 29.006 1.00 47.95 C ATOM 2221 CG ASP A 603 5.332 8.312 29.535 1.00 52.14 C ATOM 2222 OD1 ASP A 603 6.416 7.673 29.597 1.00 46.12 O ATOM 2223 OD2 ASP A 603 5.215 9.517 29.869 1.00 53.45 O ATOM 2224 H ASP A 603 5.545 7.172 26.934 1.00 0.00 H ATOM 2225 N LEU A 604 2.520 5.774 26.938 1.00 40.85 N ATOM 2226 CA LEU A 604 1.247 5.229 26.504 1.00 39.77 C ATOM 2227 C LEU A 604 1.361 3.715 26.288 1.00 40.48 C ATOM 2228 O LEU A 604 0.517 2.981 26.781 1.00 38.05 O ATOM 2229 CB LEU A 604 0.795 5.940 25.229 1.00 39.77 C ATOM 2230 CG LEU A 604 -0.597 5.606 24.717 1.00 39.77 C ATOM 2231 CD1 LEU A 604 -1.658 5.947 25.750 1.00 40.89 C ATOM 2232 CD2 LEU A 604 -0.821 6.343 23.392 1.00 41.09 C ATOM 2233 H LEU A 604 3.067 6.365 26.280 1.00 0.00 H ATOM 2234 N MET A 605 2.424 3.273 25.592 1.00 38.77 N ATOM 2235 CA MET A 605 2.802 1.855 25.476 1.00 39.60 C ATOM 2236 C MET A 605 2.683 1.135 26.800 1.00 40.56 C ATOM 2237 O MET A 605 2.049 0.057 26.870 1.00 37.38 O ATOM 2238 CB MET A 605 4.240 1.681 24.980 1.00 41.63 C ATOM 2239 CG MET A 605 4.463 2.055 23.534 1.00 40.97 C ATOM 2240 SD MET A 605 6.176 1.838 23.034 1.00 40.50 S ATOM 2241 CE MET A 605 6.199 2.954 21.631 1.00 41.80 C ATOM 2242 H MET A 605 3.015 3.977 25.106 1.00 0.00 H ATOM 2243 N ASN A 606 3.268 1.752 27.837 1.00 39.51 N ATOM 2244 CA ASN A 606 3.205 1.227 29.218 1.00 40.23 C ATOM 2245 C ASN A 606 1.883 1.335 29.923 1.00 38.68 C ATOM 2246 O ASN A 606 1.628 0.532 30.788 1.00 41.05 O ATOM 2247 CB ASN A 606 4.265 1.868 30.132 1.00 43.35 C ATOM 2248 CG ASN A 606 5.565 1.108 30.120 1.00 43.32 C ATOM 2249 OD1 ASN A 606 5.601 -0.095 30.380 1.00 46.28 O ATOM 2250 ND2 ASN A 606 6.631 1.790 29.807 1.00 46.82 N ATOM 2251 HD22 ASN A 606 6.555 2.805 29.595 1.00 0.00 H ATOM 2252 HD21 ASN A 606 7.557 1.319 29.770 1.00 0.00 H ATOM 2253 H ASN A 606 3.787 2.636 27.663 1.00 0.00 H ATOM 2254 N LEU A 607 1.051 2.328 29.610 1.00 39.56 N ATOM 2255 CA LEU A 607 -0.308 2.324 30.142 1.00 37.39 C ATOM 2256 C LEU A 607 -1.076 1.216 29.452 1.00 34.93 C ATOM 2257 O LEU A 607 -1.848 0.489 30.102 1.00 34.09 O ATOM 2258 CB LEU A 607 -0.992 3.683 29.977 1.00 42.88 C ATOM 2259 CG LEU A 607 -2.308 3.879 30.749 1.00 47.07 C ATOM 2260 CD1 LEU A 607 -2.150 3.768 32.267 1.00 47.90 C ATOM 2261 CD2 LEU A 607 -2.994 5.198 30.392 1.00 46.93 C ATOM 2262 H LEU A 607 1.368 3.101 28.991 1.00 0.00 H ATOM 2263 N CYS A 608 -0.847 1.069 28.142 1.00 34.84 N ATOM 2264 CA CYS A 608 -1.403 -0.055 27.354 1.00 34.58 C ATOM 2265 C CYS A 608 -0.996 -1.443 27.887 1.00 32.01 C ATOM 2266 O CYS A 608 -1.789 -2.364 27.800 1.00 29.79 O ATOM 2267 CB CYS A 608 -1.031 0.055 25.869 1.00 37.68 C ATOM 2268 SG CYS A 608 -1.902 1.332 24.899 1.00 38.77 S ATOM 2269 H CYS A 608 -0.254 1.773 27.657 1.00 0.00 H ATOM 2270 N TRP A 609 0.220 -1.566 28.437 1.00 29.33 N ATOM 2271 CA TRP A 609 0.714 -2.814 29.044 1.00 29.54 C ATOM 2272 C TRP A 609 0.477 -2.952 30.564 1.00 33.05 C ATOM 2273 O TRP A 609 1.206 -3.680 31.238 1.00 38.80 O ATOM 2274 CB TRP A 609 2.219 -3.046 28.767 1.00 25.02 C ATOM 2275 CG TRP A 609 2.625 -3.063 27.338 1.00 23.21 C ATOM 2276 CD1 TRP A 609 1.922 -3.572 26.287 1.00 23.57 C ATOM 2277 CD2 TRP A 609 3.863 -2.557 26.782 1.00 21.74 C ATOM 2278 NE1 TRP A 609 2.645 -3.397 25.103 1.00 23.27 N ATOM 2279 CE2 TRP A 609 3.828 -2.774 25.396 1.00 20.83 C ATOM 2280 CE3 TRP A 609 4.974 -1.918 27.329 1.00 21.98 C ATOM 2281 CZ2 TRP A 609 4.863 -2.414 24.566 1.00 21.90 C ATOM 2282 CZ3 TRP A 609 5.995 -1.551 26.501 1.00 22.16 C ATOM 2283 CH2 TRP A 