Browse entries in the PDBbind-CN Database
HEADER 6GCX_COMPLEX COMPND 6GCX_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 46 ARG ASP TYR GLU ILE GLN ARG GLU ARG ILE GLU LEU GLY SEQRES 2 A 46 ARG CYS ILE GLY GLU GLY GLN PHE GLY ASP VAL HIS GLN SEQRES 3 A 46 GLY ILE TYR MET SER PRO GLU ASN PRO ALA MET ALA VAL SEQRES 4 A 46 ALA ILE LYS THR CYS LYS ASN SEQRES 1 A 109 SER ASP SER VAL ARG GLU LYS PHE LEU GLN GLU ALA LEU SEQRES 2 A 109 THR MET ARG GLN PHE ASP HIS PRO HIS ILE VAL LYS LEU SEQRES 3 A 109 ILE GLY VAL ILE THR GLU ASN PRO VAL TRP ILE ILE MET SEQRES 4 A 109 GLU LEU CYS THR LEU GLY GLU LEU ARG SER PHE LEU GLN SEQRES 5 A 109 VAL ARG LYS PHE SER LEU ASP LEU ALA SER LEU ILE LEU SEQRES 6 A 109 TYR ALA TYR GLN LEU SER THR ALA LEU ALA TYR LEU GLU SEQRES 7 A 109 SER LYS ARG PHE VAL HIS ARG ASP ILE ALA ALA ARG ASN SEQRES 8 A 109 VAL LEU VAL SER ALA THR ASP CYS VAL LYS LEU GLY ASP SEQRES 9 A 109 PHE GLY LEU SER ARG SEQRES 1 A 103 LEU PRO ILE LYS TRP MET ALA PRO GLU SER ILE ASN PHE SEQRES 2 A 103 ARG ARG PHE THR SER ALA SER ASP VAL TRP MET PHE GLY SEQRES 3 A 103 VAL CYS MET TRP GLU ILE LEU MET HIS GLY VAL LYS PRO SEQRES 4 A 103 PHE GLN GLY VAL LYS ASN ASN ASP VAL ILE GLY ARG ILE SEQRES 5 A 103 GLU ASN GLY GLU ARG LEU PRO MET PRO PRO ASN CYS PRO SEQRES 6 A 103 PRO THR LEU TYR SER LEU MET THR LYS CYS TRP ALA TYR SEQRES 7 A 103 ASP PRO SER ARG ARG PRO ARG PHE THR GLU LEU LYS ALA SEQRES 8 A 103 GLN LEU SER THR ILE LEU GLU GLU GLU LYS LEU GLN HET EUW A 441 70 ATOM 1 N ARG A 413 -14.427 23.192 78.821 1.00 66.75 N ATOM 2 CA ARG A 413 -14.813 24.157 79.845 1.00 66.21 C ATOM 3 C ARG A 413 -13.755 24.250 80.938 1.00 66.19 C ATOM 4 O ARG A 413 -12.561 24.077 80.681 1.00 71.07 O ATOM 5 CB ARG A 413 -16.166 23.783 80.457 1.00 63.19 C ATOM 6 HN3 ARG A 413 -14.313 22.254 79.256 1.00 0.00 H ATOM 7 HN2 ARG A 413 -13.528 23.487 78.390 1.00 0.00 H ATOM 8 HN1 ARG A 413 -15.166 23.150 78.090 1.00 0.00 H ATOM 9 N ASP A 414 -14.204 24.521 82.161 1.00 63.82 N ATOM 10 CA ASP A 414 -13.297 24.675 83.290 1.00 60.05 C ATOM 11 C ASP A 414 -12.833 23.315 83.793 1.00 57.19 C ATOM 12 O ASP A 414 -13.647 22.414 84.020 1.00 57.91 O ATOM 13 CB ASP A 414 -13.976 25.445 84.421 1.00 62.91 C ATOM 14 CG ASP A 414 -12.981 26.005 85.418 1.00 64.06 C ATOM 15 OD1 ASP A 414 -12.109 26.797 85.006 1.00 70.71 O ATOM 16 OD2 ASP A 414 -13.067 25.650 86.611 1.00 66.61 O ATOM 17 H ASP A 414 -15.227 24.625 82.314 1.00 0.00 H ATOM 18 N TYR A 415 -11.521 23.173 83.978 1.00 50.96 N ATOM 19 CA TYR A 415 -10.946 21.949 84.517 1.00 42.66 C ATOM 20 C TYR A 415 -10.568 22.059 85.989 1.00 37.25 C ATOM 21 O TYR A 415 -10.047 21.095 86.553 1.00 33.24 O ATOM 22 CB TYR A 415 -9.718 21.540 83.699 1.00 46.14 C ATOM 23 CG TYR A 415 -10.039 20.679 82.499 1.00 52.30 C ATOM 24 CD1 TYR A 415 -10.316 21.251 81.264 1.00 56.77 C ATOM 25 CD2 TYR A 415 -10.068 19.293 82.602 1.00 53.43 C ATOM 26 CE1 TYR A 415 -10.612 20.466 80.163 1.00 63.23 C ATOM 27 CE2 TYR A 415 -10.362 18.499 81.508 1.00 55.83 C ATOM 28 CZ TYR A 415 -10.633 19.092 80.289 1.00 63.29 C ATOM 29 OH TYR A 415 -10.925 18.319 79.187 1.00 70.03 O ATOM 30 HH TYR A 415 -11.091 18.907 78.408 1.00 0.00 H ATOM 31 H TYR A 415 -10.889 23.960 83.730 1.00 0.00 H ATOM 32 N GLU A 416 -10.815 23.201 86.627 1.00 31.71 N ATOM 33 CA GLU A 416 -10.471 23.368 88.033 1.00 30.12 C ATOM 34 C GLU A 416 -11.517 22.696 88.915 1.00 29.38 C ATOM 35 O GLU A 416 -12.724 22.866 88.703 1.00 31.07 O ATOM 36 CB GLU A 416 -10.372 24.851 88.386 1.00 31.17 C ATOM 37 CG GLU A 416 -9.847 25.116 89.786 1.00 35.01 C ATOM 38 CD GLU A 416 -8.338 25.018 89.867 1.00 36.08 C ATOM 39 OE1 GLU A 416 -7.679 25.136 88.809 1.00 42.08 O ATOM 40 OE2 GLU A 416 -7.809 24.833 90.985 1.00 33.95 O ATOM 41 H GLU A 416 -11.261 23.987 86.113 1.00 0.00 H ATOM 42 N ILE A 417 -11.051 21.946 89.912 1.00 27.38 N ATOM 43 CA ILE A 417 -11.914 21.222 90.837 1.00 26.54 C ATOM 44 C ILE A 417 -11.696 21.775 92.240 1.00 26.02 C ATOM 45 O ILE A 417 -10.553 21.967 92.664 1.00 28.20 O ATOM 46 CB ILE A 417 -11.629 19.706 90.791 1.00 25.74 C ATOM 47 CG1 ILE A 417 -12.057 19.124 89.441 1.00 26.73 C ATOM 48 CG2 ILE A 417 -12.364 18.976 91.907 1.00 29.45 C ATOM 49 CD1 ILE A 417 -11.736 17.645 89.289 1.00 27.20 C ATOM 50 H ILE A 417 -10.021 21.873 90.037 1.00 0.00 H ATOM 51 N GLN A 418 -12.792 22.032 92.954 1.00 27.49 N ATOM 52 CA GLN A 418 -12.703 22.437 94.353 1.00 29.55 C ATOM 53 C GLN A 418 -12.212 21.272 95.205 1.00 26.60 C ATOM 54 O GLN A 418 -12.714 20.149 95.090 1.00 25.58 O ATOM 55 CB GLN A 418 -14.063 22.926 94.854 1.00 32.52 C ATOM 56 CG GLN A 418 -14.346 24.403 94.587 1.00 34.07 C ATOM 57 CD GLN A 418 -13.775 25.324 95.658 1.00 35.10 C ATOM 58 OE1 GLN A 418 -12.688 25.882 95.499 1.00 34.44 O ATOM 59 NE2 GLN A 418 -14.510 25.485 96.756 1.00 29.99 N ATOM 60 HE22 GLN A 418 -15.422 24.994 96.848 1.00 0.00 H ATOM 61 HE21 GLN A 418 -14.172 26.102 97.522 1.00 0.00 H ATOM 62 H GLN A 418 -13.726 21.942 92.506 1.00 0.00 H ATOM 63 N ARG A 419 -11.227 21.541 96.066 1.00 26.57 N ATOM 64 CA ARG A 419 -10.588 20.462 96.822 1.00 25.28 C ATOM 65 C ARG A 419 -11.558 19.733 97.739 1.00 24.73 C ATOM 66 O ARG A 419 -11.387 18.535 97.992 1.00 26.77 O ATOM 67 CB ARG A 419 -9.411 20.993 97.643 1.00 31.65 C ATOM 68 CG ARG A 419 -8.487 19.875 98.119 1.00 33.29 C ATOM 69 CD ARG A 419 -7.341 20.368 98.974 1.00 36.90 C ATOM 70 NE ARG A 419 -6.521 21.368 98.296 1.00 36.70 N ATOM 71 CZ ARG A 419 -5.509 21.094 97.475 1.00 36.23 C ATOM 72 NH1 ARG A 419 -5.180 19.838 97.197 1.00 28.07 N ATOM 73 NH2 ARG A 419 -4.827 22.089 96.922 1.00 36.47 N ATOM 74 HE ARG A 419 -6.744 22.369 98.467 1.00 0.00 H ATOM 75 HH12 ARG A 419 -4.387 19.638 96.554 1.00 0.00 H ATOM 76 HH11 ARG A 419 -5.715 19.054 97.622 1.00 0.00 H ATOM 77 HH22 ARG A 419 -4.035 21.883 96.280 1.00 0.00 H ATOM 78 HH21 ARG A 419 -5.084 23.075 97.131 1.00 0.00 H ATOM 79 H ARG A 419 -10.912 22.523 96.200 1.00 0.00 H ATOM 80 N GLU A 420 -12.574 20.431 98.253 1.00 26.20 N ATOM 81 CA GLU A 420 -13.523 19.797 99.161 1.00 30.52 C ATOM 82 C GLU A 420 -14.370 18.730 98.479 1.00 28.68 C ATOM 83 O GLU A 420 -15.005 17.926 99.173 1.00 30.13 O ATOM 84 CB GLU A 420 -14.414 20.862 99.790 1.00 30.97 C ATOM 85 CG GLU A 420 -13.650 21.806 100.714 1.00 34.08 C ATOM 86 CD GLU A 420 -12.920 22.934 99.979 1.00 44.43 C ATOM 87 OE1 GLU A 420 -12.181 23.684 100.652 1.00 47.82 O ATOM 88 OE2 GLU A 420 -13.072 23.077 98.741 1.00 39.91 O ATOM 89 H GLU A 420 -12.689 21.434 98.004 1.00 0.00 H ATOM 90 N ARG A 421 -14.393 18.698 97.149 1.00 26.45 N ATOM 91 CA ARG A 421 -15.108 17.661 96.420 1.00 25.98 C ATOM 92 C ARG A 421 -14.280 16.395 96.227 1.00 31.19 C ATOM 93 O ARG A 421 -14.789 15.429 95.646 1.00 31.23 O ATOM 94 CB ARG A 421 -15.553 18.193 95.060 1.00 28.23 C ATOM 95 CG ARG A 421 -16.609 19.280 95.142 1.00 27.46 C ATOM 96 CD ARG A 421 -17.042 19.751 93.744 1.00 34.70 C ATOM 97 NE ARG A 421 -18.187 20.660 93.809 1.00 34.03 N ATOM 98 CZ ARG A 421 -19.437 20.290 94.086 1.00 31.88 C ATOM 99 NH1 ARG A 421 -19.734 19.018 94.321 1.00 33.63 N ATOM 100 NH2 ARG A 421 -20.400 21.197 94.127 1.00 33.85 N ATOM 101 HE ARG A 421 -18.012 21.669 93.626 1.00 0.00 H ATOM 102 HH12 ARG A 421 -20.714 18.744 94.536 1.00 0.00 H ATOM 103 HH11 ARG A 421 -18.987 18.295 94.290 1.00 0.00 H ATOM 104 HH22 ARG A 421 -21.376 20.910 94.343 1.00 0.00 H ATOM 105 HH21 ARG A 421 -20.181 22.197 93.943 1.00 0.00 H ATOM 106 H ARG A 421 -13.887 19.434 96.616 1.00 0.00 H ATOM 107 N ILE A 422 -13.035 16.374 96.702 1.00 24.62 N ATOM 108 CA ILE A 422 -12.163 15.202 96.625 1.00 28.98 C ATOM 109 C ILE A 422 -11.975 14.633 98.023 1.00 31.18 C ATOM 110 O ILE A 422 -11.534 15.340 98.936 1.00 37.66 O ATOM 111 CB ILE A 422 -10.796 15.537 96.010 1.00 26.74 C ATOM 112 CG1 ILE A 422 -10.959 16.190 94.641 1.00 26.86 C ATOM 113 CG2 ILE A 422 -9.938 14.286 95.907 1.00 34.03 C ATOM 114 CD1 ILE A 422 -11.419 15.227 93.560 1.00 25.81 C ATOM 115 H ILE A 422 -12.664 17.236 97.151 1.00 0.00 H ATOM 116 N GLU A 423 -12.276 13.350 98.184 1.00 33.23 N ATOM 117 CA GLU A 423 -11.923 12.606 99.386 1.00 37.20 C ATOM 118 C GLU A 423 -10.675 11.786 99.078 1.00 35.78 C ATOM 119 O GLU A 423 -10.731 10.822 98.307 1.00 34.82 O ATOM 120 CB GLU A 423 -13.075 11.713 99.839 1.00 42.35 C ATOM 121 CG GLU A 423 -13.915 12.298 100.959 1.00 52.06 C ATOM 122 CD GLU A 423 -14.867 11.277 101.555 1.00 56.66 C ATOM 123 OE1 GLU A 423 -14.636 10.856 102.709 1.00 60.62 O ATOM 124 OE2 GLU A 423 -15.841 10.893 100.870 1.00 55.64 O ATOM 125 H GLU A 423 -12.784 12.857 97.422 1.00 0.00 H ATOM 126 N LEU A 424 -9.550 12.175 99.667 1.00 32.02 N ATOM 127 CA LEU A 424 -8.297 11.482 99.412 1.00 37.01 C ATOM 128 C LEU A 424 -8.288 10.119 100.096 1.00 42.83 C ATOM 129 O LEU A 424 -8.744 9.974 101.234 1.00 44.94 O ATOM 130 CB LEU A 424 -7.123 12.328 99.902 1.00 38.00 C ATOM 131 CG LEU A 424 -5.721 11.935 99.435 1.00 44.03 C ATOM 132 CD1 LEU A 424 -5.460 12.420 98.015 1.00 40.17 C ATOM 133 CD2 LEU A 424 -4.679 12.490 100.395 1.00 47.65 C ATOM 134 H LEU A 424 -9.565 12.985 100.319 1.00 0.00 H ATOM 135 N GLY A 425 -7.765 9.115 99.391 1.00 40.56 N ATOM 136 CA GLY A 425 -7.655 7.776 99.941 1.00 37.83 C ATOM 137 C GLY A 425 -6.239 7.231 99.961 1.00 42.82 C ATOM 138 O GLY A 425 -5.277 7.987 100.126 1.00 44.91 O ATOM 139 H GLY A 425 -7.428 9.296 98.424 1.00 0.00 H ATOM 140 N ARG A 426 -6.095 5.920 99.780 1.00 46.55 N ATOM 141 CA ARG A 426 -4.809 5.257 99.937 1.00 47.65 C ATOM 142 C ARG A 426 -3.882 5.531 98.752 1.00 44.59 C ATOM 143 O ARG A 426 -4.319 5.819 97.635 1.00 38.43 O ATOM 144 CB ARG A 426 -5.008 3.750 100.098 1.00 49.82 C ATOM 145 H ARG A 426 -6.926 5.353 99.519 1.00 0.00 H ATOM 146 N CYS A 427 -2.579 5.414 99.011 1.00 38.04 N ATOM 147 CA CYS A 427 -1.559 5.559 97.979 1.00 42.62 C ATOM 148 C CYS A 427 -1.500 4.320 97.087 1.00 44.53 C ATOM 149 O CYS A 427 -1.685 3.190 97.547 1.00 44.75 O ATOM 150 CB CYS A 427 -0.191 5.805 98.622 1.00 39.45 C ATOM 151 SG CYS A 427 1.179 5.866 97.463 1.00 46.42 S ATOM 152 H CYS A 427 -2.279 5.212 99.986 1.00 0.00 H ATOM 153 N ILE A 428 -1.223 4.541 95.795 1.00 39.47 N ATOM 154 CA ILE A 428 -1.175 3.450 94.825 1.00 38.89 C ATOM 155 C ILE A 428 0.017 3.571 93.875 1.00 36.91 C ATOM 156 O ILE A 428 0.040 2.919 92.824 1.00 53.25 O ATOM 157 CB ILE A 428 -2.485 3.371 94.013 1.00 43.28 C ATOM 158 CG1 ILE A 428 -2.716 4.665 93.227 1.00 41.00 C ATOM 159 CG2 ILE A 428 -3.681 3.067 94.911 1.00 41.13 C ATOM 160 CD1 ILE A 428 -4.052 4.711 92.511 1.00 38.01 C ATOM 161 H ILE A 428 -1.038 5.513 95.475 1.00 0.00 H ATOM 162 N GLY A 429 1.011 4.379 94.216 1.00 40.32 N ATOM 163 CA GLY A 429 2.199 4.485 93.389 1.00 42.58 C ATOM 164 C GLY A 429 2.833 5.858 93.503 1.00 48.98 C ATOM 165 O GLY A 429 2.446 6.672 94.337 1.00 40.09 O ATOM 166 H GLY A 429 0.939 4.944 95.086 1.00 0.00 H ATOM 167 N GLU A 430 3.817 6.100 92.630 1.00 48.86 N ATOM 168 CA GLU A 430 4.614 7.322 92.668 1.00 58.76 C ATOM 169 C GLU A 430 4.850 7.829 91.247 1.00 60.84 C ATOM 170 O GLU A 430 4.356 7.261 90.269 1.00 64.43 O ATOM 171 CB GLU A 430 5.945 7.085 93.396 1.00 58.90 C ATOM 172 H GLU A 430 4.022 5.391 91.897 1.00 0.00 H ATOM 173 N GLY A 431 5.613 8.912 91.137 1.00 56.69 N ATOM 174 CA GLY A 431 5.956 9.459 89.838 1.00 52.15 C ATOM 175 C GLY A 431 7.115 10.422 89.965 1.00 59.93 C ATOM 176 O GLY A 431 7.630 10.666 91.059 1.00 65.81 O ATOM 177 H GLY A 431 5.970 9.375 91.997 1.00 0.00 H ATOM 178 N GLN A 432 7.518 10.977 88.817 1.00 58.05 N ATOM 179 CA GLN A 432 8.562 11.997 88.794 1.00 61.12 C ATOM 180 C GLN A 432 8.294 13.120 89.791 1.00 63.82 C ATOM 181 O GLN A 432 9.234 13.817 90.194 1.00 67.34 O ATOM 182 CB GLN A 432 8.695 12.567 87.377 1.00 61.80 C ATOM 183 CG GLN A 432 9.941 13.418 87.121 1.00 68.96 C ATOM 184 CD GLN A 432 9.696 14.534 86.112 1.00 74.06 C ATOM 185 OE1 GLN