609 5.935 -1.794 25.128 1.00 21.99 C ATOM 2284 HE1 TRP A 609 2.335 -3.692 24.155 1.00 0.00 H ATOM 2285 H TRP A 609 0.848 -0.737 28.435 1.00 0.00 H ATOM 2286 N THR A 610 -0.552 -2.303 31.090 1.00 34.33 N ATOM 2287 CA THR A 610 -1.052 -2.563 32.441 1.00 33.30 C ATOM 2288 C THR A 610 -1.552 -4.006 32.555 1.00 34.81 C ATOM 2289 O THR A 610 -2.451 -4.421 31.816 1.00 35.03 O ATOM 2290 CB THR A 610 -2.192 -1.566 32.772 1.00 35.44 C ATOM 2291 OG1 THR A 610 -1.698 -0.222 32.596 1.00 35.49 O ATOM 2292 CG2 THR A 610 -2.750 -1.734 34.218 1.00 34.09 C ATOM 2293 HG1 THR A 610 -1.405 -0.099 31.658 1.00 0.00 H ATOM 2294 H THR A 610 -1.026 -1.576 30.517 1.00 0.00 H ATOM 2295 N TYR A 611 -1.000 -4.733 33.525 1.00 35.30 N ATOM 2296 CA TYR A 611 -1.275 -6.159 33.722 1.00 37.06 C ATOM 2297 C TYR A 611 -2.738 -6.455 34.069 1.00 38.01 C ATOM 2298 O TYR A 611 -3.353 -7.379 33.536 1.00 34.50 O ATOM 2299 CB TYR A 611 -0.376 -6.719 34.820 1.00 36.82 C ATOM 2300 CG TYR A 611 -0.350 -8.221 34.848 1.00 38.24 C ATOM 2301 CD1 TYR A 611 0.660 -8.932 34.208 1.00 40.52 C ATOM 2302 CD2 TYR A 611 -1.315 -8.928 35.524 1.00 40.29 C ATOM 2303 CE1 TYR A 611 0.688 -10.303 34.227 1.00 42.74 C ATOM 2304 CE2 TYR A 611 -1.313 -10.307 35.546 1.00 41.13 C ATOM 2305 CZ TYR A 611 -0.309 -10.998 34.896 1.00 44.22 C ATOM 2306 OH TYR A 611 -0.274 -12.376 34.900 1.00 42.84 O ATOM 2307 HH TYR A 611 0.513 -12.686 34.386 1.00 0.00 H ATOM 2308 H TYR A 611 -0.339 -4.264 34.177 1.00 0.00 H ATOM 2309 N ASP A 612 -3.272 -5.667 34.987 1.00 41.84 N ATOM 2310 CA ASP A 612 -4.664 -5.785 35.405 1.00 40.90 C ATOM 2311 C ASP A 612 -5.607 -5.265 34.303 1.00 38.52 C ATOM 2312 O ASP A 612 -5.569 -4.108 33.949 1.00 38.47 O ATOM 2313 CB ASP A 612 -4.871 -5.019 36.708 1.00 43.46 C ATOM 2314 CG ASP A 612 -6.323 -4.972 37.133 1.00 49.19 C ATOM 2315 OD1 ASP A 612 -6.986 -6.033 37.092 1.00 48.84 O ATOM 2316 OD2 ASP A 612 -6.811 -3.868 37.482 1.00 52.73 O ATOM 2317 H ASP A 612 -2.677 -4.936 35.427 1.00 0.00 H ATOM 2318 N VAL A 613 -6.462 -6.132 33.775 1.00 40.97 N ATOM 2319 CA VAL A 613 -7.335 -5.763 32.661 1.00 44.52 C ATOM 2320 C VAL A 613 -8.192 -4.536 32.990 1.00 45.84 C ATOM 2321 O VAL A 613 -8.478 -3.731 32.114 1.00 46.91 O ATOM 2322 CB VAL A 613 -8.317 -6.873 32.205 1.00 45.30 C ATOM 2323 CG1 VAL A 613 -8.630 -6.676 30.730 1.00 46.84 C ATOM 2324 CG2 VAL A 613 -7.796 -8.283 32.415 1.00 45.95 C ATOM 2325 H VAL A 613 -6.512 -7.096 34.162 1.00 0.00 H ATOM 2326 N GLU A 614 -8.569 -4.415 34.259 1.00 49.30 N ATOM 2327 CA GLU A 614 -9.483 -3.398 34.752 1.00 54.69 C ATOM 2328 C GLU A 614 -8.833 -2.025 35.011 1.00 55.78 C ATOM 2329 O GLU A 614 -9.522 -1.007 35.086 1.00 54.79 O ATOM 2330 CB GLU A 614 -10.151 -3.922 36.041 1.00 61.62 C ATOM 2331 CG GLU A 614 -11.553 -3.385 36.298 1.00 67.75 C ATOM 2332 CD GLU A 614 -12.524 -3.705 35.170 1.00 70.51 C ATOM 2333 OE1 GLU A 614 -12.548 -4.868 34.709 1.00 72.30 O ATOM 2334 OE2 GLU A 614 -13.249 -2.781 34.736 1.00 73.47 O ATOM 2335 H GLU A 614 -8.184 -5.094 34.946 1.00 0.00 H ATOM 2336 N ASN A 615 -7.520 -1.977 35.162 1.00 55.15 N ATOM 2337 CA ASN A 615 -6.841 -0.685 35.207 1.00 51.85 C ATOM 2338 C ASN A 615 -6.298 -0.250 33.862 1.00 49.87 C ATOM 2339 O ASN A 615 -6.072 0.944 33.664 1.00 49.49 O ATOM 2340 CB ASN A 615 -5.732 -0.719 36.242 1.00 55.91 C ATOM 2341 CG ASN A 615 -6.258 -0.930 37.654 1.00 58.16 C ATOM 2342 OD1 ASN A 615 -7.458 -0.787 37.934 1.00 55.60 O ATOM 2343 ND2 ASN A 615 -5.363 -1.304 38.546 1.00 59.79 N ATOM 2344 HD22 ASN A 615 -4.366 -1.412 38.269 1.00 0.00 H ATOM 2345 HD21 ASN A 615 -5.653 -1.491 39.527 1.00 0.00 H ATOM 2346 H ASN A 615 -6.973 -2.857 35.248 1.00 0.00 H ATOM 2347 N ARG A 616 -6.091 -1.207 32.946 1.00 44.56 N ATOM 2348 CA ARG A 616 -5.611 -0.926 31.576 1.00 41.78 C ATOM 2349 C ARG A 616 -6.674 -0.098 30.890 1.00 43.62 C ATOM 2350 O ARG A 616 -7.843 -0.479 30.948 1.00 42.13 O ATOM 2351 CB ARG A 616 -5.418 -2.244 30.793 1.00 40.26 C ATOM 2352 CG ARG A 616 -4.562 -2.174 29.538 1.00 36.01 C ATOM 2353 CD ARG A 616 -4.579 -3.499 28.829 1.00 33.41 C ATOM 2354 NE ARG A 616 -4.110 -4.604 29.660 1.00 29.76 N ATOM 2355 CZ ARG A 616 -4.595 -5.846 29.616 1.00 28.74 C ATOM 2356 NH1 ARG A 616 -5.572 -6.189 28.761 1.00 27.05 N ATOM 2357 NH2 ARG A 616 -4.101 -6.760 30.444 1.00 29.41 N ATOM 2358 HE ARG A 616 -3.343 -4.409 30.335 1.00 0.00 H ATOM 2359 HH12 ARG A 616 -5.932 -7.165 28.747 1.00 0.00 H ATOM 2360 HH11 ARG A 616 -5.969 -5.479 28.113 1.00 0.00 H ATOM 2361 HH22 ARG A 616 -4.468 -7.733 30.423 1.00 0.00 H ATOM 2362 HH21 ARG A 616 -3.348 -6.502 31.113 1.00 0.00 H ATOM 2363 H ARG A 616 -6.277 -2.195 33.212 1.00 0.00 H ATOM 2364 N PRO A 617 -6.291 1.022 30.237 1.00 43.52 N ATOM 2365 CA PRO A 617 -7.266 1.941 29.610 1.00 42.55 C ATOM 2366 C PRO A 617 -7.987 1.316 28.441 1.00 42.46 C ATOM 2367 O PRO A 617 -7.498 0.357 27.855 1.00 41.49 O ATOM 2368 CB PRO A 617 -6.401 3.082 29.090 1.00 42.16 C ATOM 2369 CG PRO A 617 -5.077 2.446 28.831 1.00 44.05 C ATOM 2370 CD PRO A 617 -4.911 1.424 29.933 1.00 42.98 C ATOM 2371 N GLY A 618 -9.146 1.867 28.116 1.00 42.70 N ATOM 2372 CA GLY A 618 -9.939 1.390 27.000 1.00 38.80 C ATOM 2373 C GLY A 618 -9.508 2.143 25.782 1.00 37.26 C ATOM 2374 O GLY A 618 -8.684 3.042 25.853 1.00 39.42 O ATOM 2375 H GLY A 618 -9.499 2.667 28.679 1.00 0.00 H ATOM 2376 N PHE A 619 -10.091 1.808 24.653 1.00 37.72 N ATOM 2377 CA PHE A 619 -9.668 2.444 23.415 1.00 39.81 C ATOM 2378 C PHE A 619 -10.134 3.887 23.272 1.00 40.64 C ATOM 2379 O PHE A 619 -9.480 4.682 22.605 1.00 38.23 O ATOM 2380 CB PHE A 619 -10.069 1.618 22.197 1.00 38.99 C ATOM 2381 CG PHE A 619 -8.970 0.767 21.693 1.00 39.64 C ATOM 2382 CD1 PHE A 619 -7.824 1.366 21.205 1.00 39.67 C ATOM 2383 CD2 PHE A 619 -9.068 -0.615 21.691 1.00 35.45 C ATOM 2384 CE1 PHE A 619 -6.782 0.588 20.712 1.00 38.71 C ATOM 2385 CE2 PHE A 619 -8.047 -1.378 21.207 1.00 34.10 C ATOM 2386 CZ PHE A 619 -6.899 -0.788 20.729 1.00 36.73 C ATOM 2387 H PHE A 619 -10.848 1.095 24.645 1.00 0.00 H ATOM 2388 N ALA A 620 -11.255 4.221 23.888 1.00 42.57 N ATOM 2389 CA ALA A 620 -11.638 5.614 24.020 1.00 47.34 C ATOM 2390 C ALA A 620 -10.551 6.412 24.740 1.00 49.80 C ATOM 2391 O ALA A 620 -10.103 7.452 24.248 1.00 55.37 O ATOM 2392 CB ALA A 620 -12.949 5.721 24.776 1.00 52.01 C ATOM 2393 H ALA A 620 -11.868 3.479 24.281 1.00 0.00 H ATOM 2394 N ALA A 621 -10.110 5.906 25.889 1.00 48.99 N ATOM 2395 CA ALA A 621 -9.120 6.610 26.695 1.00 50.22 C ATOM 2396 C ALA A 621 -7.789 6.755 25.959 1.00 53.68 C ATOM 2397 O ALA A 621 -7.123 7.786 26.078 1.00 57.23 O ATOM 2398 CB ALA A 621 -8.917 5.904 28.030 1.00 49.71 C ATOM 2399 H ALA A 621 -10.479 4.991 26.218 1.00 0.00 H ATOM 2400 N VAL A 622 -7.422 5.731 25.182 1.00 56.18 N ATOM 2401 CA VAL A 622 -6.146 5.718 24.461 1.00 53.22 C ATOM 2402 C VAL A 622 -6.204 6.742 23.334 1.00 51.62 C ATOM 2403 O VAL A 622 -5.373 7.636 23.289 1.00 50.47 O ATOM 2404 CB VAL A 622 -5.789 4.299 23.927 1.00 51.91 C ATOM 2405 CG1 VAL A 622 -4.543 4.319 23.037 1.00 48.73 C ATOM 2406 CG2 VAL A 622 -5.565 3.335 25.081 1.00 51.01 C ATOM 2407 H VAL A 622 -8.063 4.917 25.086 1.00 0.00 H ATOM 2408 N GLU A 623 -7.201 6.608 22.455 1.00 53.22 N ATOM 2409 CA GLU A 623 -7.442 7.559 21.346 1.00 59.77 C ATOM 2410 C GLU A 623 -7.376 9.031 21.795 1.00 59.03 C ATOM 2411 O GLU A 623 -6.674 9.836 21.183 1.00 53.33 O ATOM 2412 CB GLU A 623 -8.801 7.270 20.689 1.00 60.88 C ATOM 2413 CG GLU A 623 -9.032 7.955 19.347 1.00 62.83 C ATOM 2414 CD GLU A 623 -9.317 9.442 19.468 1.00 63.69 C ATOM 2415 OE1 GLU A 623 -10.131 9.842 20.317 1.00 68.08 O ATOM 2416 OE2 GLU A 623 -8.709 10.223 18.724 1.00 63.25 O ATOM 2417 H GLU A 623 -7.841 5.794 22.555 1.00 0.00 H ATOM 2418 N LEU A 624 -8.101 9.342 22.874 1.00 61.70 N ATOM 2419 CA LEU A 624 -8.095 10.678 23.522 1.00 65.03 C ATOM 2420 C LEU A 624 -6.701 11.220 23.804 1.00 65.09 C ATOM 2421 O LEU A 624 -6.412 12.375 23.497 1.00 66.26 O ATOM 2422 CB LEU A 624 -8.880 10.624 24.849 1.00 68.09 C ATOM 2423 CG LEU A 624 -9.321 11.919 25.542 1.00 64.36 C ATOM 2424 CD1 LEU A 624 -10.251 12.731 24.650 1.00 64.43 C ATOM 2425 CD2 LEU A 624 -10.012 11.557 26.847 1.00 63.37 C ATOM 2426 H LEU A 624 -8.706 8.603 23.285 1.00 0.00 H ATOM 2427 N ARG A 625 -5.854 10.372 24.394 1.00 69.80 N ATOM 2428 CA ARG A 625 -4.444 10.700 24.679 1.00 67.45 C ATOM 2429 C ARG A 625 -3.585 10.810 23.428 1.00 65.69 C ATOM 2430 O ARG A 625 -2.642 11.600 23.399 1.00 70.29 O ATOM 2431 CB ARG A 625 -3.831 9.673 25.639 1.00 72.65 C ATOM 2432 CG ARG A 625 -2.337 9.819 25.921 1.00 79.88 C ATOM 2433 CD ARG A 625 -1.952 11.174 26.482 1.00 85.01 C ATOM 2434 NE ARG A 625 -0.507 11.245 26.714 1.00 92.10 N ATOM 2435 CZ ARG A 625 0.183 12.363 26.960 1.00 97.53 C ATOM 2436 NH1 ARG A 625 1.494 12.284 27.165 1.00 99.22 N ATOM 2437 NH2 ARG A 625 -0.416 13.559 27.007 1.00 97.51 N ATOM 2438 HE ARG A 625 0.026 10.352 26.685 1.00 0.00 H ATOM 2439 HH12 ARG A 625 2.043 13.146 27.357 1.00 0.00 H ATOM 2440 HH11 ARG A 625 1.971 11.360 27.133 1.00 0.00 H ATOM 2441 HH22 ARG A 625 0.144 14.414 27.200 1.00 0.00 H ATOM 2442 HH21 ARG A 625 -1.441 13.634 26.850 1.00 0.00 H ATOM 2443 H ARG A 625 -6.207 9.432 24.666 1.00 0.00 H ATOM 2444 N LEU A 626 -3.877 10.014 22.402 1.00 64.22 N ATOM 2445 CA LEU A 626 -3.144 10.148 21.138 1.00 60.52 C ATOM 2446 C LEU A 626 -3.540 11.440 20.447 1.00 58.65 C ATOM 2447 O LEU A 626 -2.667 12.166 19.982 1.00 59.48 O ATOM 2448 CB LEU A 626 -3.326 8.936 20.210 1.00 59.23 C ATOM 2449 CG LEU A 626 -2.199 7.889 20.302 1.00 57.33 C ATOM 2450 CD1 LEU A 626 -2.620 6.530 19.767 1.00 55.56 C ATOM 2451 CD2 LEU A 626 -0.927 8.349 19.595 1.00 57.74 C ATOM 2452 H LEU A 626 -4.625 9.297 22.496 1.00 0.00 H ATOM 2453 N ARG A 627 -4.842 11.733 20.416 1.00 60.50 N ATOM 2454 CA ARG A 627 -5.356 12.956 19.782 1.00 63.23 C ATOM 2455 C ARG A 627 -4.781 14.213 20.439 1.00 65.49 C ATOM 2456 O ARG A 627 -4.068 14.967 19.769 1.00 63.26 O ATOM 2457 CB ARG A 627 -6.882 12.995 19.800 1.00 65.18 C ATOM 2458 CG ARG A 627 -7.479 14.085 18.920 1.00 67.03 C ATOM 2459 CD ARG A 627 -8.893 14.416 19.346 1.00 69.33 C ATOM 2460 NE ARG A 627 -9.802 13.319 19.028 1.00 71.31 N ATOM 2461 CZ ARG A 627 -10.840 12.915 19.764 1.00 71.54 C ATOM 2462 NH1 ARG A 627 -11.146 13.487 20.934 1.00 66.77 N ATOM 2463 NH2 ARG A 627 -11.585 11.899 19.312 1.00 72.70 N ATOM 2464 HE ARG A 627 -9.624 12.803 18.143 1.00 0.00 H ATOM 2465 HH12 ARG A 627 -11.962 13.147 21.481 1.00 0.00 H ATOM 2466 HH11 ARG A 627 -10.568 14.272 21.296 1.00 0.00 H ATOM 2467 HH22 ARG A 627 -12.399 11.565 