A 432 9.150 14.300 85.032 1.00 74.44 O ATOM 186 NE2 GLN A 432 10.115 15.749 86.454 1.00 77.12 N ATOM 187 HE22 GLN A 432 10.571 15.901 87.376 1.00 0.00 H ATOM 188 HE21 GLN A 432 9.987 16.547 85.799 1.00 0.00 H ATOM 189 H GLN A 432 7.079 10.676 87.923 1.00 0.00 H ATOM 190 N PHE A 433 7.041 13.285 90.231 1.00 56.28 N ATOM 191 CA PHE A 433 6.651 14.419 91.050 1.00 52.71 C ATOM 192 C PHE A 433 6.148 14.053 92.438 1.00 52.95 C ATOM 193 O PHE A 433 6.186 14.910 93.327 1.00 52.93 O ATOM 194 CB PHE A 433 5.570 15.230 90.327 1.00 51.35 C ATOM 195 CG PHE A 433 6.009 15.757 88.992 1.00 54.72 C ATOM 196 CD1 PHE A 433 6.788 16.898 88.906 1.00 53.86 C ATOM 197 CD2 PHE A 433 5.652 15.105 87.824 1.00 51.93 C ATOM 198 CE1 PHE A 433 7.195 17.385 87.681 1.00 54.35 C ATOM 199 CE2 PHE A 433 6.054 15.590 86.593 1.00 53.64 C ATOM 200 CZ PHE A 433 6.828 16.730 86.522 1.00 55.32 C ATOM 201 H PHE A 433 6.322 12.577 89.978 1.00 0.00 H ATOM 202 N GLY A 434 5.674 12.832 92.650 1.00 47.60 N ATOM 203 CA GLY A 434 5.247 12.428 93.973 1.00 48.76 C ATOM 204 C GLY A 434 4.318 11.229 93.925 1.00 46.37 C ATOM 205 O GLY A 434 4.194 10.550 92.908 1.00 46.75 O ATOM 206 H GLY A 434 5.609 12.160 91.859 1.00 0.00 H ATOM 207 N ASP A 435 3.665 10.997 95.063 1.00 39.27 N ATOM 208 CA ASP A 435 2.788 9.848 95.242 1.00 40.79 C ATOM 209 C ASP A 435 1.490 10.002 94.455 1.00 40.10 C ATOM 210 O ASP A 435 1.017 11.111 94.203 1.00 38.17 O ATOM 211 CB ASP A 435 2.455 9.658 96.724 1.00 45.89 C ATOM 212 CG ASP A 435 3.665 9.259 97.551 1.00 57.35 C ATOM 213 OD1 ASP A 435 4.414 8.358 97.117 1.00 62.67 O ATOM 214 OD2 ASP A 435 3.859 9.830 98.644 1.00 61.45 O ATOM 215 H ASP A 435 3.786 11.662 95.854 1.00 0.00 H ATOM 216 N VAL A 436 0.908 8.864 94.082 1.00 37.48 N ATOM 217 CA VAL A 436 -0.391 8.804 93.418 1.00 30.62 C ATOM 218 C VAL A 436 -1.360 8.118 94.369 1.00 30.32 C ATOM 219 O VAL A 436 -1.060 7.041 94.898 1.00 38.12 O ATOM 220 CB VAL A 436 -0.310 8.052 92.075 1.00 31.95 C ATOM 221 CG1 VAL A 436 -1.611 8.206 91.287 1.00 34.57 C ATOM 222 CG2 VAL A 436 0.876 8.543 91.265 1.00 32.65 C ATOM 223 H VAL A 436 1.405 7.971 94.274 1.00 0.00 H ATOM 224 N HIS A 437 -2.505 8.747 94.607 1.00 30.02 N ATOM 225 CA HIS A 437 -3.535 8.191 95.467 1.00 31.39 C ATOM 226 C HIS A 437 -4.775 7.840 94.657 1.00 36.50 C ATOM 227 O HIS A 437 -4.981 8.331 93.545 1.00 30.54 O ATOM 228 CB HIS A 437 -3.932 9.180 96.571 1.00 29.22 C ATOM 229 CG HIS A 437 -2.913 9.332 97.659 1.00 35.24 C ATOM 230 ND1 HIS A 437 -3.144 8.925 98.955 1.00 36.35 N ATOM 231 CD2 HIS A 437 -1.669 9.867 97.649 1.00 34.22 C ATOM 232 CE1 HIS A 437 -2.083 9.194 99.695 1.00 34.02 C ATOM 233 NE2 HIS A 437 -1.174 9.765 98.926 1.00 33.87 N ATOM 234 H HIS A 437 -2.670 9.672 94.161 1.00 0.00 H ATOM 235 N GLN A 438 -5.598 6.970 95.236 1.00 31.17 N ATOM 236 CA GLN A 438 -6.972 6.755 94.810 1.00 33.95 C ATOM 237 C GLN A 438 -7.891 7.543 95.738 1.00 30.00 C ATOM 238 O GLN A 438 -7.523 7.852 96.870 1.00 31.16 O ATOM 239 CB GLN A 438 -7.308 5.259 94.830 1.00 46.27 C ATOM 240 CG GLN A 438 -8.719 4.884 95.270 1.00 49.88 C ATOM 241 CD GLN A 438 -8.836 3.417 95.657 1.00 51.10 C ATOM 242 OE1 GLN A 438 -8.340 2.533 94.953 1.00 53.71 O ATOM 243 NE2 GLN A 438 -9.499 3.153 96.776 1.00 50.44 N ATOM 244 HE22 GLN A 438 -9.900 3.930 97.338 1.00 0.00 H ATOM 245 HE21 GLN A 438 -9.617 2.169 97.091 1.00 0.00 H ATOM 246 H GLN A 438 -5.239 6.413 96.037 1.00 0.00 H ATOM 247 N GLY A 439 -9.069 7.900 95.244 1.00 29.77 N ATOM 248 CA GLY A 439 -9.991 8.665 96.053 1.00 29.23 C ATOM 249 C GLY A 439 -11.370 8.731 95.438 1.00 31.49 C ATOM 250 O GLY A 439 -11.699 7.971 94.525 1.00 31.51 O ATOM 251 H GLY A 439 -9.330 7.629 94.274 1.00 0.00 H ATOM 252 N ILE A 440 -12.169 9.670 95.949 1.00 33.04 N ATOM 253 CA ILE A 440 -13.575 9.818 95.581 1.00 30.38 C ATOM 254 C ILE A 440 -13.852 11.274 95.239 1.00 34.80 C ATOM 255 O ILE A 440 -13.437 12.177 95.973 1.00 32.57 O ATOM 256 CB ILE A 440 -14.508 9.345 96.711 1.00 37.88 C ATOM 257 CG1 ILE A 440 -14.377 7.833 96.893 1.00 46.77 C ATOM 258 CG2 ILE A 440 -15.948 9.754 96.432 1.00 41.28 C ATOM 259 CD1 ILE A 440 -14.960 7.033 95.749 1.00 49.26 C ATOM 260 H ILE A 440 -11.770 10.331 96.646 1.00 0.00 H ATOM 261 N TYR A 441 -14.572 11.500 94.137 1.00 31.59 N ATOM 262 CA TYR A 441 -14.884 12.842 93.643 1.00 28.07 C ATOM 263 C TYR A 441 -16.395 13.060 93.598 1.00 31.21 C ATOM 264 O TYR A 441 -17.110 12.381 92.850 1.00 33.85 O ATOM 265 CB TYR A 441 -14.251 13.071 92.263 1.00 30.18 C ATOM 266 CG TYR A 441 -14.716 14.311 91.525 1.00 27.04 C ATOM 267 CD1 TYR A 441 -14.860 15.526 92.184 1.00 27.27 C ATOM 268 CD2 TYR A 441 -14.990 14.265 90.161 1.00 28.15 C ATOM 269 CE1 TYR A 441 -15.285 16.660 91.507 1.00 28.07 C ATOM 270 CE2 TYR A 441 -15.404 15.389 89.469 1.00 28.74 C ATOM 271 CZ TYR A 441 -15.550 16.585 90.150 1.00 31.81 C ATOM 272 OH TYR A 441 -15.965 17.706 89.464 1.00 35.72 O ATOM 273 HH TYR A 441 -15.316 17.910 88.745 1.00 0.00 H ATOM 274 H TYR A 441 -14.929 10.682 93.603 1.00 0.00 H ATOM 275 N MET A 442 -16.869 14.031 94.382 1.00 30.83 N ATOM 276 CA MET A 442 -18.280 14.400 94.432 1.00 37.84 C ATOM 277 C MET A 442 -18.493 15.652 93.581 1.00 33.04 C ATOM 278 O MET A 442 -18.143 16.755 94.008 1.00 33.54 O ATOM 279 CB MET A 442 -18.715 14.675 95.874 1.00 39.06 C ATOM 280 CG MET A 442 -18.302 13.649 96.917 1.00 53.06 C ATOM 281 SD MET A 442 -18.314 14.321 98.608 1.00 62.12 S ATOM 282 CE MET A 442 -16.716 15.147 98.660 1.00 50.30 C ATOM 283 H MET A 442 -16.200 14.550 94.986 1.00 0.00 H ATOM 284 N SER A 443 -19.080 15.489 92.397 1.00 38.62 N ATOM 285 CA SER A 443 -19.486 16.587 91.533 1.00 44.54 C ATOM 286 C SER A 443 -21.002 16.722 91.577 1.00 51.40 C ATOM 287 O SER A 443 -21.690 15.840 92.095 1.00 59.96 O ATOM 288 CB SER A 443 -19.017 16.352 90.090 1.00 48.57 C ATOM 289 OG SER A 443 -19.930 15.534 89.391 1.00 46.55 O ATOM 290 HG SER A 443 -20.817 15.974 89.371 1.00 0.00 H ATOM 291 H SER A 443 -19.259 14.518 92.070 1.00 0.00 H ATOM 292 N PRO A 444 -21.559 17.822 91.059 1.00 58.23 N ATOM 293 CA PRO A 444 -23.032 17.931 91.046 1.00 60.22 C ATOM 294 C PRO A 444 -23.722 16.826 90.268 1.00 66.44 C ATOM 295 O PRO A 444 -24.763 16.315 90.702 1.00 71.92 O ATOM 296 CB PRO A 444 -23.264 19.309 90.411 1.00 62.79 C ATOM 297 CG PRO A 444 -22.050 20.092 90.850 1.00 58.77 C ATOM 298 CD PRO A 444 -20.926 19.085 90.632 1.00 56.60 C ATOM 299 N GLU A 445 -23.150 16.434 89.136 1.00 65.54 N ATOM 300 CA GLU A 445 -23.724 15.452 88.229 1.00 68.58 C ATOM 301 C GLU A 445 -22.781 14.256 88.144 1.00 68.96 C ATOM 302 O GLU A 445 -21.581 14.427 87.908 1.00 74.64 O ATOM 303 CB GLU A 445 -23.957 16.080 86.851 1.00 67.43 C ATOM 304 H GLU A 445 -22.234 16.855 88.882 1.00 0.00 H ATOM 305 N ASN A 446 -23.333 13.052 88.368 1.00 70.34 N ATOM 306 CA ASN A 446 -22.711 11.733 88.570 1.00 71.47 C ATOM 307 C ASN A 446 -21.922 11.517 89.870 1.00 68.85 C ATOM 308 O ASN A 446 -21.066 10.616 89.894 1.00 59.44 O ATOM 309 CB ASN A 446 -21.782 11.391 87.404 1.00 69.77 C ATOM 310 H ASN A 446 -24.372 13.052 88.405 1.00 0.00 H ATOM 311 N PRO A 447 -22.158 12.244 90.974 1.00 65.08 N ATOM 312 CA PRO A 447 -21.435 11.902 92.206 1.00 64.57 C ATOM 313 C PRO A 447 -21.967 10.597 92.767 1.00 71.71 C ATOM 314 O PRO A 447 -23.163 10.304 92.677 1.00 74.04 O ATOM 315 CB PRO A 447 -21.765 13.062 93.147 1.00 67.86 C ATOM 316 CG PRO A 447 -23.192 13.336 92.796 1.00 70.21 C ATOM 317 CD PRO A 447 -23.167 13.290 91.267 1.00 67.63 C ATOM 318 N ALA A 448 -21.076 9.807 93.359 1.00 70.78 N ATOM 319 CA ALA A 448 -19.677 10.143 93.527 1.00 62.93 C ATOM 320 C ALA A 448 -18.826 9.169 92.709 1.00 61.12 C ATOM 321 O ALA A 448 -19.142 7.975 92.603 1.00 64.03 O ATOM 322 CB ALA A 448 -19.300 10.111 95.003 1.00 64.46 C ATOM 323 H ALA A 448 -21.404 8.890 93.724 1.00 0.00 H ATOM 324 N MET A 449 -17.744 9.685 92.141 1.00 45.39 N ATOM 325 CA MET A 449 -16.951 8.968 91.154 1.00 39.48 C ATOM 326 C MET A 449 -15.580 8.599 91.715 1.00 40.96 C ATOM 327 O MET A 449 -14.935 9.401 92.396 1.00 41.81 O ATOM 328 CB MET A 449 -16.816 9.834 89.895 1.00 43.74 C ATOM 329 CG MET A 449 -15.632 9.550 88.996 1.00 47.21 C ATOM 330 SD MET A 449 -15.277 10.924 87.863 1.00 55.22 S ATOM 331 CE MET A 449 -16.932 11.505 87.495 1.00 49.15 C ATOM 332 H MET A 449 -17.449 10.645 92.413 1.00 0.00 H ATOM 333 N ALA A 450 -15.140 7.374 91.431 1.00 32.89 N ATOM 334 CA ALA A 450 -13.808 6.947 91.842 1.00 31.10 C ATOM 335 C ALA A 450 -12.747 7.579 90.945 1.00 28.83 C ATOM 336 O ALA A 450 -12.880 7.598 89.718 1.00 39.80 O ATOM 337 CB ALA A 450 -13.700 5.423 91.792 1.00 38.33 C ATOM 338 H ALA A 450 -15.753 6.715 90.910 1.00 0.00 H ATOM 339 N VAL A 451 -11.681 8.103 91.558 1.00 29.59 N ATOM 340 CA VAL A 451 -10.638 8.804 90.817 1.00 26.27 C ATOM 341 C VAL A 451 -9.262 8.414 91.327 1.00 28.25 C ATOM 342 O VAL A 451 -9.101 7.901 92.437 1.00 27.55 O ATOM 343 CB VAL A 451 -10.777 10.338 90.912 1.00 21.78 C ATOM 344 CG1 VAL A 451 -12.054 10.804 90.228 1.00 23.74 C ATOM 345 CG2 VAL A 451 -10.739 10.779 92.372 1.00 22.83 C ATOM 346 H VAL A 451 -11.593 8.009 92.590 1.00 0.00 H ATOM 347 N ALA A 452 -8.260 8.694 90.493 1.00 23.36 N ATOM 348 CA ALA A 452 -6.860 8.700 90.887 1.00 24.40 C ATOM 349 C ALA A 452 -6.396 10.138 91.098 1.00 27.35 C ATOM 350 O ALA A 452 -6.801 11.039 90.361 1.00 27.47 O ATOM 351 CB ALA A 452 -6.002 8.028 89.818 1.00 25.64 C ATOM 352 H ALA A 452 -8.493 8.921 89.505 1.00 0.00 H ATOM 353 N ILE A 453 -5.547 10.349 92.103 1.00 23.40 N ATOM 354 CA ILE A 453 -5.072 11.684 92.471 1.00 24.06 C ATOM 355 C ILE A 453 -3.552 11.675 92.401 1.00 26.08 C ATOM 356 O ILE A 453 -2.892 11.011 93.210 1.00 30.73 O ATOM 357 CB ILE A 453 -5.554 12.098 93.866 1.00 28.34 C ATOM 358 CG1 ILE A 453 -7.084 12.110 93.915 1.00 31.91 C ATOM 359 CG2 ILE A 453 -4.993 13.483 94.244 1.00 29.12 C ATOM 360 CD1 ILE A 453 -7.659 11.581 95.202 1.00 40.05 C ATOM 361 H ILE A 453 -5.208 9.531 92.649 1.00 0.00 H ATOM 362 N LYS A 454 -2.994 12.412 91.444 1.00 25.44 N ATOM 363 CA LYS A 454 -1.551 12.606 91.352 1.00 25.77 C ATOM 364 C LYS A 454 -1.146 13.777 92.237 1.00 27.66 C ATOM 365 O LYS A 454 -1.714 14.868 92.129 1.00 29.47 O ATOM 366 CB LYS A 454 -1.128 12.872 89.904 1.00 35.62 C ATOM 367 CG LYS A 454 -1.285 11.668 88.972 1.00 36.84 C ATOM 368 CD LYS A 454 -0.988 12.016 87.509 1.00 34.71 C ATOM 369 CE LYS A 454 0.314 12.791 87.340 1.00 44.06 C ATOM 370 NZ LYS A 454 0.549 13.207 85.916 1.00 44.35 N ATOM 371 HZ1 LYS A 454 0.596 12.361 85.312 1.00 0.00 H ATOM 372 HZ2 LYS A 454 -0.233 13.816 85.601 1.00 0.00 H ATOM 373 HZ3 LYS A 454 1.446 13.730 85.852 1.00 0.00 H ATOM 374 H LYS A 454 -3.608 12.865 90.737 1.00 0.00 H ATOM 375 N THR A 455 -0.171 13.552 93.114 1.00 30.83 N ATOM 376 CA THR A 455 0.335 14.597 93.992 1.00 31.72 C ATOM 377 C THR A 455 1.746 14.991 93.570 1.00 38.01 C ATOM 378 O THR A 455 2.421 14.282 92.817 1.00 34.90 O ATOM 379 CB THR A 455 0.321 14.153 95.465 1.00 29.00 C ATOM 380 OG1 THR A 455 1.340 13.169 95.690 1.00 32.36 O ATOM 381 CG2 THR A 455 -1.035 13.566 95.835 1.00 36.40 C ATOM 382 HG1 THR A 455 1.173 12.384 95.111 1.00 0.00 H ATOM 383 H THR A 455 0.243 12.600 93.174 1.00 0.00 H ATOM 384 N CYS A 456 2.175 16.153 94.057 1.00 47.06 N ATOM 385 CA CYS A 456 3.469 16.741 93.723 1.00 47.60 C ATOM 386 C CYS A 456 4.168 17.096 95.028 1.00 52.37 C ATOM 387 O CYS A 456 3.726 18.000 95.744 1.00 55.45 O ATOM 388 CB CYS A 456 3.289 17.976 92.839 1.00 50.97 C ATOM 389 SG CYS A 456 4.799 18.648 92.103 1.00 49.41 S ATOM 390 H CYS A 456 1.554 16.671 94.711 1.00 0.00 H ATOM 391 N LYS A 457 5.253 16.384 95.341 1.00 51.87 N ATOM 392 CA LYS A 457 5.886 16.551 96.646 1.00 56.16 C ATOM 393 C LYS A 457 6.506 17.933 96.811 1.00 61.45 C ATOM 394 O LYS A 457 6.510 18.479 97.920 1.00 64.61 O ATOM 395 CB LYS A 457 6.938 15.463 96.862 1.00 55.87 C ATOM 