19.866 1.00 0.00 H ATOM 2468 HH21 ARG A 627 -11.350 11.444 18.407 1.00 0.00 H ATOM 2469 H ARG A 627 -5.516 11.074 20.855 1.00 0.00 H ATOM 2470 N ASN A 628 -5.063 14.408 21.738 1.00 67.26 N ATOM 2471 CA ASN A 628 -4.504 15.529 22.539 1.00 65.60 C ATOM 2472 C ASN A 628 -3.017 15.729 22.306 1.00 62.62 C ATOM 2473 O ASN A 628 -2.559 16.847 22.113 1.00 67.92 O ATOM 2474 CB ASN A 628 -4.689 15.288 24.043 1.00 64.90 C ATOM 2475 CG ASN A 628 -6.088 15.612 24.545 1.00 64.33 C ATOM 2476 OD1 ASN A 628 -6.984 15.972 23.784 1.00 63.05 O ATOM 2477 ND2 ASN A 628 -6.274 15.485 25.859 1.00 61.89 N ATOM 2478 HD22 ASN A 628 -5.489 15.178 26.468 1.00 0.00 H ATOM 2479 HD21 ASN A 628 -7.204 15.693 26.275 1.00 0.00 H ATOM 2480 H ASN A 628 -5.706 13.740 22.208 1.00 0.00 H ATOM 2481 N TYR A 629 -2.270 14.631 22.330 1.00 61.08 N ATOM 2482 CA TYR A 629 -0.825 14.692 22.142 1.00 60.48 C ATOM 2483 C TYR A 629 -0.445 15.046 20.697 1.00 59.91 C ATOM 2484 O TYR A 629 0.486 15.815 20.475 1.00 65.45 O ATOM 2485 CB TYR A 629 -0.139 13.386 22.585 1.00 57.51 C ATOM 2486 CG TYR A 629 1.351 13.460 22.384 1.00 55.96 C ATOM 2487 CD1 TYR A 629 2.151 14.192 23.256 1.00 59.60 C ATOM 2488 CD2 TYR A 629 1.955 12.869 21.286 1.00 54.84 C ATOM 2489 CE1 TYR A 629 3.520 14.303 23.049 1.00 60.86 C ATOM 2490 CE2 TYR A 629 3.314 12.985 21.069 1.00 55.23 C ATOM 2491 CZ TYR A 629 4.092 13.691 21.951 1.00 58.04 C ATOM 2492 OH TYR A 629 5.439 13.787 21.723 1.00 67.08 O ATOM 2493 HH TYR A 629 5.857 14.324 22.442 1.00 0.00 H ATOM 2494 H TYR A 629 -2.725 13.709 22.486 1.00 0.00 H ATOM 2495 N TYR A 630 -1.153 14.479 19.725 1.00 60.37 N ATOM 2496 CA TYR A 630 -0.873 14.745 18.307 1.00 63.48 C ATOM 2497 C TYR A 630 -0.892 16.264 17.963 1.00 66.07 C ATOM 2498 O TYR A 630 0.076 16.789 17.382 1.00 59.51 O ATOM 2499 CB TYR A 630 -1.858 13.950 17.427 1.00 62.92 C ATOM 2500 CG TYR A 630 -1.657 14.110 15.937 1.00 65.47 C ATOM 2501 CD1 TYR A 630 -0.389 13.965 15.356 1.00 64.91 C ATOM 2502 CD2 TYR A 630 -2.731 14.396 15.100 1.00 66.54 C ATOM 2503 CE1 TYR A 630 -0.200 14.114 13.992 1.00 64.96 C ATOM 2504 CE2 TYR A 630 -2.549 14.548 13.733 1.00 68.60 C ATOM 2505 CZ TYR A 630 -1.282 14.406 13.184 1.00 66.95 C ATOM 2506 OH TYR A 630 -1.090 14.556 11.830 1.00 69.73 O ATOM 2507 HH TYR A 630 -1.635 13.887 11.345 1.00 0.00 H ATOM 2508 H TYR A 630 -1.926 13.830 19.975 1.00 0.00 H ATOM 2509 N TYR A 631 -1.957 16.956 18.383 1.00 68.04 N ATOM 2510 CA TYR A 631 -2.148 18.390 18.088 1.00 74.74 C ATOM 2511 C TYR A 631 -1.062 19.312 18.647 1.00 78.79 C ATOM 2512 O TYR A 631 -0.618 20.247 17.955 1.00 79.05 O ATOM 2513 CB TYR A 631 -3.522 18.875 18.567 1.00 78.14 C ATOM 2514 CG TYR A 631 -4.715 18.151 17.959 1.00 81.74 C ATOM 2515 CD1 TYR A 631 -4.647 17.555 16.690 1.00 83.11 C ATOM 2516 CD2 TYR A 631 -5.926 18.083 18.649 1.00 84.55 C ATOM 2517 CE1 TYR A 631 -5.737 16.901 16.145 1.00 85.14 C ATOM 2518 CE2 TYR A 631 -7.028 17.436 18.105 1.00 88.23 C ATOM 2519 CZ TYR A 631 -6.928 16.839 16.851 1.00 88.49 C ATOM 2520 OH TYR A 631 -8.006 16.184 16.274 1.00 89.25 O ATOM 2521 HH TYR A 631 -7.740 15.829 15.389 1.00 0.00 H ATOM 2522 H TYR A 631 -2.682 16.462 18.942 1.00 0.00 H ATOM 2523 N ASP A 632 -0.616 19.033 19.873 1.00 80.35 N ATOM 2524 CA ASP A 632 0.490 19.781 20.490 1.00 80.77 C ATOM 2525 C ASP A 632 1.841 19.641 19.750 1.00 86.89 C ATOM 2526 O ASP A 632 2.730 20.491 19.902 1.00 90.37 O ATOM 2527 CB ASP A 632 0.626 19.407 21.982 1.00 78.23 C ATOM 2528 CG ASP A 632 -0.334 20.194 22.887 1.00 69.63 C ATOM 