396 H LYS A 457 5.648 15.710 94.655 1.00 0.00 H ATOM 397 N ASN A 458 7.016 18.516 95.733 1.00 62.77 N ATOM 398 CA ASN A 458 7.674 19.814 95.807 1.00 59.03 C ATOM 399 C ASN A 458 6.887 20.904 95.081 1.00 58.25 C ATOM 400 O ASN A 458 5.700 20.740 94.785 1.00 48.35 O ATOM 401 CB ASN A 458 9.088 19.719 95.230 1.00 60.58 C ATOM 402 H ASN A 458 6.944 18.035 94.814 1.00 0.00 H TER 403 ASN A 458 ATOM 404 N SER A 461 7.563 25.211 94.776 1.00 63.03 N ATOM 405 CA SER A 461 8.726 25.355 93.911 1.00 66.82 C ATOM 406 C SER A 461 8.424 26.273 92.730 1.00 69.09 C ATOM 407 O SER A 461 9.104 27.279 92.526 1.00 78.49 O ATOM 408 CB SER A 461 9.200 23.990 93.423 1.00 65.85 C ATOM 409 OG SER A 461 10.369 24.109 92.639 1.00 74.99 O ATOM 410 HG SER A 461 10.181 24.680 91.852 1.00 0.00 H ATOM 411 HN3 SER A 461 6.776 24.804 94.231 1.00 0.00 H ATOM 412 HN2 SER A 461 7.287 26.144 95.142 1.00 0.00 H ATOM 413 HN1 SER A 461 7.799 24.582 95.570 1.00 0.00 H ATOM 414 N ASP A 462 7.412 25.908 91.954 1.00 64.18 N ATOM 415 CA ASP A 462 6.959 26.679 90.802 1.00 61.54 C ATOM 416 C ASP A 462 7.753 26.367 89.550 1.00 71.21 C ATOM 417 O ASP A 462 7.421 26.827 88.460 1.00 76.33 O ATOM 418 CB ASP A 462 6.996 28.177 91.093 1.00 62.79 C ATOM 419 H ASP A 462 6.914 25.023 92.180 1.00 0.00 H ATOM 420 N SER A 463 8.792 25.562 89.701 1.00 66.91 N ATOM 421 CA SER A 463 9.582 25.159 88.562 1.00 64.71 C ATOM 422 C SER A 463 8.963 23.818 88.235 1.00 61.42 C ATOM 423 O SER A 463 8.675 23.512 87.083 1.00 63.05 O ATOM 424 CB SER A 463 11.060 25.031 88.926 1.00 64.66 C ATOM 425 OG SER A 463 11.231 24.434 90.200 1.00 66.76 O ATOM 426 HG SER A 463 10.786 24.991 90.887 1.00 0.00 H ATOM 427 H SER A 463 9.042 25.216 90.649 1.00 0.00 H ATOM 428 N VAL A 464 8.741 23.042 89.291 1.00 61.85 N ATOM 429 CA VAL A 464 8.117 21.726 89.227 1.00 58.16 C ATOM 430 C VAL A 464 6.612 21.849 89.000 1.00 55.76 C ATOM 431 O VAL A 464 6.019 21.047 88.270 1.00 57.49 O ATOM 432 CB VAL A 464 8.449 20.928 90.505 1.00 57.80 C ATOM 433 CG1 VAL A 464 9.950 20.912 90.740 1.00 63.96 C ATOM 434 CG2 VAL A 464 7.739 21.504 91.721 1.00 59.18 C ATOM 435 H VAL A 464 9.032 23.397 90.224 1.00 0.00 H ATOM 436 N ARG A 465 5.976 22.854 89.617 1.00 53.04 N ATOM 437 CA ARG A 465 4.558 23.124 89.387 1.00 50.67 C ATOM 438 C ARG A 465 4.286 23.319 87.905 1.00 49.68 C ATOM 439 O ARG A 465 3.289 22.819 87.368 1.00 45.68 O ATOM 440 CB ARG A 465 4.153 24.370 90.179 1.00 54.86 C ATOM 441 CG ARG A 465 2.667 24.632 90.331 1.00 55.44 C ATOM 442 CD ARG A 465 2.426 25.500 91.564 1.00 56.60 C ATOM 443 NE ARG A 465 1.091 26.088 91.584 1.00 56.62 N ATOM 444 CZ ARG A 465 0.749 27.188 90.920 1.00 59.24 C ATOM 445 NH1 ARG A 465 1.644 27.825 90.177 1.00 60.74 N ATOM 446 NH2 ARG A 465 -0.490 27.650 90.993 1.00 63.85 N ATOM 447 HE ARG A 465 0.360 25.617 92.154 1.00 0.00 H ATOM 448 HH12 ARG A 465 1.373 28.685 89.659 1.00 0.00 H ATOM 449 HH11 ARG A 465 2.617 27.464 90.112 1.00 0.00 H ATOM 450 HH22 ARG A 465 -0.756 28.511 90.473 1.00 0.00 H ATOM 451 HH21 ARG A 465 -1.197 27.152 91.570 1.00 0.00 H ATOM 452 H ARG A 465 6.506 23.458 90.277 1.00 0.00 H ATOM 453 N GLU A 466 5.184 24.038 87.236 1.00 50.45 N ATOM 454 CA GLU A 466 5.146 24.205 85.790 1.00 53.09 C ATOM 455 C GLU A 466 5.083 22.861 85.071 1.00 46.58 C ATOM 456 O GLU A 466 4.161 22.598 84.290 1.00 38.68 O ATOM 457 CB GLU A 466 6.391 24.985 85.363 1.00 57.74 C ATOM 458 CG GLU A 466 6.533 25.248 83.879 1.00 61.41 C ATOM 459 CD GLU A 466 5.497 26.211 83.339 1.00 63.97 C ATOM 460 OE1 GLU A 466 4.316 25.829 83.235 1.00 66.95 O ATOM 461 OE2 GLU A 466 5.877 27.360 83.025 1.00 69.43 O ATOM 462 H GLU A 466 5.947 24.501 87.770 1.00 0.00 H ATOM 463 N LYS A 467 6.086 22.008 85.297 1.00 43.80 N ATOM 464 CA LYS A 467 6.159 20.746 84.567 1.00 41.30 C ATOM 465 C LYS A 467 5.047 19.799 84.992 1.00 40.53 C ATOM 466 O LYS A 467 4.534 19.032 84.170 1.00 40.24 O ATOM 467 CB LYS A 467 7.529 20.091 84.769 1.00 43.80 C ATOM 468 H LYS A 467 6.818 22.244 85.996 1.00 0.00 H ATOM 469 N PHE A 468 4.662 19.838 86.268 1.00 39.42 N ATOM 470 CA PHE A 468 3.610 18.948 86.751 1.00 35.56 C ATOM 471 C PHE A 468 2.310 19.158 85.984 1.00 32.94 C ATOM 472 O PHE A 468 1.739 18.211 85.430 1.00 33.30 O ATOM 473 CB PHE A 468 3.392 19.169 88.246 1.00 35.54 C ATOM 474 CG PHE A 468 2.568 18.097 88.905 1.00 38.89 C ATOM 475 CD1 PHE A 468 2.876 16.758 88.730 1.00 33.88 C ATOM 476 CD2 PHE A 468 1.479 18.432 89.690 1.00 42.78 C ATOM 477 CE1 PHE A 468 2.120 15.778 89.335 1.00 31.77 C ATOM 478 CE2 PHE A 468 0.717 17.457 90.296 1.00 39.46 C ATOM 479 CZ PHE A 468 1.038 16.129 90.119 1.00 39.10 C ATOM 480 H PHE A 468 5.114 20.507 86.924 1.00 0.00 H ATOM 481 N LEU A 469 1.835 20.405 85.925 1.00 33.92 N ATOM 482 CA LEU A 469 0.544 20.677 85.309 1.00 30.23 C ATOM 483 C LEU A 469 0.574 20.568 83.786 1.00 36.93 C ATOM 484 O LEU A 469 -0.480 20.349 83.177 1.00 39.16 O ATOM 485 CB LEU A 469 0.058 22.058 85.750 1.00 29.35 C ATOM 486 CG LEU A 469 -0.247 22.116 87.253 1.00 30.68 C ATOM 487 CD1 LEU A 469 -0.432 23.533 87.762 1.00 38.53 C ATOM 488 CD2 LEU A 469 -1.484 21.272 87.546 1.00 33.59 C ATOM 489 H LEU A 469 2.392 21.188 86.322 1.00 0.00 H ATOM 490 N GLN A 470 1.745 20.699 83.153 1.00 39.74 N ATOM 491 CA GLN A 470 1.815 20.504 81.704 1.00 36.69 C ATOM 492 C GLN A 470 1.401 19.094 81.305 1.00 41.90 C ATOM 493 O GLN A 470 0.826 18.896 80.228 1.00 44.27 O ATOM 494 CB GLN A 470 3.226 20.814 81.191 1.00 43.72 C ATOM 495 CG GLN A 470 3.397 20.722 79.668 1.00 48.02 C ATOM 496 CD GLN A 470 2.535 21.719 78.909 1.00 50.14 C ATOM 497 OE1 GLN A 470 2.677 22.934 79.071 1.00 55.01 O ATOM 498 NE2 GLN A 470 1.641 21.211 78.072 1.00 48.69 N ATOM 499 HE22 GLN A 470 1.555 20.180 77.966 1.00 0.00 H ATOM 500 HE21 GLN A 470 1.026 21.844 77.521 1.00 0.00 H ATOM 501 H GLN A 470 2.603 20.939 83.689 1.00 0.00 H ATOM 502 N GLU A 471 1.667 18.105 82.162 1.00 40.15 N ATOM 503 CA GLU A 471 1.229 16.741 81.878 1.00 36.07 C ATOM 504 C GLU A 471 -0.289 16.647 81.815 1.00 38.94 C ATOM 505 O GLU A 471 -0.838 15.900 80.997 1.00 40.03 O ATOM 506 CB GLU A 471 1.774 15.788 82.937 1.00 38.03 C ATOM 507 CG GLU A 471 3.247 15.963 83.218 1.00 38.59 C ATOM 508 CD GLU A 471 3.857 14.742 83.879 1.00 44.78 C ATOM 509 OE1 GLU A 471 4.984 14.363 83.494 1.00 42.14 O ATOM 510 OE2 GLU A 471 3.210 14.169 84.785 1.00 47.62 O ATOM 511 H GLU A 471 2.190 18.308 83.038 1.00 0.00 H ATOM 512 N ALA A 472 -0.986 17.377 82.689 1.00 34.03 N ATOM 513 CA ALA A 472 -2.443 17.408 82.625 1.00 32.81 C ATOM 514 C ALA A 472 -2.913 18.013 81.314 1.00 33.71 C ATOM 515 O ALA A 472 -3.842 17.502 80.677 1.00 32.45 O ATOM 516 CB ALA A 472 -3.006 18.201 83.804 1.00 33.51 C ATOM 517 H ALA A 472 -0.488 17.926 83.419 1.00 0.00 H ATOM 518 N LEU A 473 -2.291 19.125 80.912 1.00 33.12 N ATOM 519 CA LEU A 473 -2.555 19.709 79.602 1.00 37.59 C ATOM 520 C LEU A 473 -2.437 18.663 78.510 1.00 40.04 C ATOM 521 O LEU A 473 -3.283 18.588 77.611 1.00 43.32 O ATOM 522 CB LEU A 473 -1.568 20.846 79.334 1.00 42.85 C ATOM 523 CG LEU A 473 -1.980 22.295 79.568 1.00 56.57 C ATOM 524 CD1 LEU A 473 -0.763 23.202 79.397 1.00 48.46 C ATOM 525 CD2 LEU A 473 -3.086 22.690 78.606 1.00 57.08 C ATOM 526 H LEU A 473 -1.605 19.583 81.546 1.00 0.00 H ATOM 527 N THR A 474 -1.386 17.843 78.580 1.00 32.75 N ATOM 528 CA THR A 474 -1.147 16.832 77.557 1.00 38.35 C ATOM 529 C THR A 474 -2.336 15.891 77.424 1.00 32.37 C ATOM 530 O THR A 474 -2.796 15.610 76.314 1.00 35.67 O ATOM 531 CB THR A 474 0.130 16.055 77.887 1.00 32.98 C ATOM 532 OG1 THR A 474 1.262 16.912 77.710 1.00 33.56 O ATOM 533 CG2 THR A 474 0.278 14.821 76.985 1.00 40.63 C ATOM 534 HG1 THR A 474 1.182 17.692 78.314 1.00 0.00 H ATOM 535 H THR A 474 -0.725 17.927 79.379 1.00 0.00 H ATOM 536 N MET A 475 -2.867 15.406 78.549 1.00 29.72 N ATOM 537 CA MET A 475 -3.987 14.475 78.464 1.00 26.34 C ATOM 538 C MET A 475 -5.281 15.165 78.051 1.00 26.15 C ATOM 539 O MET A 475 -6.207 14.490 77.591 1.00 27.92 O ATOM 540 CB MET A 475 -4.185 13.744 79.794 1.00 24.36 C ATOM 541 CG MET A 475 -3.024 12.847 80.212 1.00 24.38 C ATOM 542 SD MET A 475 -2.329 11.819 78.885 1.00 25.46 S ATOM 543 CE MET A 475 -3.665 10.663 78.544 1.00 28.55 C ATOM 544 H MET A 475 -2.487 15.689 79.475 1.00 0.00 H ATOM 545 N ARG A 476 -5.357 16.494 78.193 1.00 32.23 N ATOM 546 CA ARG A 476 -6.581 17.213 77.858 1.00 33.47 C ATOM 547 C ARG A 476 -6.990 17.011 76.403 1.00 39.12 C ATOM 548 O ARG A 476 -8.187 16.977 76.099 1.00 31.86 O ATOM 549 CB ARG A 476 -6.414 18.708 78.150 1.00 41.47 C ATOM 550 CG ARG A 476 -7.730 19.413 78.450 1.00 49.39 C ATOM 551 CD ARG A 476 -7.710 20.890 78.071 1.00 51.80 C ATOM 552 NE ARG A 476 -6.887 21.698 78.967 1.00 58.05 N ATOM 553 CZ ARG A 476 -6.960 23.025 79.056 1.00 58.51 C ATOM 554 NH1 ARG A 476 -7.825 23.698 78.308 1.00 59.04 N ATOM 555 NH2 ARG A 476 -6.170 23.681 79.895 1.00 61.11 N ATOM 556 HE ARG A 476 -6.201 21.206 79.574 1.00 0.00 H ATOM 557 HH12 ARG A 476 -7.879 24.734 78.380 1.00 0.00 H ATOM 558 HH11 ARG A 476 -8.449 23.189 77.649 1.00 0.00 H ATOM 559 HH22 ARG A 476 -6.229 24.717 79.962 1.00 0.00 H ATOM 560 HH21 ARG A 476 -5.491 23.159 80.486 1.00 0.00 H ATOM 561 H ARG A 476 -4.533 17.020 78.547 1.00 0.00 H ATOM 562 N GLN A 477 -6.022 16.868 75.494 1.00 28.51 N ATOM 563 CA GLN A 477 -6.325 16.800 74.066 1.00 27.13 C ATOM 564 C GLN A 477 -6.872 15.449 73.617 1.00 28.36 C ATOM 565 O GLN A 477 -7.278 15.322 72.457 1.00 31.48 O ATOM 566 CB GLN A 477 -5.077 17.114 73.247 1.00 33.78 C ATOM 567 CG GLN A 477 -3.964 16.118 73.478 1.00 36.02 C ATOM 568 CD GLN A 477 -2.672 16.484 72.776 1.00 39.56 C ATOM 569 OE1 GLN A 477 -2.654 16.755 71.572 1.00 40.86 O ATOM 570 NE2 GLN A 477 -1.578 16.498 73.532 1.00 40.06 N ATOM 571 HE22 GLN A 477 -1.641 16.262 74.543 1.00 0.00 H ATOM 572 HE21 GLN A 477 -0.659 16.745 73.112 1.00 0.00 H ATOM 573 H GLN A 477 -5.033 16.804 75.809 1.00 0.00 H ATOM 574 N PHE A 478 -6.890 14.443 74.481 1.00 24.10 N ATOM 575 CA PHE A 478 -7.266 13.093 74.083 1.00 21.16 C ATOM 576 C PHE A 478 -8.625 12.721 74.651 1.00 23.34 C ATOM 577 O PHE A 478 -8.983 13.122 75.764 1.00 25.77 O ATOM 578 CB PHE A 478 -6.207 12.083 74.531 1.00 21.15 C ATOM 579 CG PHE A 478 -4.853 12.380 73.973 1.00 24.56 C ATOM 580 CD1 PHE A 478 -4.650 12.364 72.609 1.00 22.88 C ATOM 581 CD2 PHE A 478 -3.794 12.715 74.802 1.00 27.41 C ATOM 582 CE1 PHE A 478 -3.420 12.663 72.074 1.00 26.21 C ATOM 583 CE2 PHE A 478 -2.551 13.024 74.261 1.00 26.25 C ATOM 584 CZ PHE A 478 -2.369 12.987 72.897 1.00 31.87 C ATOM 585 H PHE A 478 -6.628 14.623 75.471 1.00 0.00 H ATOM 586 N ASP A 479 -9.383 11.957 73.867 1.00 22.75 N ATOM 587 CA ASP A 479 -10.692 11.458 74.290 1.00 22.63 C ATOM 588 C ASP A 479 -10.891 10.103 73.606 1.00 25.40 C ATOM 589 O ASP A 479 -11.324 10.030 72.455 1.00 26.73 O ATOM 590 CB ASP A 479 -11.795 12.450 73.943 1.00 26.28 C ATOM 591 CG ASP A 479 -13.173 11.981 74.371 1.00 36.47 C ATOM 592 OD1 ASP A 479 -13.284 11.030 75.173 1.00 37.51 O ATOM 593 OD2 ASP A 479 -14.154 12.576 73.889 1.00 42.56 O ATOM 594 H ASP A 479 -9.032 11.706 72.921 1.00 0.00 H ATOM 595 N HIS A 480 -10.550 9.033 74.324 1.00 18.74 N ATOM 596 CA HIS A 480 -10.690 7.674 73.794 1.00 19.56 C ATOM 597 C HIS A 480 -11.048 6.698 74.904 1.00 19.50 C ATOM 598 O HIS A 480 -10.522 6.824 76.017 1.00 21.05 O ATOM 599 CB HIS A 480 -9.410 7.204 73.095 1.00 23.04 C ATOM 600 CG HIS A 480 -9.607 5.972 72.275 1.00 18.94 C ATOM 601 ND1 HIS A 480 -9.409 4.702 72.777 1.00 20.70 N ATOM 602 CD2 HIS A 480 -10.022 5.813 70.995 1.00 18.61 C ATOM 603 CE1 HIS A 480 -9.675 3.816 71.834 1.00 19.96 C ATOM 604 NE2 HIS A 480 -10.065 4.464 70.749 1.00 21.63 N ATOM 605 H HIS A 480 -10.175 9.166 75.285 1.00 0.00 H ATOM 606 N PRO A 481 -11.914 5.713 74.636 1.00 24.33 N ATOM 607 CA PRO A 481 -12.304 4.772 75.702 1.00 27.24 C ATOM 608 C PRO A 481 -11.162 3.939 76.257 1.00 24.51 C ATOM 609 O PRO A 481 -11.310 3.383 77.346 1.00 22.76 O ATOM 610 CB PRO A 481 -13.362 3.885 75.028 1.00 30.48 C ATOM 611 CG PRO A 481 -13.163 4.078 73.561 1.00 42.60 C ATOM 612 CD PRO A 481 -12.654 5.472 73.386 1.00 24.63 C ATOM 613 N HIS A 482 -10.024 3.826 75.565 1.00 19.89 N ATOM 614 CA HIS A 482 -8.914 3.032 76.084 1.00 19.23 C ATOM 615 C HIS A 482 -7.675 3.884 76.347 1.00 17.95 C ATOM 616 O HIS A 482 -6.547 3.396 76.276 1.00 17.57 O ATOM 617 CB HIS A 482 -8.628 1.860 75.151 1.00 21.01 C ATOM 618 CG HIS A 482 -9.775 0.908 75.110 1.00 19.79 C ATOM 619 ND1 HIS A 482 -10.060 0.065 76.159 1.00 18.22 N ATOM 620 CD2 HIS A 482 -10.774 0.751 74.211 1.00 20.07 C ATOM 621 CE1 HIS A 482 -11.176 -0.592 75.897 1.00 19.35 C ATOM 622 NE2 HIS A 482 -11.626 -0.200 74.718 1.00 20.36 N ATOM 623 H HIS A 482 -9.928 4.308 74.648 1.00 0.00 H ATOM 624 N ILE A 483 -7.897 5.158 76.684 1.00 18.30 N ATOM 625 CA ILE A 483 -6.876 6.058 77.210 1.00 17.07 C ATOM 626 C ILE A 483 -7.444 6.693 78.475 1.00 17.89 C ATOM 627 O ILE A 483 -8.568 7.208 78.459 1.00 20.53 O ATOM 628 CB ILE A 483 -6.480 7.146 76.190 1.00 18.36 C ATOM 629 CG1 ILE A 483 -5.981 6.520 74.881 1.00 16.70 C ATOM 630 CG2 ILE A 483 -5.425 8.059 76.771 1.00 20.57 C ATOM 631 CD1 ILE A 483 -5.531 7.525 73.836 1.00 17.30 C ATOM 632 H ILE A 483 -8.860 5.532 76.564 1.00 0.00 H ATOM 633 N VAL A 484 -6.668 6.663 79.566 1.00 18.51 N ATOM 634 CA VAL A 484 -7.131 7.250 80.821 1.00 18.41 C ATOM 635 C VAL A 484 -7.468 8.726 80.628 1.00 20.14 C ATOM 636 O VAL A 484 -6.725 9.479 79.983 1.00 19.47 O ATOM 637 CB VAL A 484 -6.086 7.038 81.932 1.00 24.62 C ATOM 638 CG1 VAL A 484 -4.807 7.773 81.643 1.00 28.09 C ATOM 639 CG2 VAL A 484 -6.655 7.463 83.296 1.00 27.35 C ATOM 640 H VAL A 484 -5.729 6.219 79.519 1.00 0.00 H ATOM 641 N LYS A 485 -8.617 9.133 81.184 1.00 22.53 N ATOM 642 CA LYS A 485 -9.163 10.480 81.052 1.00 24.57 C ATOM 643 C LYS A 485 -8.646 11.408 82.143 1.00 21.11 C ATOM 644 O LYS A 485 -8.557 11.026 83.312 1.00 24.73 O ATOM 645 CB LYS A 485 -10.694 10.437 81.126 1.00 24.74 C ATOM 646 CG LYS A 485 -11.397 11.787 80.920 1.00 39.17 C ATOM 647 CD LYS A 485 -12.206 11.732 79.655 1.00 50.41 C ATOM 648 CE LYS A 485 -13.456 12.575 79.685 1.00 53.25 C ATOM 649 NZ LYS A 485 -13.672 13.173 78.341 1.00 51.98 N ATOM 650 HZ1 LYS A 485 -12.855 13.766 78.092 1.00 0.00 H ATOM 651 HZ2 LYS A 485 -13.778 12.414 77.638 1.00 0.00 H ATOM 652 HZ3 LYS A 485 -14.533 13.756 78.357 1.00 0.00 H ATOM 653 H LYS A 485 -9.155 8.444 81.747 1.00 0.00 H ATOM 654 N LEU A 486 -8.332 12.642 81.758 1.00 21.44 N ATOM 655 CA LEU A 486 -8.139 13.693 82.747 1.00 22.43 C ATOM 656 C LEU A 486 -9.493 14.210 83.238 1.00 23.60 C ATOM 657 O LEU A 486 -10.368 14.547 82.434 1.00 24.51 O ATOM 658 CB LEU A 486 -7.318 14.835 82.151 1.00 26.10 C ATOM 659 CG LEU A 486 -7.263 16.104 82.996 1.00 25.69 C ATOM 660 CD1 LEU A 486 -6.279 15.940 84.141 1.00 24.00 C ATOM 661 CD2 LEU A 486 -6.869 17.303 82.124 1.00 26.67 C ATOM 662 H LEU A 486 -8.224 12.857 80.746 1.00 0.00 H ATOM 663 N ILE A 487 -9.678 14.242 84.556 1.00 20.46 N ATOM 664 CA ILE A 487 -10.912 14.774 85.123 1.00 22.40 C ATOM 665 C ILE A 487 -10.773 16.256 85.445 1.00 26.37 C ATOM 666 O ILE A 487 -11.671 17.045 85.143 1.00 29.00 O ATOM 667 CB ILE A 487 -11.314 13.954 86.366 1.00 24.49 C ATOM 668 CG1 ILE A 487 -11.411 12.466 86.019 1.00 31.98 C ATOM 669 CG2 ILE A 487 -12.631 14.468 86.952 1.00 31.34 C ATOM 670 CD1 ILE A 487 -12.350 12.153 84.872 1.00 34.49 C ATOM 671 H ILE A 487 -8.934 13.884 85.188 1.00 0.00 H ATOM 672 N GLY A 488 -9.660 16.653 86.051 1.00 24.68 N ATOM 673 CA GLY A 488 -9.422 18.056 86.322 1.00 24.44 C ATOM 674 C GLY A 488 -8.172 18.233 87.158 1.00 26.21 C ATOM 675 O GLY A 488 -7.424 17.282 87.395 1.00 24.71 O ATOM 676 H GLY A 488 -8.950 15.948 86.335 1.00 0.00 H ATOM 677 N VAL A 489 -7.962 19.475 87.604 1.00 25.77 N ATOM 678 CA VAL A 489 -6.770 19.843 88.357 1.00 24.66 C ATOM 679 C VAL A 489 -7.152 20.703 89.549 1.00 25.84 C ATOM 680 O VAL A 489 -8.177 21.388 89.553 1.00 27.55 O ATOM 681 CB VAL A 489 -5.733 20.611 87.504 1.00 24.93 C ATOM 682 CG1 VAL A 489 -5.119 19.708 86.429 1.00 29.83 C ATOM 683 CG2 VAL A 489 -6.360 21.866 86.897 1.00 25.85 C ATOM 684 H VAL A 489 -8.675 20.206 87.406 1.00 0.00 H ATOM 685 N ILE A 490 -6.293 20.675 90.563 1.00 27.43 N ATOM 686 CA ILE A 490 -6.352 21.615 91.682 1.00 28.82 C ATOM 687 C ILE A 490 -5.022 22.351 91.677 1.00 34.37 C ATOM 688 O ILE A 490 -3.974 21.742 91.927 1.00 33.39 O ATOM 689 CB ILE A 490 -6.591 20.912 93.024 1.00 27.67 C ATOM 690 CG1 ILE A 490 -7.831 20.021 92.937 1.00 35.10 C ATOM 691 CG2 ILE A 490 -6.728 21.932 94.144 1.00 31.42 C ATOM 692 CD1 ILE A 490 -8.250 19.433 94.260 1.00 37.46 C ATOM 693 H ILE A 490 -5.545 19.952 90.561 1.00 0.00 H ATOM 694 N THR A 491 -5.054 23.653 91.387 1.00 32.79 N ATOM 695 CA THR A 491 -3.838 24.390 91.068 1.00 34.96 C ATOM 696 C THR A 491 -3.301 25.220 92.229 1.00 40.93 C ATOM 697 O THR A 491 -2.288 25.906 92.064 1.00 53.33 O ATOM 698 CB THR A 491 -4.074 25.287 89.848 1.00 38.41 C ATOM 699 OG1 THR A 491 -5.250 26.083 90.051 1.00 48.67 O ATOM 700 CG2 THR A 491 -4.262 24.436 88.614 1.00 36.92 C ATOM 701 HG1 THR A 491 -6.032 25.489 90.177 1.00 0.00 H ATOM 702 H THR A 491 -5.966 24.152 91.389 1.00 0.00 H ATOM 703 N GLU A 492 -3.949 25.185 93.388 1.00 34.24 N ATOM 704 CA GLU A 492 -3.382 25.753 94.603 1.00 35.69 C ATOM 705 C GLU A 492 -2.668 24.659 95.393 1.00 41.83 C ATOM 706 O GLU A 492 -3.053 23.486 95.354 1.00 37.19 O ATOM 707 CB GLU A 492 -4.469 26.406 95.461 1.00 41.09 C ATOM 708 H GLU A 492 -4.888 24.739 93.429 1.00 0.00 H ATOM 709 N ASN A 493 -1.615 25.052 96.103 1.00 46.19 N ATOM 710 CA ASN A 493 -0.808 24.077 96.827 1.00 50.95 C ATOM 711 C ASN A 493 -1.612 23.468 97.977 1.00 41.94 C ATOM 712 O ASN A 493 -2.298 24.191 98.709 1.00 44.03 O ATOM 713 CB ASN A 493 0.468 24.730 97.362 1.00 51.61 C ATOM 714 H ASN A 493 -1.365 26.061 96.142 1.00 0.00 H ATOM 715 N PRO A 494 -1.552 22.136 98.166 1.00 44.94 N ATOM 716 CA PRO A 494 -0.803 21.176 97.347 1.00 39.22 C ATOM 717 C PRO A 494 -1.487 20.864 96.016 1.00 35.85 C ATOM 718 O PRO A 494 -2.674 20.543 95.990 1.00 31.19 O ATOM 719 CB PRO A 494 -0.747 19.923 98.234 1.00 36.18 C ATOM 720 CG PRO A 494 -1.164 20.368 99.592 1.00 45.91 C ATOM 721 CD PRO A 494 -2.121 21.487 99.357 1.00 45.98 C ATOM 722 N VAL A 495 -0.724 20.957 94.927 1.00 32.61 N ATOM 723 CA VAL A 495 -1.274 20.788 93.587 1.00 35.59 C ATOM 724 C VAL A 495 -1.620 19.320 93.355 1.00 34.05 C ATOM 725 O VAL A 495 -0.827 18.421 93.667 1.00 38.64 O ATOM 726 CB VAL A 495 -0.276 21.317 92.543 1.00 36.11 C ATOM 727 CG1 VAL A 495 -0.633 20.848 91.149 1.00 36.94 C ATOM 728 CG2 VAL A 495 -0.209 22.841 92.595 1.00 39.37 C ATOM 729 H VAL A 495 0.291 21.155 95.036 1.00 0.00 H ATOM 730 N TRP A 496 -2.828 19.069 92.833 1.00 29.11 N ATOM 731 CA TRP A 496 -3.302 17.719 92.527 1.00 26.54 C ATOM 732 C TRP A 496 -3.778 17.652 91.084 1.00 28.75 C ATOM 733 O TRP A 496 -4.351 18.608 90.562 1.00 29.27 O ATOM 734 CB TRP A 496 -4.494 17.278 93.423 1.00 26.55 C ATOM 735 CG TRP A 496 -4.210 17.053 94.871 1.00 30.19 C ATOM 736 CD1 TRP A 496 -2.991 17.015 95.477 1.00 31.90 C ATOM 737 CD2 TRP A 496 -5.180 16.831 95.902 1.00 33.97 C ATOM 738 NE1 TRP A 496 -3.141 16.786 96.825 1.00 35.02 N ATOM 739 CE2 TRP A 496 -4.475 16.673 97.113 1.00 34.34 C ATOM 740 CE3 TRP A 496 -6.578 16.757 95.921 1.00 34.65 C ATOM 741 CZ2 TRP A 496 -5.119 16.440 98.330 1.00 37.29 C ATOM 742 CZ3 TRP A 496 -7.218 16.528 97.132 1.00 40.80 C ATOM 743 CH2 TRP A 496 -6.487 16.375 98.321 1.00 38.49 C ATOM 744 HE1 TRP A 496 -2.366 16.711 97.514 1.00 0.00 H ATOM 745 H TRP A 496 -3.459 19.872 92.636 1.00 0.00 H ATOM 746 N ILE A 497 -3.571 16.501 90.448 1.00 29.17 N ATOM 747 CA ILE A 497 -4.167 16.199 89.151 1.00 27.01 C ATOM 748 C ILE A 497 -5.148 15.055 89.355 1.00 29.96 C ATOM 749 O ILE A 497 -4.787 14.028 89.937 1.00 25.67 O ATOM 750 CB ILE A 497 -3.100 15.837 88.102 1.00 26.65 C ATOM 751 CG1 ILE A 497 -2.166 17.031 87.851 1.00 30.11 C ATOM 752 CG2 ILE A 497 -3.767 15.394 86.804 1.00 33.34 C ATOM 753 CD1 ILE A 497 -1.149 16.781 86.753 1.00 34.83 C ATOM 754 H ILE A 497 -2.959 15.788 90.894 1.00 0.00 H ATOM 755 N ILE A 498 -6.387 15.233 88.901 1.00 25.48 N ATOM 756 CA ILE A 498 -7.446 14.250 89.103 1.00 23.05 C ATOM 757 C ILE A 498 -7.636 13.480 87.803 1.00 22.15 C ATOM 758 O ILE A 498 -7.949 14.070 86.762 1.00 20.54 O ATOM 759 CB ILE A 498 -8.759 14.915 89.545 1.00 22.44 C ATOM 760 CG1 ILE A 498 -8.507 15.986 90.620 1.00 23.27 C ATOM 761 CG2 ILE A 498 -9.749 13.865 90.054 1.00 22.23 C ATOM 762 CD1 ILE A 498 -7.864 15.456 91.880 1.00 26.47 C ATOM 763 H ILE A 498 -6.608 16.107 88.382 1.00 0.00 H ATOM 764 N MET A 499 -7.431 12.164 87.849 1.00 20.98 N ATOM 765 CA MET A 499 -7.570 11.314 86.679 1.00 21.32 C ATOM 766 C MET A 499 -8.630 10.250 86.916 1.00 21.48 C ATOM 767 O MET A 499 -8.930 9.891 88.051 1.00 23.92 O ATOM 768 CB MET A 499 -6.242 10.619 86.332 1.00 24.67 C ATOM 769 CG MET A 499 -5.050 11.546 86.140 1.00 31.48 C ATOM 770 SD MET A 499 -5.152 12.475 84.601 1.00 29.47 S ATOM 771 CE MET A 499 -4.788 11.184 83.427 1.00 28.23 C ATOM 772 H MET A 499 -7.162 11.730 88.755 1.00 0.00 H ATOM 773 N GLU A 500 -9.181 9.730 85.821 1.00 22.35 N ATOM 774 CA GLU A 500 -10.032 8.554 85.913 1.00 25.38 C ATOM 775 C GLU A 500 -9.267 7.430 86.608 1.00 24.12 C ATOM 776 O GLU A 500 -8.073 7.241 86.367 1.00 26.20 O ATOM 777 CB GLU A 500 -10.468 8.135 84.502 1.00 28.63 C ATOM 778 CG GLU A 500 -10.906 6.693 84.363 1.00 29.68 C ATOM 779 CD GLU A 500 -11.016 6.238 82.912 1.00 31.36 C ATOM 780 OE1 GLU A 500 -10.486 6.928 82.008 1.00 25.13 O ATOM 781 OE2 GLU A 500 -11.649 5.186 82.682 1.00 32.19 O ATOM 782 H GLU A 500 -9.002 10.167 84.895 1.00 0.00 H ATOM 783 N LEU A 501 -9.941 6.699 87.503 1.00 23.91 N ATOM 784 CA LEU A 501 -9.304 5.566 88.171 1.00 22.09 C ATOM 785 C LEU A 501 -9.488 4.286 87.360 1.00 21.08 C ATOM 786 O LEU A 501 -10.604 3.970 86.927 1.00 24.97 O ATOM 787 CB LEU A 501 -9.854 5.351 89.581 1.00 23.46 C ATOM 788 CG LEU A 501 -9.181 4.210 90.364 1.00 26.66 C ATOM 789 CD1 LEU A 501 -7.762 4.556 90.758 1.00 24.47 C ATOM 790 CD2 LEU A 501 -10.000 3.812 91.602 1.00 29.96 C ATOM 791 H LEU A 501 -10.928 6.939 87.726 1.00 0.00 H ATOM 792 N CYS A 502 -8.374 3.570 87.139 1.00 21.67 N ATOM 793 CA CYS A 502 -8.384 2.207 86.610 1.00 23.26 C ATOM 794 C CYS A 502 -8.206 1.298 87.816 1.00 24.81 C ATOM 795 O CYS A 502 -7.085 1.106 88.297 1.00 23.30 O ATOM 796 CB CYS A 502 -7.289 2.004 85.571 1.00 18.85 C ATOM 797 SG CYS A 502 -7.540 3.003 84.110 1.00 25.43 S ATOM 798 H CYS A 502 -7.456 4.008 87.355 1.00 0.00 H ATOM 799 N THR A 503 -9.324 0.727 88.280 1.00 22.90 N ATOM 800 CA THR A 503 -9.393 0.127 89.611 1.00 26.25 C ATOM 801 C THR A 503 -8.336 -0.951 89.817 1.00 29.06 C ATOM 802 O THR A 503 -7.744 -1.053 90.898 1.00 27.18 O ATOM 803 CB THR A 503 -10.785 -0.464 89.833 1.00 36.47 C ATOM 804 OG1 THR A 503 -11.779 0.554 89.651 1.00 41.72 O ATOM 805 CG2 THR A 503 -10.894 -1.045 91.228 1.00 38.51 C ATOM 806 HG1 THR A 503 -11.718 0.913 88.730 1.00 0.00 H ATOM 807 H THR A 503 -10.170 0.710 87.675 1.00 0.00 H ATOM 808 N LEU A 504 -8.077 -1.759 88.796 1.00 22.68 N ATOM 809 CA LEU A 504 -7.284 -2.960 88.991 1.00 21.66 C ATOM 810 C LEU A 504 -5.788 -2.730 88.819 1.00 27.51 C ATOM 811 O LEU A 504 -5.007 -3.670 88.979 1.00 32.40 O ATOM 812 CB LEU A 504 -7.781 -4.059 88.045 1.00 23.84 C ATOM 813 CG LEU A 504 -9.214 -4.494 88.367 1.00 25.66 C ATOM 814 CD1 LEU A 504 -9.704 -5.597 87.446 1.00 24.60 C ATOM 815 CD2 LEU A 504 -9.287 -4.937 89.811 1.00 25.64 C ATOM 816 H LEU A 504 -8.444 -1.530 87.850 1.00 0.00 H ATOM 817 N GLY A 505 -5.369 -1.514 88.495 1.00 23.19 N ATOM 818 CA GLY A 505 -3.965 -1.171 88.600 1.00 23.92 C ATOM 819 C GLY A 505 -3.109 -1.472 87.394 1.00 20.82 C ATOM 820 O GLY A 505 -3.599 -1.523 86.259 1.00 21.85 O ATOM 821 H GLY A 505 -6.052 -0.803 88.164 1.00 0.00 H ATOM 822 N GLU A 506 -1.816 -1.665 87.643 1.00 21.26 N ATOM 823 CA GLU A 506 -0.844 -1.860 86.576 1.00 21.73 C ATOM 824 C GLU A 506 -1.017 -3.205 85.878 1.00 18.66 C ATOM 825 O GLU A 506 -1.262 -4.233 86.512 1.00 22.47 O ATOM 826 CB GLU A 506 0.575 -1.757 87.134 1.00 30.64 C ATOM 827 CG GLU A 506 0.915 -0.383 87.686 1.00 37.56 C ATOM 828 CD GLU A 506 2.160 -0.403 88.544 1.00 51.20 C ATOM 829 OE1 GLU A 506 2.042 -0.147 89.760 1.00 54.82 O ATOM 830 OE2 GLU A 506 3.255 -0.677 88.005 1.00 54.49 O ATOM 831 H GLU A 506 -1.489 -1.677 88.630 1.00 0.00 H ATOM 832 N LEU A 507 -0.822 -3.196 84.557 1.00 19.86 N ATOM 833 CA LEU A 507 -1.059 -4.401 83.769 1.00 20.26 C ATOM 834 C LEU A 507 -0.057 -5.502 84.091 1.00 21.22 C ATOM 835 O LEU A 507 -0.434 -6.674 84.177 1.00 22.36 O ATOM 836 CB LEU A 507 -1.029 -4.069 82.278 1.00 21.66 C ATOM 837 CG LEU A 507 -1.170 -5.239 81.300 1.00 20.47 C ATOM 838 CD1 LEU A 507 -2.564 -5.834 81.335 1.00 21.58 C ATOM 839 CD2 LEU A 507 -0.826 -4.731 79.893 1.00 21.64 C ATOM 840 H LEU A 507 -0.500 -2.326 84.087 1.00 0.00 H ATOM 841 N ARG A 508 1.227 -5.173 84.248 1.00 21.92 N ATOM 842 CA ARG A 508 2.206 -6.248 84.441 1.00 21.30 C ATOM 843 C ARG A 508 1.900 -7.052 85.700 1.00 21.95 C ATOM 844 O ARG A 508 1.869 -8.288 85.668 1.00 23.39 O ATOM 845 CB ARG A 508 3.630 -5.690 84.486 1.00 21.31 C ATOM 846 CG ARG A 508 4.126 -5.124 83.163 1.00 23.17 C ATOM 847 CD ARG A 508 5.634 -4.835 83.221 1.00 27.64 C ATOM 848 NE ARG A 508 6.394 -6.053 83.461 1.00 26.82 N ATOM 849 CZ ARG A 508 7.145 -6.276 84.537 1.00 29.24 C ATOM 850 NH1 ARG A 508 7.245 -5.352 85.480 1.00 26.11 N ATOM 851 NH2 ARG A 508 7.783 -7.432 84.673 1.00 29.42 N ATOM 852 HE ARG A 508 6.347 -6.802 82.741 1.00 0.00 H ATOM 853 HH12 ARG A 508 7.832 -5.528 86.320 1.00 0.00 H ATOM 854 HH11 ARG A 508 6.736 -4.450 85.381 1.00 0.00 H ATOM 855 HH22 ARG A 508 8.370 -7.606 85.514 1.00 0.00 H ATOM 856 HH21 ARG A 508 7.696 -8.163 83.939 1.00 0.00 H ATOM 857 H ARG A 508 1.526 -4.177 84.234 1.00 0.00 H ATOM 858 N SER A 509 1.640 -6.364 86.813 1.00 22.25 N ATOM 859 CA SER A 509 1.265 -7.049 88.048 1.00 26.89 C ATOM 860 C SER A 509 -0.008 -7.873 87.871 1.00 21.88 C ATOM 861 O SER A 509 -0.080 -9.027 88.319 1.00 26.29 O ATOM 862 CB SER A 509 1.091 -6.023 89.168 1.00 31.15 C ATOM 863 OG SER A 509 0.709 -6.644 90.382 1.00 45.00 O ATOM 864 HG SER A 509 0.605 -5.955 91.085 1.00 0.00 H ATOM 865 H SER A 509 1.705 -5.326 86.802 1.00 0.00 H ATOM 866 N PHE A 510 -1.020 -7.297 87.217 1.00 22.36 N ATOM 867 CA PHE A 510 -2.275 -8.005 86.981 1.00 20.33 C ATOM 868 C PHE A 510 -2.042 -9.302 86.215 1.00 19.84 C ATOM 869 O PHE A 510 -2.600 -10.348 86.562 1.00 21.79 O ATOM 870 CB PHE A 510 -3.233 -7.082 86.224 1.00 19.81 C ATOM 871 CG PHE A 510 -4.581 -7.691 85.925 1.00 24.32 C ATOM 872 CD1 PHE A 510 -5.567 -7.759 86.901 1.00 29.43 C ATOM 873 CD2 PHE A 510 -4.872 -8.159 84.652 1.00 26.83 C ATOM 874 CE1 PHE A 510 -6.811 -8.310 86.617 1.00 35.79 C ATOM 875 CE2 PHE A 510 -6.112 -8.704 84.360 1.00 32.08 C ATOM 876 CZ PHE A 510 -7.083 -8.778 85.347 1.00 28.99 C ATOM 877 H PHE A 510 -0.912 -6.323 86.868 1.00 0.00 H ATOM 878 N LEU A 511 -1.216 -9.256 85.166 1.00 19.33 N ATOM 879 CA LEU A 511 -0.982 -10.455 84.372 1.00 19.76 C ATOM 880 C LEU A 511 -0.195 -11.492 85.155 1.00 22.77 C ATOM 881 O LEU A 511 -0.401 -12.701 84.976 1.00 23.50 O ATOM 882 CB LEU A 511 -0.235 -10.103 83.086 1.00 19.75 C ATOM 883 CG LEU A 511 -0.982 -9.236 82.085 1.00 18.24 C ATOM 884 CD1 LEU A 511 -0.054 -8.904 80.918 1.00 19.85 C ATOM 885 CD2 LEU A 511 -2.239 -9.931 81.598 1.00 20.87 C ATOM 886 H LEU A 511 -0.741 -8.365 84.916 1.00 0.00 H ATOM 887 N GLN A 512 0.733 -11.039 86.000 1.00 22.01 N ATOM 888 CA GLN A 512 1.548 -11.970 86.774 1.00 24.58 C ATOM 889 C GLN A 512 0.710 -12.677 87.827 1.00 22.78 C ATOM 890 O GLN A 512 0.821 -13.897 88.009 1.00 29.83 O ATOM 891 CB GLN A 512 2.715 -11.225 87.430 1.00 22.10 C ATOM 892 CG GLN A 512 3.745 -10.680 86.423 1.00 33.36 C ATOM 893 CD GLN A 512 4.632 -9.585 86.997 1.00 37.90 C ATOM 894 OE1 GLN A 512 4.430 -9.121 88.121 1.00 47.77 O ATOM 895 NE2 GLN A 512 5.625 -9.167 86.219 1.00 39.50 N ATOM 896 HE22 GLN A 512 5.759 -9.586 85.277 1.00 0.00 H ATOM 897 HE21 GLN A 512 6.268 -8.421 86.552 1.00 0.00 H ATOM 898 H GLN A 512 0.877 -10.015 86.108 1.00 0.00 H ATOM 899 N VAL A 513 -0.150 -11.926 88.513 1.00 22.62 N ATOM 900 CA VAL A 513 -0.969 -12.491 89.585 1.00 29.51 C ATOM 901 C VAL A 513 -2.017 -13.441 89.019 1.00 32.60 C ATOM 902 O VAL A 513 -2.305 -14.494 89.603 1.00 34.62 O ATOM 903 CB VAL A 513 -1.614 -11.348 90.396 1.00 35.69 C ATOM 904 CG1 VAL A 513 -2.701 -11.876 91.314 1.00 38.22 C ATOM 905 CG2 VAL A 513 -0.562 -10.605 91.193 1.00 42.33 C ATOM 906 H VAL A 513 -0.241 -10.916 88.281 1.00 0.00 H ATOM 907 N ARG A 514 -2.596 -13.096 87.870 1.00 29.69 N ATOM 908 CA ARG A 514 -3.733 -13.814 87.309 1.00 31.75 C ATOM 909 C ARG A 514 -3.337 -14.704 86.138 1.00 39.12 C ATOM 910 O ARG A 514 -4.179 -15.022 85.290 1.00 45.49 O ATOM 911 CB ARG A 514 -4.820 -12.824 86.887 1.00 27.43 C ATOM 912 CG ARG A 514 -5.474 -12.100 88.055 1.00 34.87 C ATOM 913 CD ARG A 514 -6.917 -11.732 87.744 1.00 45.08 C ATOM 914 NE ARG A 514 -7.612 -12.814 87.048 1.00 57.71 N ATOM 915 CZ ARG A 514 -8.877 -12.751 86.643 1.00 53.01 C ATOM 916 NH1 ARG A 514 -9.584 -11.655 86.862 1.00 48.54 N ATOM 917 NH2 ARG A 514 -9.432 -13.783 86.017 1.00 52.24 N ATOM 918 HE ARG A 514 -7.083 -13.689 86.858 1.00 0.00 H ATOM 919 HH12 ARG A 514 -10.574 -11.603 86.546 1.00 0.00 H ATOM 920 HH11 ARG A 514 -9.150 -10.845 87.350 1.00 0.00 H ATOM 921 HH22 ARG A 514 -10.422 -13.729 85.702 1.00 0.00 H ATOM 922 HH21 ARG A 514 -8.877 -14.645 85.842 1.00 0.00 H ATOM 923 H ARG A 514 -2.220 -12.278 87.350 1.00 0.00 H ATOM 924 N LYS A 515 -2.070 -15.129 86.096 1.00 29.42 N ATOM 925 CA LYS A 515 -1.537 -15.843 84.939 1.00 31.24 C ATOM 926 C LYS A 515 -2.370 -17.070 84.586 1.00 41.76 C ATOM 927 O LYS A 515 -2.721 -17.284 83.420 1.00 51.68 O ATOM 928 CB LYS A 515 -0.086 -16.241 85.205 1.00 30.42 C ATOM 929 CG LYS A 515 0.487 -17.193 84.173 1.00 29.90 C ATOM 930 CD LYS A 515 2.001 -17.252 84.275 1.00 38.24 C ATOM 931 CE LYS A 515 2.577 -18.174 83.212 1.00 39.60 C ATOM 932 NZ LYS A 515 4.055 -18.052 83.112 1.00 45.47 N ATOM 933 HZ1 LYS A 515 4.305 -17.073 82.864 1.00 0.00 H ATOM 934 HZ2 LYS A 515 4.485 -18.300 84.026 1.00 0.00 H ATOM 935 HZ3 LYS A 515 4.406 -18.697 82.376 1.00 0.00 H ATOM 936 H LYS A 515 -1.448 -14.946 86.909 1.00 0.00 H ATOM 937 N PHE A 516 -2.690 -17.895 85.578 1.00 36.42 N ATOM 938 CA PHE A 516 -3.443 -19.116 85.334 1.00 36.49 C ATOM 939 C PHE A 516 -4.943 -18.940 85.533 1.00 34.46 C ATOM 940 O PHE A 516 -5.668 -19.940 85.600 1.00 46.88 O ATOM 941 CB PHE A 516 -2.911 -20.240 86.226 1.00 30.62 C ATOM 942 CG PHE A 516 -1.444 -20.494 86.040 1.00 39.08 C ATOM 943 CD1 PHE A 516 -0.987 -21.225 84.953 1.00 42.13 C ATOM 944 CD2 PHE A 516 -0.517 -19.971 86.929 1.00 46.10 C ATOM 945 CE1 PHE A 516 0.364 -21.445 84.768 1.00 41.04 C ATOM 946 CE2 PHE A 516 0.838 -20.191 86.748 1.00 43.04 C ATOM 947 CZ PHE A 516 1.276 -20.925 85.666 1.00 38.09 C ATOM 948 H PHE A 516 -2.396 -17.663 86.548 1.00 0.00 H ATOM 949 N SER A 517 -5.421 -17.700 85.615 1.00 34.64 N ATOM 950 CA SER A 517 -6.842 -17.398 85.698 1.00 42.97 C ATOM 951 C SER A 517 -7.351 -16.626 84.493 1.00 43.27 C ATOM 952 O SER A 517 -8.553 -16.352 84.412 1.00 51.90 O ATOM 953 CB SER A 517 -7.145 -16.600 86.972 1.00 44.06 C ATOM 954 OG SER A 517 -7.255 -17.469 88.084 1.00 53.82 O ATOM 955 HG SER A 517 -7.450 -16.939 88.897 1.00 0.00 H ATOM 956 H SER A 517 -4.746 -16.909 85.620 1.00 0.00 H ATOM 957 N LEU A 518 -6.476 -16.265 83.564 1.00 35.43 N ATOM 958 CA LEU A 518 -6.835 -15.472 82.398 1.00 33.76 C ATOM 959 C LEU A 518 -6.817 -16.372 81.175 1.00 38.05 C ATOM 960 O LEU A 518 -5.820 -17.053 80.916 1.00 48.60 O ATOM 961 CB LEU A 518 -5.867 -14.300 82.208 1.00 28.53 C ATOM 962 CG LEU A 518 -6.106 -13.076 83.098 1.00 29.74 C ATOM 963 CD1 LEU A 518 -5.012 -12.028 82.923 1.00 30.05 C ATOM 964 CD2 LEU A 518 -7.474 -12.479 82.827 1.00 30.96 C ATOM 965 H LEU A 518 -5.486 -16.563 83.674 1.00 0.00 H ATOM 966 N ASP A 519 -7.919 -16.388 80.437 1.00 32.94 N ATOM 967 CA ASP A 519 -7.899 -17.159 79.209 1.00 34.03 C ATOM 968 C ASP A 519 -7.223 -16.361 78.096 1.00 23.55 C ATOM 969 O ASP A 519 -7.060 -15.140 78.169 1.00 25.61 O ATOM 970 CB ASP A 519 -9.309 -17.577 78.791 1.00 37.75 C ATOM 971 CG ASP A 519 -10.238 -16.406 78.608 1.00 47.42 C ATOM 972 OD1 ASP A 519 -9.850 -15.271 78.949 1.00 52.69 O ATOM 973 OD2 ASP A 519 -11.368 -16.622 78.119 1.00 60.59 O ATOM 974 H ASP A 519 -8.769 -15.865 80.729 1.00 0.00 H ATOM 975 N LEU A 520 -6.831 -17.085 77.052 1.00 20.66 N ATOM 976 CA LEU A 520 -6.189 -16.465 75.901 1.00 18.88 C ATOM 977 C LEU A 520 -7.055 -15.362 75.294 1.00 17.58 C ATOM 978 O LEU A 520 -6.535 -14.346 74.803 1.00 18.33 O ATOM 979 CB LEU A 520 -5.880 -17.548 74.876 1.00 22.74 C ATOM 980 CG LEU A 520 -5.357 -17.095 73.530 1.00 21.94 C ATOM 981 CD1 LEU A 520 -4.124 -16.202 73.683 1.00 26.47 C ATOM 982 CD2 LEU A 520 -5.041 -18.336 72.740 1.00 22.22 C ATOM 983 H LEU A 520 -6.986 -18.113 77.057 1.00 0.00 H ATOM 984 N ALA A 521 -8.378 -15.551 75.289 1.00 19.74 N ATOM 985 CA ALA A 521 -9.242 -14.539 74.698 1.00 19.16 C ATOM 986 C ALA A 521 -9.095 -13.199 75.398 1.00 19.00 C ATOM 987 O ALA A 521 -9.191 -12.154 74.743 1.00 20.54 O ATOM 988 CB ALA A 521 -10.700 -14.994 74.737 1.00 22.27 C ATOM 989 H ALA A 521 -8.787 -16.413 75.703 1.00 0.00 H ATOM 990 N SER A 522 -8.849 -13.200 76.717 1.00 19.06 N ATOM 991 CA SER A 522 -8.653 -11.930 77.417 1.00 18.64 C ATOM 992 C SER A 522 -7.337 -11.275 77.018 1.00 16.34 C ATOM 993 O SER A 522 -7.276 -10.050 76.843 1.00 17.24 O ATOM 994 CB SER A 522 -8.696 -12.128 78.935 1.00 18.19 C ATOM 995 OG SER A 522 -9.954 -12.614 79.372 1.00 21.73 O ATOM 996 HG SER A 522 -10.138 -13.486 78.941 1.00 0.00 H ATOM 997 H SER A 522 -8.798 -14.098 77.239 1.00 0.00 H ATOM 998 N LEU A 523 -6.264 -12.063 76.906 1.00 17.22 N ATOM 999 CA LEU A 523 -4.983 -11.512 76.463 1.00 18.79 C ATOM 1000 C LEU A 523 -5.117 -10.872 75.093 1.00 20.39 C ATOM 1001 O LEU A 523 -4.600 -9.772 74.857 1.00 17.04 O ATOM 1002 CB LEU A 523 -3.923 -12.617 76.435 1.00 16.25 C ATOM 1003 CG LEU A 523 -3.611 -13.295 77.765 1.00 20.78 C ATOM 1004 CD1 LEU A 523 -2.426 -14.269 77.611 1.00 23.28 C ATOM 1005 CD2 LEU A 523 -3.407 -12.268 78.889 1.00 19.52 C ATOM 1006 H LEU A 523 -6.340 -13.075 77.135 1.00 0.00 H ATOM 1007 N ILE A 524 -5.830 -11.534 74.176 1.00 18.15 N ATOM 1008 CA ILE A 524 -5.962 -10.969 72.837 1.00 17.45 C ATOM 1009 C ILE A 524 -6.830 -9.722 72.874 1.00 14.49 C ATOM 1010 O ILE A 524 -6.574 -8.748 72.148 1.00 15.00 O ATOM 1011 CB ILE A 524 -6.520 -12.022 71.867 1.00 17.01 C ATOM 1012 CG1 ILE A 524 -5.588 -13.231 71.835 1.00 18.53 C ATOM 1013 CG2 ILE A 524 -6.680 -11.414 70.462 1.00 20.17 C ATOM 1014 CD1 ILE A 524 -6.189 -14.416 71.112 1.00 21.11 C ATOM 1015 H ILE A 524 -6.284 -12.439 74.414 1.00 0.00 H ATOM 1016 N LEU A 525 -7.876 -9.740 73.710 1.00 15.05 N ATOM 1017 CA LEU A 525 -8.728 -8.569 73.891 1.00 15.49 C ATOM 1018 C LEU A 525 -7.919 -7.349 74.306 1.00 17.45 C ATOM 1019 O LEU A 525 -8.142 -6.245 73.788 1.00 16.68 O ATOM 1020 CB LEU A 525 -9.798 -8.865 74.938 1.00 15.08 C ATOM 1021 CG LEU A 525 -10.750 -7.699 75.236 1.00 13.69 C ATOM 1022 CD1 LEU A 525 -11.616 -7.349 74.042 1.00 17.73 C ATOM 1023 CD2 LEU A 525 -11.614 -8.082 76.420 1.00 17.71 C ATOM 1024 H LEU A 525 -8.086 -10.608 74.242 1.00 0.00 H ATOM 1025 N TYR A 526 -6.978 -7.526 75.246 1.00 16.52 N ATOM 1026 CA TYR