2529 OD1 ASP A 632 -1.307 20.796 22.396 1.00 65.88 O ATOM 2530 OD2 ASP A 632 -0.092 20.223 24.107 1.00 61.68 O ATOM 2531 H ASP A 632 -1.064 18.263 20.409 1.00 0.00 H ATOM 2532 N VAL A 633 1.976 18.594 18.939 1.00 91.91 N ATOM 2533 CA VAL A 633 3.164 18.373 18.113 1.00 93.90 C ATOM 2534 C VAL A 633 3.003 18.925 16.674 1.00 95.11 C ATOM 2535 O VAL A 633 4.005 19.162 15.994 1.00 89.21 O ATOM 2536 CB VAL A 633 3.522 16.867 18.089 1.00 92.75 C ATOM 2537 CG1 VAL A 633 4.901 16.640 17.491 1.00 94.19 C ATOM 2538 CG2 VAL A 633 3.512 16.289 19.498 1.00 92.39 C ATOM 2539 H VAL A 633 1.202 17.901 18.890 1.00 0.00 H ATOM 2540 N VAL A 634 1.760 19.136 16.223 1.00 99.10 N ATOM 2541 CA VAL A 634 1.462 19.547 14.833 1.00100.05 C ATOM 2542 C VAL A 634 2.308 20.754 14.403 1.00104.15 C ATOM 2543 O VAL A 634 3.177 20.626 13.534 1.00108.38 O ATOM 2544 CB VAL A 634 -0.061 19.803 14.622 1.00 97.03 C ATOM 2545 CG1 VAL A 634 -0.355 20.560 13.331 1.00 97.64 C ATOM 2546 CG2 VAL A 634 -0.813 18.483 14.595 1.00 95.74 C ATOM 2547 H VAL A 634 0.966 19.005 16.881 1.00 0.00 H ATOM 2548 N ASN A 635 2.067 21.904 15.029 1.00103.42 N ATOM 2549 CA ASN A 635 2.799 23.137 14.714 1.00 99.43 C ATOM 2550 C ASN A 635 4.024 23.323 15.604 1.00 90.27 C ATOM 2551 O ASN A 635 3.901 23.560 16.804 1.00 82.28 O ATOM 2552 CB ASN A 635 1.873 24.343 14.838 1.00101.40 C ATOM 2553 CG ASN A 635 0.659 24.234 13.933 1.00107.53 C ATOM 2554 OD1 ASN A 635 0.730 24.533 12.740 1.00108.96 O ATOM 2555 ND2 ASN A 635 -0.464 23.797 14.495 1.00106.08 N ATOM 2556 HD22 ASN A 635 -0.480 23.556 15.506 1.00 0.00 H ATOM 2557 HD21 ASN A 635 -1.327 23.697 13.923 1.00 0.00 H ATOM 2558 H ASN A 635 1.335 21.930 15.767 1.00 0.00 H TER 2559 ASN A 635 HETATM 2560 O HOH 1 -15.986 -4.020 23.743 1.00 35.51 O HETATM 2561 O HOH 2 -9.719 -9.971 6.815 1.00 40.19 O HETATM 2562 O HOH 3 -9.333 -9.554 27.939 1.00 46.97 O HETATM 2563 O HOH 4 -17.348 -12.623 33.497 1.00 48.82 O HETATM 2564 O HOH 5 -12.005 -3.898 20.172 1.00 53.70 O HETATM 2565 O HOH 6 -18.270 -0.171 -14.284 1.00 54.05 O HETATM 2566 O HOH 7 3.424 -6.942 13.326 1.00 37.42 O HETATM 2567 O HOH 8 3.116 -8.434 25.004 1.00 31.39 O HETATM 2568 O HOH 9 10.572 8.133 15.120 1.00 44.06 O HETATM 2569 O HOH 10 -14.592 -1.726 6.706 1.00 49.60 O HETATM 2570 O HOH 11 -19.990 -6.442 -4.605 1.00 47.03 O HETATM 2571 O HOH 12 -11.943 0.595 31.698 1.00 58.09 O HETATM 2572 O HOH 13 15.122 6.885 14.447 1.00 55.65 O HETATM 2573 O HOH 14 -19.784 -18.275 -0.840 1.00 52.06 O HETATM 2574 C4 X A 8 -4.874 -6.234 1.855 1.00 0.18 C HETATM 2575 C5 X A 8 -5.934 -5.338 1.813 1.00 0.01 C HETATM 2576 C6 X A 8 -5.711 -4.145 1.133 1.00 0.01 C HETATM 2577 N1 X A 8 -4.484 -3.815 0.518 1.00 -0.26 N HETATM 2578 C2 X A 8 -3.468 -4.689 0.602 1.00 0.20 C HETATM 2579 N3 X A 8 -3.729 -5.830 1.267 1.00 -0.22 N HETATM 2580 NAR X A 8 -2.221 -4.461 0.059 1.00 -0.25 N HETATM 2581 CAT X A 8 -1.204 -5.327 0.328 1.00 0.05 C HETATM 2582 CAI X A 8 0.158 -5.231 -0.030 1.00 -0.04 C HETATM 2583 CAY X A 8 1.004 -6.235 0.347 1.00 0.01 C HETATM 2584 CAV X A 8 2.278 -6.542 0.238 1.00 0.12 C HETATM 2585 CL1 X A 8 3.449 -5.597 -0.541 1.00 -0.06 CL HETATM 2586 NAQ X A 8 2.551 -7.708 0.839 1.00 -0.19 N HETATM 2587 NBC X A 8 1.605 -8.135 1.297 1.00 -0.21 N HETATM 2588 CAB X A 8 1.313 -9.404 2.089 1.00 0.05 C HETATM 2589 H18 X A 8 0.245 -9.436 2.349 1.00 0.06 H HETATM 2590 H19 X A 8 1.915 -9.408 3.010 1.00 0.06 H HETATM 2591 H20 X A 8 1.569 -10.284 1.480 1.00 0.06 H HETATM 2592 CAZ X A 8 0.618 -7.294 1.041 1.00 