A 526 -6.162 -6.398 75.692 1.00 14.30 C ATOM 1027 C TYR A 526 -5.320 -5.846 74.546 1.00 14.96 C ATOM 1028 O TYR A 526 -5.202 -4.623 74.381 1.00 16.45 O ATOM 1029 CB TYR A 526 -5.251 -6.809 76.857 1.00 13.37 C ATOM 1030 CG TYR A 526 -5.961 -7.423 78.069 1.00 16.61 C ATOM 1031 CD1 TYR A 526 -7.288 -7.131 78.368 1.00 17.51 C ATOM 1032 CD2 TYR A 526 -5.272 -8.294 78.911 1.00 16.92 C ATOM 1033 CE1 TYR A 526 -7.922 -7.699 79.490 1.00 19.48 C ATOM 1034 CE2 TYR A 526 -5.896 -8.861 80.024 1.00 18.46 C ATOM 1035 CZ TYR A 526 -7.208 -8.568 80.294 1.00 20.42 C ATOM 1036 OH TYR A 526 -7.809 -9.143 81.397 1.00 19.35 O ATOM 1037 HH TYR A 526 -8.748 -8.836 81.457 1.00 0.00 H ATOM 1038 H TYR A 526 -6.829 -8.469 75.659 1.00 0.00 H ATOM 1039 N ALA A 527 -4.725 -6.730 73.743 1.00 14.84 N ATOM 1040 CA ALA A 527 -3.959 -6.270 72.591 1.00 13.02 C ATOM 1041 C ALA A 527 -4.849 -5.496 71.626 1.00 13.82 C ATOM 1042 O ALA A 527 -4.483 -4.414 71.151 1.00 13.90 O ATOM 1043 CB ALA A 527 -3.302 -7.456 71.892 1.00 13.97 C ATOM 1044 H ALA A 527 -4.808 -7.748 73.939 1.00 0.00 H ATOM 1045 N TYR A 528 -6.045 -6.026 71.350 1.00 16.26 N ATOM 1046 CA TYR A 528 -6.961 -5.338 70.450 1.00 18.70 C ATOM 1047 C TYR A 528 -7.333 -3.965 70.999 1.00 17.50 C ATOM 1048 O TYR A 528 -7.263 -2.962 70.281 1.00 15.83 O ATOM 1049 CB TYR A 528 -8.215 -6.181 70.218 1.00 14.42 C ATOM 1050 CG TYR A 528 -9.280 -5.407 69.473 1.00 16.70 C ATOM 1051 CD1 TYR A 528 -9.137 -5.139 68.124 1.00 18.16 C ATOM 1052 CD2 TYR A 528 -10.403 -4.922 70.127 1.00 16.85 C ATOM 1053 CE1 TYR A 528 -10.085 -4.422 67.433 1.00 22.18 C ATOM 1054 CE2 TYR A 528 -11.357 -4.193 69.439 1.00 20.81 C ATOM 1055 CZ TYR A 528 -11.183 -3.948 68.091 1.00 27.45 C ATOM 1056 OH TYR A 528 -12.117 -3.233 67.383 1.00 27.81 O ATOM 1057 HH TYR A 528 -11.827 -3.158 66.439 1.00 0.00 H ATOM 1058 H TYR A 528 -6.322 -6.932 71.779 1.00 0.00 H ATOM 1059 N GLN A 529 -7.730 -3.901 72.279 1.00 14.02 N ATOM 1060 CA GLN A 529 -8.137 -2.628 72.873 1.00 14.15 C ATOM 1061 C GLN A 529 -7.023 -1.592 72.787 1.00 12.26 C ATOM 1062 O GLN A 529 -7.260 -0.429 72.412 1.00 14.34 O ATOM 1063 CB GLN A 529 -8.568 -2.845 74.324 1.00 15.21 C ATOM 1064 CG GLN A 529 -9.917 -3.554 74.423 1.00 16.70 C ATOM 1065 CD GLN A 529 -10.317 -3.872 75.827 1.00 18.29 C ATOM 1066 OE1 GLN A 529 -9.492 -3.897 76.747 1.00 17.87 O ATOM 1067 NE2 GLN A 529 -11.588 -4.153 76.004 1.00 17.80 N ATOM 1068 HE22 GLN A 529 -12.245 -4.119 75.199 1.00 0.00 H ATOM 1069 HE21 GLN A 529 -11.937 -4.410 76.949 1.00 0.00 H ATOM 1070 H GLN A 529 -7.749 -4.766 72.855 1.00 0.00 H ATOM 1071 N LEU A 530 -5.789 -1.992 73.108 1.00 14.90 N ATOM 1072 CA LEU A 530 -4.674 -1.059 72.996 1.00 13.36 C ATOM 1073 C LEU A 530 -4.451 -0.621 71.553 1.00 14.19 C ATOM 1074 O LEU A 530 -4.135 0.551 71.302 1.00 15.57 O ATOM 1075 CB LEU A 530 -3.409 -1.674 73.597 1.00 15.56 C ATOM 1076 CG LEU A 530 -3.521 -1.975 75.093 1.00 14.89 C ATOM 1077 CD1 LEU A 530 -2.323 -2.777 75.588 1.00 15.56 C ATOM 1078 CD2 LEU A 530 -3.677 -0.663 75.873 1.00 17.40 C ATOM 1079 H LEU A 530 -5.625 -2.965 73.436 1.00 0.00 H ATOM 1080 N SER A 531 -4.621 -1.526 70.585 1.00 15.74 N ATOM 1081 CA SER A 531 -4.465 -1.119 69.189 1.00 14.79 C ATOM 1082 C SER A 531 -5.511 -0.085 68.772 1.00 16.87 C ATOM 1083 O SER A 531 -5.219 0.764 67.919 1.00 19.35 O ATOM 1084 CB SER A 531 -4.505 -2.335 68.252 1.00 16.94 C ATOM 1085 OG SER A 531 -5.832 -2.762 67.992 1.00 15.83 O ATOM 1086 HG SER A 531 -6.270 -3.013 68.844 1.00 0.00 H ATOM 1087 H SER A 531 -4.862 -2.510 70.822 1.00 0.00 H ATOM 1088 N THR A 532 -6.718 -0.099 69.372 1.00 17.53 N ATOM 1089 CA THR A 532 -7.695 0.927 69.001 1.00 18.16 C ATOM 1090 C THR A 532 -7.272 2.294 69.531 1.00 18.88 C ATOM 1091 O THR A 532 -7.426 3.309 68.835 1.00 17.55 O ATOM 1092 CB THR A 532 -9.114 0.558 69.473 1.00 18.58 C ATOM 1093 OG1 THR A 532 -9.237 0.646 70.905 1.00 19.13 O ATOM 1094 CG2 THR A 532 -9.496 -0.844 69.008 1.00 17.45 C ATOM 1095 HG1 THR A 532 -8.595 0.023 71.329 1.00 0.00 H ATOM 1096 H THR A 532 -6.950 -0.822 70.082 1.00 0.00 H ATOM 1097 N ALA A 533 -6.691 2.328 70.736 1.00 14.97 N ATOM 1098 CA ALA A 533 -6.186 3.576 71.296 1.00 17.32 C ATOM 1099 C ALA A 533 -5.023 4.107 70.470 1.00 16.17 C ATOM 1100 O ALA A 533 -4.900 5.323 70.243 1.00 15.76 O ATOM 1101 CB ALA A 533 -5.746 3.352 72.738 1.00 16.27 C ATOM 1102 H ALA A 533 -6.598 1.448 71.283 1.00 0.00 H ATOM 1103 N LEU A 534 -4.149 3.204 70.020 1.00 13.22 N ATOM 1104 CA LEU A 534 -2.973 3.637 69.278 1.00 12.60 C ATOM 1105 C LEU A 534 -3.324 4.027 67.847 1.00 13.78 C ATOM 1106 O LEU A 534 -2.689 4.937 67.288 1.00 14.98 O ATOM 1107 CB LEU A 534 -1.904 2.532 69.319 1.00 16.48 C ATOM 1108 CG LEU A 534 -1.356 2.311 70.744 1.00 14.04 C ATOM 1109 CD1 LEU A 534 -0.605 0.998 70.864 1.00 16.02 C ATOM 1110 CD2 LEU A 534 -0.457 3.473 71.214 1.00 19.48 C ATOM 1111 H LEU A 534 -4.308 2.192 70.199 1.00 0.00 H ATOM 1112 N ALA A 535 -4.350 3.402 67.250 1.00 14.16 N ATOM 1113 CA ALA A 535 -4.806 3.851 65.934 1.00 17.73 C ATOM 1114 C ALA A 535 -5.435 5.230 66.023 1.00 14.96 C ATOM 1115 O ALA A 535 -5.331 6.029 65.081 1.00 16.82 O ATOM 1116 CB ALA A 535 -5.806 2.862 65.335 1.00 16.39 C ATOM 1117 H ALA A 535 -4.819 2.602 67.720 1.00 0.00 H ATOM 1118 N TYR A 536 -6.074 5.515 67.156 1.00 15.90 N ATOM 1119 CA TYR A 536 -6.583 6.853 67.419 1.00 15.82 C ATOM 1120 C TYR A 536 -5.439 7.860 67.529 1.00 16.19 C ATOM 1121 O TYR A 536 -5.482 8.934 66.910 1.00 17.28 O ATOM 1122 CB TYR A 536 -7.450 6.811 68.686 1.00 15.20 C ATOM 1123 CG TYR A 536 -7.746 8.155 69.313 1.00 17.41 C ATOM 1124 CD1 TYR A 536 -8.742 8.973 68.797 1.00 21.43 C ATOM 1125 CD2 TYR A 536 -7.047 8.586 70.440 1.00 19.86 C ATOM 1126 CE1 TYR A 536 -9.026 10.207 69.377 1.00 20.53 C ATOM 1127 CE2 TYR A 536 -7.327 9.806 71.032 1.00 22.14 C ATOM 1128 CZ TYR A 536 -8.305 10.618 70.488 1.00 22.73 C ATOM 1129 OH TYR A 536 -8.587 11.835 71.080 1.00 25.64 O ATOM 1130 HH TYR A 536 -9.305 12.289 70.572 1.00 0.00 H ATOM 1131 H TYR A 536 -6.212 4.768 67.866 1.00 0.00 H ATOM 1132 N LEU A 537 -4.391 7.529 68.297 1.00 16.08 N ATOM 1133 CA LEU A 537 -3.265 8.462 68.387 1.00 15.54 C ATOM 1134 C LEU A 537 -2.600 8.672 67.031 1.00 14.68 C ATOM 1135 O LEU A 537 -2.207 9.797 66.688 1.00 16.96 O ATOM 1136 CB LEU A 537 -2.222 7.972 69.395 1.00 16.92 C ATOM 1137 CG LEU A 537 -2.618 7.938 70.866 1.00 17.09 C ATOM 1138 CD1 LEU A 537 -1.468 7.458 71.730 1.00 18.94 C ATOM 1139 CD2 LEU A 537 -3.053 9.329 71.309 1.00 17.02 C ATOM 1140 H LEU A 537 -4.378 6.629 68.818 1.00 0.00 H ATOM 1141 N GLU A 538 -2.438 7.596 66.260 1.00 16.37 N ATOM 1142 CA GLU A 538 -1.884 7.715 64.914 1.00 14.61 C ATOM 1143 C GLU A 538 -2.730 8.657 64.060 1.00 16.52 C ATOM 1144 O GLU A 538 -2.195 9.525 63.357 1.00 17.75 O ATOM 1145 CB GLU A 538 -1.788 6.310 64.310 1.00 18.56 C ATOM 1146 CG GLU A 538 -1.403 6.193 62.843 1.00 21.58 C ATOM 1147 CD GLU A 538 -1.491 4.710 62.410 1.00 30.69 C ATOM 1148 OE1 GLU A 538 -2.593 4.204 62.046 1.00 24.76 O ATOM 1149 OE2 GLU A 538 -0.450 4.048 62.484 1.00 20.49 O ATOM 1150 H GLU A 538 -2.710 6.660 66.622 1.00 0.00 H ATOM 1151 N SER A 539 -4.055 8.543 64.158 1.00 19.54 N ATOM 1152 CA SER A 539 -4.935 9.417 63.383 1.00 16.69 C ATOM 1153 C SER A 539 -4.832 10.874 63.821 1.00 17.98 C ATOM 1154 O SER A 539 -5.177 11.769 63.040 1.00 18.66 O ATOM 1155 CB SER A 539 -6.394 8.928 63.478 1.00 17.07 C ATOM 1156 OG SER A 539 -7.024 9.326 64.695 1.00 20.28 O ATOM 1157 HG SER A 539 -6.525 8.949 65.462 1.00 0.00 H ATOM 1158 H SER A 539 -4.466 7.827 64.791 1.00 0.00 H ATOM 1159 N LYS A 540 -4.381 11.125 65.050 1.00 17.06 N ATOM 1160 CA LYS A 540 -4.143 12.471 65.552 1.00 17.69 C ATOM 1161 C LYS A 540 -2.724 12.932 65.268 1.00 18.64 C ATOM 1162 O LYS A 540 -2.348 14.040 65.677 1.00 21.46 O ATOM 1163 CB LYS A 540 -4.405 12.519 67.056 1.00 22.31 C ATOM 1164 CG LYS A 540 -5.873 12.364 67.417 1.00 30.57 C ATOM 1165 CD LYS A 540 -6.099 12.707 68.870 1.00 48.01 C ATOM 1166 CE LYS A 540 -7.213 13.719 69.030 1.00 45.47 C ATOM 1167 NZ LYS A 540 -6.854 15.071 68.525 1.00 46.67 N ATOM 1168 HZ1 LYS A 540 -6.028 15.427 69.048 1.00 0.00 H ATOM 1169 HZ2 LYS A 540 -6.626 15.012 67.512 1.00 0.00 H ATOM 1170 HZ3 LYS A 540 -7.658 15.716 68.663 1.00 0.00 H ATOM 1171 H LYS A 540 -4.190 10.321 65.681 1.00 0.00 H ATOM 1172 N ARG A 541 -1.941 12.097 64.584 1.00 19.41 N ATOM 1173 CA ARG A 541 -0.527 12.343 64.313 1.00 17.88 C ATOM 1174 C ARG A 541 0.260 12.583 65.600 1.00 19.31 C ATOM 1175 O ARG A 541 1.163 13.427 65.648 1.00 23.50 O ATOM 1176 CB ARG A 541 -0.330 13.502 63.328 1.00 21.49 C ATOM 1177 CG ARG A 541 -0.996 13.314 61.967 1.00 22.71 C ATOM 1178 CD ARG A 541 -1.047 14.635 61.170 1.00 36.33 C ATOM 1179 NE ARG A 541 0.065 14.731 60.231 1.00 40.33 N ATOM 1180 CZ ARG A 541 -0.016 15.294 59.028 1.00 47.91 C ATOM 1181 NH1 ARG A 541 -1.161 15.823 58.619 1.00 53.79 N ATOM 1182 NH2 ARG A 541 1.048 15.333 58.233 1.00 48.84 N ATOM 1183 HE ARG A 541 0.981 14.333 60.521 1.00 0.00 H ATOM 1184 HH12 ARG A 541 -1.224 16.263 57.679 1.00 0.00 H ATOM 1185 HH11 ARG A 541 -1.996 15.798 59.238 1.00 0.00 H ATOM 1186 HH22 ARG A 541 0.979 15.774 57.294 1.00 0.00 H ATOM 1187 HH21 ARG A 541 1.949 14.922 58.550 1.00 0.00 H ATOM 1188 H ARG A 541 -2.362 11.218 64.222 1.00 0.00 H ATOM 1189 N PHE A 542 -0.064 11.819 66.644 1.00 19.41 N ATOM 1190 CA PHE A 542 0.623 11.904 67.928 1.00 19.85 C ATOM 1191 C PHE A 542 1.530 10.697 68.094 1.00 18.42 C ATOM 1192 O PHE A 542 1.054 9.557 68.080 1.00 18.51 O ATOM 1193 CB PHE A 542 -0.360 11.968 69.098 1.00 18.51 C ATOM 1194 CG PHE A 542 0.309 12.141 70.437 1.00 21.92 C ATOM 1195 CD1 PHE A 542 0.639 13.413 70.895 1.00 28.31 C ATOM 1196 CD2 PHE A 542 0.642 11.050 71.215 1.00 25.03 C ATOM 1197 CE1 PHE A 542 1.264 13.584 72.124 1.00 26.02 C ATOM 1198 CE2 PHE A 542 1.275 11.213 72.443 1.00 27.38 C ATOM 1199 CZ PHE A 542 1.586 12.477 72.891 1.00 28.34 C ATOM 1200 H PHE A 542 -0.839 11.134 66.538 1.00 0.00 H ATOM 1201 N VAL A 543 2.811 10.948 68.324 1.00 17.12 N ATOM 1202 CA VAL A 543 3.798 9.885 68.506 1.00 16.48 C ATOM 1203 C VAL A 543 4.041 9.732 70.003 1.00 17.47 C ATOM 1204 O VAL A 543 4.376 10.707 70.696 1.00 19.16 O ATOM 1205 CB VAL A 543 5.091 10.192 67.737 1.00 19.53 C ATOM 1206 CG1 VAL A 543 6.178 9.183 68.089 1.00 16.02 C ATOM 1207 CG2 VAL A 543 4.812 10.162 66.238 1.00 20.83 C ATOM 1208 H VAL A 543 3.126 11.938 68.377 1.00 0.00 H ATOM 1209 N HIS A 544 3.840 8.503 70.495 1.00 17.13 N ATOM 1210 CA HIS A 544 3.822 8.225 71.929 1.00 16.26 C ATOM 1211 C HIS A 544 5.219 8.053 72.512 1.00 19.63 C ATOM 1212 O HIS A 544 5.526 8.624 73.561 1.00 20.22 O ATOM 1213 CB HIS A 544 2.977 6.980 72.186 1.00 16.83 C ATOM 1214 CG HIS A 544 2.719 6.695 73.634 1.00 19.00 C ATOM 1215 ND1 HIS A 544 3.686 6.193 74.481 1.00 19.12 N ATOM 1216 CD2 HIS A 544 1.590 6.802 74.377 1.00 22.18 C ATOM 1217 CE1 HIS A 544 3.165 6.008 75.682 1.00 22.62 C ATOM 1218 NE2 HIS A 544 1.898 6.383 75.649 1.00 22.19 N ATOM 1219 H HIS A 544 3.691 7.717 69.831 1.00 0.00 H ATOM 1220 N ARG A 545 6.060 7.215 71.891 1.00 17.02 N ATOM 1221 CA ARG A 545 7.473 6.999 72.203 1.00 22.00 C ATOM 1222 C ARG A 545 7.700 6.094 73.407 1.00 20.72 C ATOM 1223 O ARG A 545 8.855 5.764 73.685 1.00 21.03 O ATOM 1224 CB ARG A 545 8.262 8.297 72.469 1.00 20.98 C ATOM 1225 CG ARG A 545 8.276 9.317 71.390 1.00 25.86 C ATOM 1226 CD ARG A 545 9.230 10.395 71.856 1.00 31.25 C ATOM 1227 NE ARG A 545 9.578 11.328 70.807 1.00 40.54 N ATOM 1228 CZ ARG A 545 10.754 11.929 70.734 1.00 31.26 C ATOM 1229 NH1 ARG A 545 11.687 11.670 71.643 1.00 37.86 N ATOM 1230 NH2 ARG A 545 11.002 12.766 69.744 1.00 43.88 N ATOM 1231 HE ARG A 545 8.869 11.536 70.075 1.00 0.00 H ATOM 1232 HH12 ARG A 545 12.612 12.142 71.587 1.00 0.00 H ATOM 1233 HH11 ARG A 545 11.492 10.996 72.410 1.00 0.00 H ATOM 1234 HH22 ARG A 545 11.925 13.240 69.683 1.00 0.00 H ATOM 1235 HH21 ARG A 545 10.274 12.951 69.025 1.00 0.00 H ATOM 1236 H ARG A 545 5.667 6.660 71.104 1.00 0.00 H ATOM 1237 N ASP A 546 6.674 5.697 74.145 1.00 20.61 N ATOM 1238 CA ASP A 546 6.900 4.896 75.347 1.00 22.60 C ATOM 1239 C ASP A 546 5.807 3.850 75.522 1.00 21.84 C ATOM 1240 O ASP A 546 5.213 3.703 76.591 1.00 21.74 O ATOM 1241 CB ASP A 546 7.012 5.777 76.584 1.00 31.83 C ATOM 1242 CG ASP A 546 7.997 5.221 77.598 1.00 39.86 C ATOM 1243 OD1 ASP A 546 8.477 4.079 77.403 1.00 34.14 O ATOM 1244 OD2 ASP A 546 8.291 5.924 78.586 1.00 48.16 O ATOM 1245 H ASP A 546 5.705 5.956 73.869 1.00 0.00 H ATOM 1246 N ILE A 547 5.556 3.084 74.468 1.00 16.77 N ATOM 1247 CA ILE A 547 4.601 1.985 74.542 1.00 15.33 C ATOM 1248 C ILE A 547 5.282 0.759 75.144 1.00 18.71 C ATOM 1249 O ILE A 547 6.322 0.297 74.651 1.00 20.70 O ATOM 1250 CB ILE A 547 4.017 1.681 73.161 1.00 16.42 C ATOM 1251 CG1 ILE A 547 3.312 2.924 72.643 1.00 17.70 C ATOM 1252 CG2 ILE A 547 3.065 0.506 73.229 1.00 18.82 C ATOM 1253 CD1 ILE A 547 3.232 2.999 71.153 1.00 16.88 C ATOM 1254 H ILE A 547 6.050 3.271 73.572 1.00 0.00 H ATOM 1255 N ALA A 548 4.705 0.249 76.226 1.00 19.19 N ATOM 1256 CA ALA A 548 5.241 -0.844 77.022 1.00 16.42 C ATOM 1257 C ALA A 548 4.172 -1.261 78.011 1.00 17.46 C ATOM 1258 O ALA A 548 3.334 -0.448 78.410 1.00 16.60 O ATOM 1259 CB ALA A 548 6.516 -0.438 77.772 1.00 18.77 C ATOM 1260 H ALA A 548 3.800 0.663 76.527 1.00 0.00 H ATOM 1261 N ALA A 549 4.215 -2.529 78.421 1.00 16.00 N ATOM 1262 CA ALA A 549 3.185 -3.009 79.338 1.00 20.34 C ATOM 1263 C ALA A 549 3.192 -2.253 80.659 1.00 21.36 C ATOM 1264 O ALA A 549 2.139 -2.140 81.302 1.00 19.91 O ATOM 1265 CB ALA A 549 3.351 -4.511 79.591 1.00 20.61 C ATOM 1266 H ALA A 549 4.969 -3.165 78.093 1.00 0.00 H ATOM 1267 N ARG A 550 4.350 -1.728 81.080 1.00 20.83 N ATOM 1268 CA ARG A 550 4.431 -0.966 82.325 1.00 23.26 C ATOM 1269 C ARG A 550 3.573 0.289 82.295 1.00 22.93 C ATOM 1270 O ARG A 550 3.279 0.851 83.358 1.00 24.55 O ATOM 1271 CB ARG A 550 5.883 -0.576 82.628 1.00 23.22 C ATOM 1272 CG ARG A 550 6.338 0.709 81.951 1.00 30.16 C ATOM 1273 CD ARG A 550 7.822 0.995 82.155 1.00 37.56 C ATOM 1274 NE ARG A 550 8.405 1.541 80.932 1.00 45.62 N ATOM 1275 CZ ARG A 550 9.077 0.819 80.040 1.00 47.22 C ATOM 1276 NH1 ARG A 550 9.266 -0.478 80.240 1.00 47.45 N ATOM 1277 NH2 ARG A 550 9.563 1.392 78.946 1.00 45.30 N ATOM 1278 HE ARG A 550 8.287 2.558 80.747 1.00 0.00 H ATOM 1279 HH12 ARG A 550 9.792 -1.041 79.541 1.00 0.00 H ATOM 1280 HH11 ARG A 550 8.888 -0.933 81.096 1.00 0.00 H ATOM 1281 HH22 ARG A 550 10.088 0.824 78.251 1.00 0.00 H ATOM 1282 HH21 ARG A 550 9.419 2.409 78.784 1.00 0.00 H ATOM 1283 H ARG A 550 5.209 -1.865 80.510 1.00 0.00 H ATOM 1284 N ASN A 551 3.161 0.748 81.109 1.00 18.03 N ATOM 1285 CA ASN A 551 2.388 1.978 80.991 1.00 21.86 C ATOM 1286 C ASN A 551 0.929 1.706 80.650 1.00 20.04 C ATOM 1287 O ASN A 551 0.216 2.607 80.192 1.00 23.43 O ATOM 1288 CB ASN A 551 3.046 2.893 79.964 1.00 17.70 C ATOM 1289 CG ASN A 551 4.396 3.363 80.432 1.00 28.22 C ATOM 1290 OD1 ASN A 551 4.598 3.557 81.632 1.00 27.11 O ATOM 1291 ND2 ASN A 551 5.337 3.539 79.502 1.00 30.16 N ATOM 1292 HD22 ASN A 551 5.118 3.362 78.501 1.00 0.00 H ATOM 1293 HD21 ASN A 551 6.289 3.853 79.779 1.00 0.00 H ATOM 1294 H ASN A 551 3.398 0.214 80.249 1.00 0.00 H ATOM 1295 N VAL A 552 0.474 0.480 80.860 1.00 18.91 N ATOM 1296 CA VAL A 552 -0.923 0.116 80.648 1.00 16.30 C ATOM 1297 C VAL A 552 -1.573 -0.134 82.006 1.00 16.88 C ATOM 1298 O VAL A 552 -0.930 -0.639 82.940 1.00 19.23 O ATOM 1299 CB VAL A 552 -1.057 -1.115 79.729 1.00 17.10 C ATOM 1300 CG1 VAL A 552 -2.528 -1.432 79.464 1.00 17.73 C ATOM 1301 CG2 VAL A 552 -0.329 -0.881 78.413 1.00 22.56 C ATOM 1302 H VAL A 552 1.137 -0.251 81.188 1.00 0.00 H ATOM 1303 N LEU A 553 -2.840 0.259 82.121 1.00 16.81 N ATOM 1304 CA LEU A 553 -3.617 0.138 83.346 1.00 19.84 C ATOM 1305 C LEU A 553 -4.826 -0.754 83.110 1.00 20.28 C ATOM 1306 O LEU A 553 -5.347 -0.836 81.994 1.00 19.00 O ATOM 1307 CB LEU A 553 -4.093 1.504 83.829 1.00 19.94 C ATOM 1308 CG LEU A 553 -2.998 2.469 84.262 1.00 24.98 C ATOM 1309 CD1 LEU A 553 -3.582 3.876 84.405 1.00 24.38 C ATOM 1310 CD2 LEU A 553 -2.365 2.000 85.564 1.00 30.75 C ATOM 1311 H LEU A 553 -3.301 0.677 81.288 1.00 0.00 H ATOM 1312 N VAL A 554 -5.293 -1.404 84.173 1.00 17.95 N ATOM 1313 CA VAL A 554 -6.405 -2.347 84.072 1.00 17.58 C ATOM 1314 C VAL A 554 -7.627 -1.724 84.746 1.00 18.79 C ATOM 1315 O VAL A 554 -7.653 -1.521 85.968 1.00 19.86 O ATOM 1316 CB VAL A 554 -6.061 -3.708 84.690 1.00 17.78 C ATOM 1317 CG1 VAL A 554 -7.210 -4.678 84.465 1.00 19.44 C ATOM 1318 CG2 VAL A 554 -4.767 -4.259 84.104 1.00 21.81 C ATOM 1319 H VAL A 554 -4.855 -1.236 85.101 1.00 0.00 H ATOM 1320 N SER A 555 -8.645 -1.418 83.943 1.00 19.98 N ATOM 1321 CA SER A 555 -9.868 -0.803 84.438 1.00 21.44 C ATOM 1322 C SER A 555 -10.845 -1.846 84.947 1.00 20.33 C ATOM 1323 O SER A 555 -11.543 -1.616 85.944 1.00 22.69 O ATOM 1324 CB SER A 555 -10.517 0.023 83.319 1.00 22.20 C ATOM 1325 OG SER A 555 -11.664 0.706 83.788 1.00 32.20 O ATOM 1326 HG SER A 555 -11.405 1.317 84.523 1.00 0.00 H ATOM 1327 H SER A 555 -8.563 -1.626 82.927 1.00 0.00 H ATOM 1328 N ALA A 556 -10.872 -2.995 84.289 1.00 18.72 N ATOM 1329 CA ALA A 556 -11.763 -4.103 84.607 1.00 19.87 C ATOM 1330 C ALA A 556 -11.135 -5.333 83.974 1.00 20.34 C ATOM 1331 O ALA A 556 -10.223 -5.219 83.159 1.00 20.39 O ATOM 1332 CB ALA A 556 -13.179 -3.857 84.072 1.00 23.82 C ATOM 1333 H ALA A 556 -10.214 -3.114 83.493 1.00 0.00 H ATOM 1334 N THR A 557 -11.628 -6.520 84.339 1.00 22.01 N ATOM 1335 CA THR A 557 -11.052 -7.715 83.729 1.00 21.49 C ATOM 1336 C THR A 557 -11.246 -7.739 82.215 1.00 18.04 C ATOM 1337 O THR A 557 -10.525 -8.468 81.527 1.00 21.14 O ATOM 1338 CB THR A 557 -11.624 -9.000 84.361 1.00 21.26 C ATOM 1339 OG1 THR A 557 -13.048 -9.057 84.198 1.00 27.98 O ATOM 1340 CG2 THR A 557 -11.293 -9.073 85.834 1.00 24.43 C ATOM 1341 HG1 THR A 557 -13.393 -9.888 84.610 1.00 0.00 H ATOM 1342 H THR A 557 -12.397 -6.590 85.035 1.00 0.00 H ATOM 1343 N ASP A 558 -12.190 -6.957 81.675 1.00 19.70 N ATOM 1344 CA ASP A 558 -12.399 -6.885 80.234 1.00 20.54 C ATOM 1345 C ASP A 558 -12.047 -5.517 79.650 1.00 19.66 C ATOM 1346 O ASP A 558 -12.604 -5.123 78.620 1.00 21.71 O ATOM 1347 CB ASP A 558 -13.843 -7.239 79.888 1.00 24.74 C ATOM 1348 CG ASP A 558 -14.848 -6.294 80.538 1.00 34.98 C ATOM 1349 OD1 ASP A 558 -14.431 -5.421 81.327 1.00 26.27 O ATOM 1350 OD2 ASP A 558 -16.061 -6.411 80.250 1.00 32.12 O ATOM 1351 H ASP A 558 -12.791 -6.385 82.302 1.00 0.00 H ATOM 1352 N CYS A 559 -11.135 -4.776 80.282 1.00 19.27 N ATOM 1353 CA CYS A 559 -10.876 -3.416 79.799 1.00 17.20 C ATOM 1354 C CYS A 559 -9.521 -2.918 80.272 1.00 18.20 C ATOM 1355 O CYS A 559 -9.310 -2.757 81.477 1.00 20.40 O ATOM 1356 CB CYS A 559 -11.975 -2.464 80.269 1.00 19.89 C ATOM 1357 SG CYS A 559 -11.756 -0.804 79.579 1.00 22.89 S ATOM 1358 H CYS A 559 -10.618 -5.155 81.101 1.00 0.00 H ATOM 1359 N VAL A 560 -8.619 -2.628 79.328 1.00 16.93 N ATOM 1360 CA VAL A 560 -7.340 -2.003 79.656 1.00 15.88 C ATOM 1361 C VAL A 560 -7.257 -0.645 78.968 1.00 17.88 C ATOM 1362 O VAL A 560 -7.961 -0.371 77.995 1.00 18.29 O ATOM 1363 CB VAL A 560 -6.127 -2.864 79.258 1.00 16.59 C ATOM 1364 CG1 VAL A 560 -6.091 -4.144 80.079 1.00 16.97 C ATOM 1365 CG2 VAL A 560 -6.121 -3.164 77.750 1.00 17.36 C ATOM 1366 H VAL A 560 -8.834 -2.853 78.336 1.00 0.00 H ATOM 1367 N LYS A 561 -6.361 0.202 79.476 1.00 17.13 N ATOM 1368 CA LYS A 561 -6.232 1.571 78.984 1.00 15.07 C ATOM 1369 C LYS A 561 -4.781 2.008 79.043 1.00 17.86 C ATOM 1370 O LYS A 561 -4.050 1.653 79.978 1.00 19.17 O ATOM 1371 CB LYS A 561 -7.092 2.560 79.804 1.00 19.50 C ATOM 1372 CG LYS A 561 -8.575 2.242 79.760 1.00 19.53 C ATOM 1373 CD LYS A 561 -9.431 3.333 80.355 1.00 19.65 C ATOM 1374 CE LYS A 561 -10.877 2.843 80.407 1.00 20.76 C ATOM 1375 NZ LYS A 561 -11.854 3.963 80.578 1.00 24.51 N ATOM 1376 HZ1 LYS A 561 -11.652 4.465 81.467 1.00 0.00 H ATOM 1377 HZ2 LYS A 561 -11.767 4.623 79.779 1.00 0.00 H ATOM 1378 HZ3 LYS A 561 -12.820 3.578 80.607 1.00 0.00 H ATOM 1379 H LYS A 561 -5.737 -0.121 80.243 1.00 0.00 H ATOM 1380 N LEU A 562 -4.367 2.787 78.045 1.00 15.71 N ATOM 1381 CA LEU A 562 -3.070 3.437 78.134 1.00 15.10 C ATOM 1382 C LEU A 562 -3.078 4.394 79.314 1.00 18.25 C ATOM 1383 O LEU A 562 -4.013 5.184 79.472 1.00 21.68 O ATOM 1384 CB LEU A 562 -2.772 4.209 76.852 1.00 21.18 C ATOM 1385 CG LEU A 562 -2.485 3.466 75.565 1.00 24.58 C ATOM 1386 CD1 LEU A 562 -2.207 4.517 74.483 1.00 20.97 C ATOM 1387 CD2 LEU A 562 -1.297 2.558 75.791 1.00 27.27 C ATOM 1388 H LEU A 562 -4.968 2.929 77.208 1.00 0.00 H ATOM 1389 N GLY A 563 -2.060 4.295 80.158 1.00 17.04 N ATOM 1390 CA GLY A 563 -1.945 5.164 81.305 1.00 20.95 C ATOM 1391 C GLY A 563 -1.576 6.587 80.928 1.00 25.59 C ATOM 1392 O GLY A 563 -1.362 6.938 79.768 1.00 24.24 O ATOM 1393 H GLY A 563 -1.328 3.575 79.990 1.00 0.00 H ATOM 1394 N ASP A 564 -1.516 7.425 81.958 1.00 31.04 N ATOM 1395 CA ASP A 564 -1.174 8.829 81.784 1.00 36.52 C ATOM 1396 C ASP A 564 0.186 8.961 81.103 1.00 37.36 C ATOM 1397 O ASP A 564 1.140 8.260 81.455 1.00 33.38 O ATOM 1398 CB ASP A 564 -1.188 9.519 83.152 1.00 42.92 C ATOM 1399 CG ASP A 564 -0.534 10.876 83.133 1.00 44.07 C ATOM 1400 OD1 ASP A 564 -1.156 11.815 82.599 1.00 56.05 O ATOM 1401 OD2 ASP A 564 0.577 11.017 83.681 1.00 46.84 O ATOM 1402 H ASP A 564 -1.719 7.068 82.914 1.00 0.00 H ATOM 1403 N PHE A 565 0.269 9.848 80.103 1.00 31.85 N ATOM 1404 CA PHE A 565 1.478 9.910 79.285 1.00 35.06 C ATOM 1405 C PHE A 565 2.651 10.479 80.070 1.00 42.98 C ATOM 1406 O PHE A 565 3.803 10.113 79.810 1.00 43.31 O ATOM 1407 CB PHE A 565 1.228 10.729 78.012 1.00 27.71 C ATOM 1408 CG PHE A 565 0.223 10.105 77.064 1.00 33.03 C ATOM 1409 CD1 PHE A 565 -0.359 8.876 77.345 1.00 30.76 C ATOM 1410 CD2 PHE A 565 -0.122 10.744 75.883 1.00 25.59 C ATOM 1411 CE1 PHE A 565 -1.287 8.307 76.485 1.00 28.29 C ATOM 1412 CE2 PHE A 565 -1.039 10.183 75.019 1.00 23.05 C ATOM 1413 CZ PHE A 565 -1.623 8.955 75.318 1.00 23.89 C ATOM 1414 H PHE A 565 -0.525 10.491 79.909 1.00 0.00 H ATOM 1415 N GLY A 566 2.383 11.358 81.037 1.00 46.05 N ATOM 1416 CA GLY A 566 3.450 11.831 81.906 1.00 46.97 C ATOM 1417 C GLY A 566 4.023 10.727 82.776 1.00 47.67 C ATOM 1418 O GLY A 566 5.244 10.583 82.896 1.00 48.13 O ATOM 1419 H GLY A 566 1.412 11.705 81.170 1.00 0.00 H ATOM 1420 N LEU A 567 3.151 9.931 83.400 1.00 48.03 N ATOM 1421 CA LEU A 567 3.614 8.820 84.225 1.00 48.49 C ATOM 1422 C LEU A 567 4.181 7.675 83.397 1.00 50.13 C ATOM 1423 O LEU A 567 4.797 6.764 83.963 1.00 59.71 O ATOM 1424 CB LEU A 567 2.476 8.312 85.115 1.00 39.22 C ATOM 1425 CG LEU A 567 2.054 9.283 86.224 1.00 44.83 C ATOM 1426 CD1 LEU A 567 0.733 8.865 86.858 1.00 51.01 C ATOM 1427 CD2 LEU A 567 3.149 9.412 87.273 1.00 48.55 C ATOM 1428 H LEU A 567 2.131 10.105 83.297 1.00 0.00 H ATOM 1429 N SER A 568 3.988 7.698 82.078 1.00 46.92 N ATOM 1430 CA SER A 568 4.648 6.724 81.218 1.00 44.49 C ATOM 1431 C SER A 568 6.129 7.040 81.061 1.00 52.84 C ATOM 1432 O SER A 568 6.951 6.121 80.963 1.00 63.05 O ATOM 1433 CB SER A 568 3.953 6.679 79.854 1.00 36.99 C ATOM 1434 OG SER A 568 2.631 6.172 79.978 1.00 39.77 O ATOM 1435 HG SER A 568 2.202 6.152 79.086 1.00 0.00 H ATOM 1436 H SER A 568 3.362 8.416 81.660 1.00 0.00 H ATOM 1437 N ARG A 569 6.486 8.324 81.064 1.00 54.52 N ATOM 1438 CA ARG A 569 7.860 8.778 80.858 1.00 53.47 C ATOM 1439 C ARG A 569 8.804 8.271 81.946 1.00 58.44 C ATOM 1440 O ARG A 569 9.747 7.528 81.667 1.00 61.25 O ATOM 1441 CB ARG A 569 7.899 10.311 80.796 1.00 51.40 C ATOM 1442 CG ARG A 569 9.248 10.906 80.408 1.00 57.12 C ATOM 1443 CD ARG A 569 9.197 12.432 80.419 