0.08 C HETATM 2593 CAH X A 8 -0.615 -7.411 1.385 1.00 -0.04 C HETATM 2594 CAG X A 8 -1.498 -6.454 1.034 1.00 -0.04 C HETATM 2595 H22 X A 8 -2.529 -6.593 1.339 1.00 0.05 H HETATM 2596 H21 X A 8 -0.943 -8.274 1.954 1.00 0.05 H HETATM 2597 H17 X A 8 0.524 -4.379 -0.592 1.00 0.05 H HETATM 2598 H16 X A 8 -2.060 -3.643 -0.545 1.00 0.21 H HETATM 2599 H2 X A 8 -6.524 -3.430 1.072 1.00 0.09 H HETATM 2600 H1 X A 8 -6.885 -5.557 2.285 1.00 0.06 H HETATM 2601 NBD X A 8 -4.880 -7.400 2.549 1.00 -0.16 N HETATM 2602 CAJ X A 8 -3.808 -8.178 2.848 1.00 0.07 C HETATM 2603 CAU X A 8 -4.189 -9.175 3.604 1.00 0.02 C HETATM 2604 CAK X A 8 -3.303 -10.327 4.150 1.00 -0.01 C HETATM 2605 NBB X A 8 -2.089 -9.773 4.774 1.00 0.25 N HETATM 2606 CAL X A 8 -1.466 -10.492 5.942 1.00 0.00 C HETATM 2607 CBA X A 8 -1.214 -9.069 6.531 1.00 0.13 C HETATM 2608 OAC X A 8 0.093 -8.554 6.286 1.00 -0.38 O HETATM 2609 H6 X A 8 0.169 -7.690 6.673 1.00 0.21 H HETATM 2610 CAM X A 8 -2.211 -8.513 5.552 1.00 0.00 C HETATM 2611 H7 X A 8 -1.871 -7.614 5.018 1.00 0.08 H HETATM 2612 H8 X A 8 -3.211 -8.333 5.973 1.00 0.08 H HETATM 2613 H5 X A 8 -1.480 -8.957 7.592 1.00 0.07 H HETATM 2614 H3 X A 8 -2.156 -11.121 6.523 1.00 0.08 H HETATM 2615 H4 X A 8 -0.558 -11.066 5.705 1.00 0.08 H HETATM 2616 H9 X A 8 -1.422 -9.669 4.026 1.00 0.20 H HETATM 2617 H10 X A 8 -3.870 -10.899 4.899 1.00 0.09 H HETATM 2618 H11 X A 8 -3.017 -10.991 3.321 1.00 0.09 H HETATM 2619 CAS X A 8 -5.470 -8.959 3.780 1.00 0.02 C HETATM 2620 CAA X A 8 -6.446 -9.847 4.561 1.00 -0.03 C HETATM 2621 H13 X A 8 -7.452 -9.402 4.530 1.00 0.04 H HETATM 2622 H14 X A 8 -6.113 -9.927 5.606 1.00 0.04 H HETATM 2623 H15 X A 8 -6.474 -10.849 4.107 1.00 0.04 H HETATM 2624 NAP X A 8 -5.808 -7.849 3.121 1.00 -0.21 N HETATM 2625 H12 X A 8 -2.788 -7.999 2.510 1.00 0.09 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 148 149 152 153 154 CONECT 152 148 CONECT 153 148 CONECT 154 148 CONECT 253 254 260 261 262 CONECT 260 253 CONECT 261 253 CONECT 262 253 CONECT 347 348 355 356 357 CONECT 355 347 CONECT 356 347 CONECT 357 347 CONECT 1549 1550 1555 1556 1557 CONECT 1556 1549 CONECT 1557 1549 CONECT 2574 2575 2579 2601 CONECT 2575 2574 2576 2600 CONECT 2576 2575 2577 2599 CONECT 2577 2576 2578 CONECT 2578 2577 2579 2580 CONECT 2579 2574 2578 CONECT 2580 2578 2581 2598 CONECT 2581 2580 2582 2594 CONECT 2582 2581 2583 2597 CONECT 2583 2582 2584 2592 CONECT 2584 2583 2585 2586 CONECT 2585 2584 CONECT 2586 2584 2587 CONECT 2587 2586 2588 2592 CONECT 2588 2587 2589 2590 2591 CONECT 2589 2588 CONECT 2590 2588 CONECT 2591 2588 CONECT 2592 2583 2587 2593 CONECT 2593 2592 2594 2596 CONECT 2594 2581 2593 2595 CONECT 2595 2594 CONECT 2596 2593 CONECT 2597 2582 CONECT 2598 2580 CONECT 2599 2576 CONECT 2600 2575 CONECT 2601 2574 2602 2624 CONECT 2602 2601 2603 2625 CONECT 2603 2602 2604 2619 CONECT 2604 2603 2605 2617 2618 CONECT 2605 2604 2606 2610 2616 CONECT 2606 2605 2607 2614 2615 CONECT 2607 2606 2608 2610 2613 CONECT 2608 2607 2609 CONECT 2609 2608 CONECT 2610 2605 2607 2611 2612 CONECT 2611 2610 CONECT 2612 2610 CONECT 2613 2607 CONECT 2614 2606 CONECT 2615 2606 CONECT 2616 2605 CONECT 2617 2604 CONECT 2618 2604 CONECT 2619 2603 2620 2624 CONECT 2620 2619 2621 2622 2623 CONECT 2621 2620 CONECT 2622 2620 CONECT 2623 2620 CONECT 2624 2601 2619 CONECT 2625 2602 MASTER 0 0 0 0 0 0 0 0 2620 5 71 22 END
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Pocket-Ligand
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Protein Sequence Similarity
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RCSB PDB
PDBbind
291aa, >3FQE_1|Chain... at 96%
3fqh
RCSB PDB
PDBbind
291aa, >3FQH_1|Chains... at 96%
3fqs
RCSB PDB
PDBbind
291aa, >3FQS_1|Chain... at 96%
3srv
RCSB PDB
PDBbind
277aa, >3SRV_2|Chain... at 99%
3vf8
RCSB PDB
PDBbind
299aa, >3VF8_1|Chain... at 97%
3vf9
RCSB PDB
PDBbind
299aa, >3VF9_1|Chain... at 97%
4dfl
RCSB PDB
PDBbind
274aa, >4DFL_1|Chain... at 99%
4dfn
RCSB PDB
PDBbind
274aa, >4DFN_1|Chain... at 99%
4f4p
RCSB PDB
PDBbind
273aa, >4F4P_1|Chain... at 99%
4fl1
RCSB PDB
PDBbind
291aa, >4FL1_1|Chain... at 96%
4fl2
RCSB PDB
PDBbind
636aa, >4FL2_1|Chain... *
4fl3
RCSB PDB
PDBbind
635aa, >4FL3_1|Chain... at 99%
4fyo
RCSB PDB
PDBbind
291aa, >4FYO_1|Chain... at 96%
4fz6
RCSB PDB
PDBbind
291aa, >4FZ6_1|Chain... at 96%
4i0r
RCSB PDB
PDBbind
291aa, >4I0R_1|Chain... at 96%
4i0s
RCSB PDB
PDBbind
291aa, >4I0S_1|Chain... at 96%
4i0t
RCSB PDB
PDBbind
291aa, >4I0T_1|Chain... at 96%
4puz
RCSB PDB
PDBbind
291aa, >4PUZ_1|Chains... at 96%
4pv0
RCSB PDB
PDBbind
275aa, >4PV0_1|Chain... at 99%
4px6
RCSB PDB
PDBbind
291aa, >4PX6_1|Chain... at 95%
4rss
RCSB PDB
PDBbind
290aa, >4RSS_1|Chain... at 96%
4rx7
RCSB PDB
PDBbind
289aa, >4RX7_1|Chain... at 96%
4rx8
RCSB PDB
PDBbind
289aa, >4RX8_1|Chain... at 96%
4rx9
RCSB PDB
PDBbind
290aa, >4RX9_1|Chain... at 96%
4wnm
RCSB PDB
PDBbind
299aa, >4WNM_1|Chain... at 97%
4xg3
RCSB PDB
PDBbind
290aa, >4XG3_1|Chains... at 96%
4xg4
RCSB PDB
PDBbind
290aa, >4XG4_1|Chain... at 96%
4xg6
RCSB PDB
PDBbind
290aa, >4XG6_1|Chain... at 96%
4xg7
RCSB PDB
PDBbind
290aa, >4XG7_1|Chain... at 96%
4xg9
RCSB PDB
PDBbind
290aa, >4XG9_1|Chains... at 96%
5c26
RCSB PDB
PDBbind
299aa, >5C26_1|Chain... at 97%
5cxh
RCSB PDB
PDBbind
289aa, >5CXH_1|Chain... at 96%
5cxz
RCSB PDB
PDBbind
289aa, >5CXZ_1|Chain... at 96%
5cy3
RCSB PDB
PDBbind
291aa, >5CY3_1|Chain... at 95%
5ghv
RCSB PDB
PDBbind
290aa, >5GHV_1|Chains... at 96%
5lma
RCSB PDB
PDBbind
277aa, >5LMA_1|Chain... at 99%
5lmb
RCSB PDB
PDBbind
277aa, >5LMB_1|Chains... at 99%
5t68
RCSB PDB
PDBbind
291aa, >5T68_1|Chains... at 96%
5tiu
RCSB PDB
PDBbind
291aa, >5TIU_1|Chain... at 96%
5tr6
RCSB PDB
PDBbind
289aa, >5TR6_1|Chain... at 96%
5tt7
RCSB PDB
PDBbind
289aa, >5TT7_1|Chain... at 96%
5y5t
RCSB PDB
PDBbind
293aa, >5Y5T_1|Chain... at 95%
5y5u
RCSB PDB
PDBbind
293aa, >5Y5U_1|Chains... at 95%
6hm6
RCSB PDB
PDBbind
276aa, >6HM6_1|Chain... at 100%
6hm7
RCSB PDB
PDBbind
276aa, >6HM7_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4xg8
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Tyrosine-protein kinase SYK
Ligand Name
X8G
EC.Number
E.C.2.7.10.2
Resolution
2.4(Å)
Affinity (Kd/Ki/IC50)
IC50=1.9nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Febs J. Vol. 283: pp. 3613-3625
Ligand Properties
Formula
C
2
0
H
2
2
ClN
8
O
Molecular Weight
425.895
Exact Mass
425.161
No. of atoms
52
No. of bonds
56
Polar Surface Area
98.12
LOGP Value
2.38 (
Computed with XLOGP3
)
2.66 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 5
Canonical SMILES
O[C@@H]1C[N@H+](C1)Cc1cn(nc1C)c1ccnc(n1)Nc1ccc2c(c1)c(Cl)nn2C
InChI String
InChI=1S/C20H21ClN8O/c1-12-13(8-28-10-15(30)11-28)9-29(25-12)18-5-6-22-20(24-18)23-14-3-4-17-16(7-14)19(21)26-27(17)2/h3-7,9,15,30H,8,10-11H2,1-2H3,(H,22,23,24)/p+1
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):
P43405
Entrez Gene ID
NCBI Entrez Gene ID:
6850
ASD
Information of known allosteric effects of PDB entries
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