1.00 58.47 C ATOM 1444 NE ARG A 569 7.841 12.926 80.192 1.00 62.71 N ATOM 1445 CZ ARG A 569 7.546 14.023 79.501 1.00 62.02 C ATOM 1446 NH1 ARG A 569 8.515 14.752 78.962 1.00 64.34 N ATOM 1447 NH2 ARG A 569 6.279 14.391 79.348 1.00 62.11 N ATOM 1448 HE ARG A 569 7.053 12.383 80.599 1.00 0.00 H ATOM 1449 HH12 ARG A 569 8.282 15.610 78.422 1.00 0.00 H ATOM 1450 HH11 ARG A 569 9.508 14.466 79.080 1.00 0.00 H ATOM 1451 HH22 ARG A 569 6.048 15.249 78.807 1.00 0.00 H ATOM 1452 HH21 ARG A 569 5.518 13.821 79.769 1.00 0.00 H ATOM 1453 H ARG A 569 5.749 9.040 81.221 1.00 0.00 H TER 1454 ARG A 569 ATOM 1455 N LEU A 584 16.717 5.357 78.656 1.00 48.19 N ATOM 1456 CA LEU A 584 15.847 5.055 77.527 1.00 35.92 C ATOM 1457 C LEU A 584 15.336 3.613 77.593 1.00 29.78 C ATOM 1458 O LEU A 584 16.041 2.720 78.061 1.00 34.14 O ATOM 1459 CB LEU A 584 16.587 5.289 76.204 1.00 29.81 C ATOM 1460 CG LEU A 584 16.989 6.729 75.868 1.00 40.70 C ATOM 1461 CD1 LEU A 584 18.098 6.750 74.827 1.00 38.40 C ATOM 1462 CD2 LEU A 584 15.787 7.517 75.371 1.00 48.97 C ATOM 1463 HN3 LEU A 584 17.534 4.714 78.644 1.00 0.00 H ATOM 1464 HN2 LEU A 584 16.188 5.232 79.543 1.00 0.00 H ATOM 1465 HN1 LEU A 584 17.048 6.340 78.584 1.00 0.00 H ATOM 1466 N PRO A 585 14.112 3.382 77.110 1.00 26.67 N ATOM 1467 CA PRO A 585 13.569 2.011 77.059 1.00 21.80 C ATOM 1468 C PRO A 585 14.105 1.225 75.866 1.00 19.77 C ATOM 1469 O PRO A 585 13.359 0.817 74.972 1.00 18.21 O ATOM 1470 CB PRO A 585 12.061 2.265 76.958 1.00 24.07 C ATOM 1471 CG PRO A 585 11.980 3.512 76.160 1.00 19.85 C ATOM 1472 CD PRO A 585 13.141 4.370 76.612 1.00 27.31 C ATOM 1473 N ILE A 586 15.421 0.997 75.866 1.00 21.93 N ATOM 1474 CA ILE A 586 16.108 0.424 74.704 1.00 19.52 C ATOM 1475 C ILE A 586 15.459 -0.874 74.252 1.00 19.44 C ATOM 1476 O ILE A 586 15.270 -1.102 73.051 1.00 18.65 O ATOM 1477 CB ILE A 586 17.602 0.225 75.028 1.00 23.16 C ATOM 1478 CG1 ILE A 586 18.277 1.583 75.246 1.00 24.65 C ATOM 1479 CG2 ILE A 586 18.312 -0.584 73.933 1.00 24.01 C ATOM 1480 CD1 ILE A 586 18.320 2.469 73.996 1.00 23.74 C ATOM 1481 H ILE A 586 15.974 1.233 76.714 1.00 0.00 H ATOM 1482 N LYS A 587 15.095 -1.737 75.199 1.00 16.59 N ATOM 1483 CA LYS A 587 14.604 -3.060 74.843 1.00 17.41 C ATOM 1484 C LYS A 587 13.234 -3.030 74.182 1.00 18.12 C ATOM 1485 O LYS A 587 12.792 -4.072 73.689 1.00 18.63 O ATOM 1486 CB LYS A 587 14.590 -3.952 76.081 1.00 17.47 C ATOM 1487 CG LYS A 587 16.001 -4.284 76.549 1.00 19.05 C ATOM 1488 CD LYS A 587 16.023 -5.037 77.866 1.00 22.38 C ATOM 1489 CE LYS A 587 17.448 -5.419 78.249 1.00 22.90 C ATOM 1490 NZ LYS A 587 17.502 -6.038 79.609 1.00 27.55 N ATOM 1491 HZ1 LYS A 587 17.142 -5.361 80.311 1.00 0.00 H ATOM 1492 HZ2 LYS A 587 16.916 -6.897 79.621 1.00 0.00 H ATOM 1493 HZ3 LYS A 587 18.486 -6.285 79.837 1.00 0.00 H ATOM 1494 H LYS A 587 15.162 -1.463 76.200 1.00 0.00 H ATOM 1495 N TRP A 588 12.564 -1.867 74.168 1.00 15.07 N ATOM 1496 CA TRP A 588 11.302 -1.682 73.470 1.00 13.82 C ATOM 1497 C TRP A 588 11.439 -0.890 72.184 1.00 14.58 C ATOM 1498 O TRP A 588 10.475 -0.851 71.400 1.00 15.46 O ATOM 1499 CB TRP A 588 10.288 -0.951 74.368 1.00 15.84 C ATOM 1500 CG TRP A 588 9.770 -1.765 75.505 1.00 14.65 C ATOM 1501 CD1 TRP A 588 8.557 -2.389 75.577 1.00 16.11 C ATOM 1502 CD2 TRP A 588 10.435 -2.040 76.740 1.00 15.72 C ATOM 1503 NE1 TRP A 588 8.425 -3.037 76.775 1.00 18.70 N ATOM 1504 CE2 TRP A 588 9.563 -2.839 77.512 1.00 17.16 C ATOM 1505 CE3 TRP A 588 11.679 -1.704 77.267 1.00 18.70 C ATOM 1506 CZ2 TRP A 588 9.901 -3.303 78.778 1.00 23.06 C ATOM 1507 CZ3 TRP A 588 12.009 -2.149 78.531 1.00 26.32 C ATOM 1508 CH2 TRP A 588 11.121 -2.945 79.275 1.00 27.51 C ATOM 1509 HE1 TRP A 588 7.597 -3.589 77.077 1.00 0.00 H ATOM 1510 H TRP A 588 12.968 -1.058 74.682 1.00 0.00 H ATOM 1511 N MET A 589 12.593 -0.263 71.941 1.00 17.85 N ATOM 1512 CA MET A 589 12.706 0.766 70.921 1.00 15.78 C ATOM 1513 C MET A 589 13.033 0.200 69.544 1.00 15.77 C ATOM 1514 O MET A 589 13.717 -0.823 69.406 1.00 16.37 O ATOM 1515 CB MET A 589 13.766 1.795 71.328 1.00 15.79 C ATOM 1516 CG MET A 589 13.267 2.761 72.374 1.00 18.76 C ATOM 1517 SD MET A 589 14.622 3.639 73.154 1.00 21.76 S ATOM 1518 CE MET A 589 15.192 4.684 71.803 1.00 18.03 C ATOM 1519 H MET A 589 13.434 -0.518 72.497 1.00 0.00 H ATOM 1520 N ALA A 590 12.486 0.854 68.516 1.00 13.90 N ATOM 1521 CA ALA A 590 12.800 0.476 67.147 1.00 17.06 C ATOM 1522 C ALA A 590 14.268 0.769 66.837 1.00 13.87 C ATOM 1523 O ALA A 590 14.873 1.664 67.440 1.00 16.42 O ATOM 1524 CB ALA A 590 11.916 1.233 66.163 1.00 18.12 C ATOM 1525 H ALA A 590 11.830 1.640 68.696 1.00 0.00 H ATOM 1526 N PRO A 591 14.863 0.034 65.888 1.00 15.08 N ATOM 1527 CA PRO A 591 16.285 0.263 65.589 1.00 18.53 C ATOM 1528 C PRO A 591 16.588 1.687 65.164 1.00 16.10 C ATOM 1529 O PRO A 591 17.635 2.218 65.554 1.00 17.67 O ATOM 1530 CB PRO A 591 16.592 -0.752 64.468 1.00 16.57 C ATOM 1531 CG PRO A 591 15.273 -1.397 64.099 1.00 19.28 C ATOM 1532 CD PRO A 591 14.333 -1.184 65.242 1.00 16.07 C ATOM 1533 N GLU A 592 15.707 2.330 64.393 1.00 16.13 N ATOM 1534 CA GLU A 592 16.005 3.690 63.969 1.00 15.43 C ATOM 1535 C GLU A 592 15.883 4.681 65.119 1.00 17.79 C ATOM 1536 O GLU A 592 16.485 5.758 65.052 1.00 17.22 O ATOM 1537 CB GLU A 592 15.105 4.106 62.796 1.00 17.04 C ATOM 1538 CG GLU A 592 13.644 4.299 63.149 1.00 17.76 C ATOM 1539 CD GLU A 592 12.823 3.012 63.113 1.00 15.53 C ATOM 1540 OE1 GLU A 592 11.572 3.146 63.226 1.00 15.85 O ATOM 1541 OE2 GLU A 592 13.394 1.880 62.975 1.00 16.08 O ATOM 1542 H GLU A 592 14.823 1.867 64.101 1.00 0.00 H ATOM 1543 N SER A 593 15.141 4.334 66.174 1.00 19.53 N ATOM 1544 CA SER A 593 15.120 5.162 67.377 1.00 15.42 C ATOM 1545 C SER A 593 16.412 5.005 68.171 1.00 15.55 C ATOM 1546 O SER A 593 16.973 5.990 68.675 1.00 19.08 O ATOM 1547 CB SER A 593 13.916 4.776 68.241 1.00 16.09 C ATOM 1548 OG SER A 593 12.711 4.910 67.506 1.00 15.41 O ATOM 1549 HG SER A 593 12.608 5.850 67.212 1.00 0.00 H ATOM 1550 H SER A 593 14.572 3.464 66.138 1.00 0.00 H ATOM 1551 N ILE A 594 16.889 3.767 68.305 1.00 16.27 N ATOM 1552 CA ILE A 594 18.141 3.515 69.017 1.00 17.56 C ATOM 1553 C ILE A 594 19.308 4.136 68.266 1.00 19.22 C ATOM 1554 O ILE A 594 20.169 4.788 68.862 1.00 20.85 O ATOM 1555 CB ILE A 594 18.355 1.999 69.204 1.00 19.23 C ATOM 1556 CG1 ILE A 594 17.354 1.418 70.189 1.00 17.11 C ATOM 1557 CG2 ILE A 594 19.787 1.680 69.683 1.00 19.00 C ATOM 1558 CD1 ILE A 594 17.287 -0.122 70.074 1.00 15.11 C ATOM 1559 H ILE A 594 16.362 2.968 67.897 1.00 0.00 H ATOM 1560 N ASN A 595 19.364 3.918 66.953 1.00 21.30 N ATOM 1561 CA ASN A 595 20.525 4.346 66.171 1.00 20.80 C ATOM 1562 C ASN A 595 20.532 5.854 65.935 1.00 21.25 C ATOM 1563 O ASN A 595 21.573 6.503 66.068 1.00 22.82 O ATOM 1564 CB ASN A 595 20.558 3.613 64.832 1.00 17.58 C ATOM 1565 CG ASN A 595 21.008 2.153 64.959 1.00 22.24 C ATOM 1566 OD1 ASN A 595 21.844 1.821 65.795 1.00 23.14 O ATOM 1567 ND2 ASN A 595 20.464 1.294 64.107 1.00 22.29 N ATOM 1568 HD22 ASN A 595 19.759 1.622 63.416 1.00 0.00 H ATOM 1569 HD21 ASN A 595 20.742 0.292 64.130 1.00 0.00 H ATOM 1570 H ASN A 595 18.573 3.438 66.478 1.00 0.00 H ATOM 1571 N PHE A 596 19.384 6.432 65.561 1.00 19.51 N ATOM 1572 CA PHE A 596 19.368 7.797 65.042 1.00 22.36 C ATOM 1573 C PHE A 596 18.327 8.688 65.709 1.00 18.40 C ATOM 1574 O PHE A 596 18.074 9.793 65.215 1.00 23.13 O ATOM 1575 CB PHE A 596 19.147 7.777 63.521 1.00 21.47 C ATOM 1576 CG PHE A 596 20.027 6.783 62.793 1.00 21.90 C ATOM 1577 CD1 PHE A 596 21.411 6.926 62.818 1.00 21.69 C ATOM 1578 CD2 PHE A 596 19.477 5.714 62.100 1.00 25.79 C ATOM 1579 CE1 PHE A 596 22.254 6.022 62.142 1.00 23.44 C ATOM 1580 CE2 PHE A 596 20.306 4.795 61.434 1.00 21.88 C ATOM 1581 CZ PHE A 596 21.684 4.942 61.464 1.00 21.28 C ATOM 1582 H PHE A 596 18.492 5.902 65.641 1.00 0.00 H ATOM 1583 N ARG A 597 17.706 8.244 66.802 1.00 19.92 N ATOM 1584 CA ARG A 597 16.718 9.049 67.524 1.00 21.44 C ATOM 1585 C ARG A 597 15.547 9.460 66.631 1.00 21.32 C ATOM 1586 O ARG A 597 14.946 10.524 66.827 1.00 23.18 O ATOM 1587 CB ARG A 597 17.362 10.283 68.162 1.00 28.77 C ATOM 1588 CG ARG A 597 18.414 9.929 69.202 1.00 34.12 C ATOM 1589 CD ARG A 597 17.859 8.980 70.262 1.00 42.01 C ATOM 1590 NE ARG A 597 18.432 9.239 71.581 1.00 49.09 N ATOM 1591 CZ ARG A 597 18.103 10.272 72.354 1.00 58.37 C ATOM 1592 NH1 ARG A 597 18.682 10.427 73.539 1.00 56.84 N ATOM 1593 NH2 ARG A 597 17.192 11.149 71.947 1.00 60.39 N ATOM 1594 HE ARG A 597 19.144 8.572 71.940 1.00 0.00 H ATOM 1595 HH12 ARG A 597 18.424 11.234 74.142 1.00 0.00 H ATOM 1596 HH11 ARG A 597 19.393 9.741 73.864 1.00 0.00 H ATOM 1597 HH22 ARG A 597 16.938 11.954 72.554 1.00 0.00 H ATOM 1598 HH21 ARG A 597 16.733 11.030 71.021 1.00 0.00 H ATOM 1599 H ARG A 597 17.931 7.292 67.155 1.00 0.00 H ATOM 1600 N ARG A 598 15.204 8.627 65.649 1.00 18.96 N ATOM 1601 CA ARG A 598 14.010 8.854 64.844 1.00 17.80 C ATOM 1602 C ARG A 598 12.811 8.241 65.555 1.00 17.11 C ATOM 1603 O ARG A 598 12.873 7.092 65.985 1.00 19.51 O ATOM 1604 CB ARG A 598 14.165 8.246 63.447 1.00 18.25 C ATOM 1605 CG ARG A 598 13.126 8.796 62.452 1.00 21.89 C ATOM 1606 CD ARG A 598 13.065 8.003 61.155 1.00 23.35 C ATOM 1607 NE ARG A 598 14.369 7.847 60.511 1.00 20.08 N ATOM 1608 CZ ARG A 598 14.704 6.812 59.739 1.00 23.92 C ATOM 1609 NH1 ARG A 598 13.844 5.818 59.519 1.00 20.05 N ATOM 1610 NH2 ARG A 598 15.908 6.767 59.187 1.00 23.99 N ATOM 1611 HE ARG A 598 15.080 8.590 60.665 1.00 0.00 H ATOM 1612 HH12 ARG A 598 14.118 5.017 58.915 1.00 0.00 H ATOM 1613 HH11 ARG A 598 12.898 5.843 59.951 1.00 0.00 H ATOM 1614 HH22 ARG A 598 16.174 5.962 58.584 1.00 0.00 H ATOM 1615 HH21 ARG A 598 16.587 7.536 59.356 1.00 0.00 H ATOM 1616 H ARG A 598 15.800 7.798 65.453 1.00 0.00 H ATOM 1617 N PHE A 599 11.732 9.017 65.695 1.00 16.97 N ATOM 1618 CA PHE A 599 10.507 8.565 66.349 1.00 16.26 C ATOM 1619 C PHE A 599 9.337 8.940 65.460 1.00 17.02 C ATOM 1620 O PHE A 599 9.145 10.124 65.146 1.00 20.50 O ATOM 1621 CB PHE A 599 10.338 9.202 67.735 1.00 19.05 C ATOM 1622 CG PHE A 599 11.427 8.827 68.708 1.00 20.22 C ATOM 1623 CD1 PHE A 599 11.323 7.667 69.452 1.00 20.56 C ATOM 1624 CD2 PHE A 599 12.540 9.647 68.881 1.00 24.27 C ATOM 1625 CE1 PHE A 599 12.314 7.320 70.355 1.00 25.85 C ATOM 1626 CE2 PHE A 599 13.536 9.301 69.781 1.00 27.69 C ATOM 1627 CZ PHE A 599 13.417 8.136 70.516 1.00 26.50 C ATOM 1628 H PHE A 599 11.766 9.987 65.321 1.00 0.00 H ATOM 1629 N THR A 600 8.588 7.924 65.029 1.00 17.03 N ATOM 1630 CA THR A 600 7.417 8.091 64.186 1.00 16.57 C ATOM 1631 C THR A 600 6.353 7.116 64.663 1.00 15.18 C ATOM 1632 O THR A 600 6.578 6.319 65.571 1.00 16.67 O ATOM 1633 CB THR A 600 7.727 7.825 62.712 1.00 17.10 C ATOM 1634 OG1 THR A 600 8.001 6.432 62.552 1.00 18.49 O ATOM 1635 CG2 THR A 600 8.901 8.651 62.202 1.00 17.89 C ATOM 1636 HG1 THR A 600 8.779 6.183 63.112 1.00 0.00 H ATOM 1637 H THR A 600 8.857 6.960 65.312 1.00 0.00 H ATOM 1638 N SER A 601 5.179 7.186 64.042 1.00 15.01 N ATOM 1639 CA SER A 601 4.178 6.179 64.364 1.00 14.39 C ATOM 1640 C SER A 601 4.683 4.781 64.040 1.00 13.80 C ATOM 1641 O SER A 601 4.296 3.820 64.718 1.00 15.06 O ATOM 1642 CB SER A 601 2.875 6.494 63.645 1.00 15.50 C ATOM 1643 OG SER A 601 2.240 7.616 64.283 1.00 20.18 O ATOM 1644 HG SER A 601 2.052 7.393 65.229 1.00 0.00 H ATOM 1645 H SER A 601 4.982 7.936 63.349 1.00 0.00 H ATOM 1646 N ALA A 602 5.566 4.644 63.038 1.00 14.11 N ATOM 1647 CA ALA A 602 6.113 3.322 62.720 1.00 13.12 C ATOM 1648 C ALA A 602 7.072 2.823 63.795 1.00 15.77 C ATOM 1649 O ALA A 602 7.164 1.599 64.019 1.00 14.44 O ATOM 1650 CB ALA A 602 6.794 3.336 61.346 1.00 13.59 C ATOM 1651 H ALA A 602 5.862 5.476 62.488 1.00 0.00 H ATOM 1652 N SER A 603 7.801 3.723 64.466 1.00 15.51 N ATOM 1653 CA SER A 603 8.577 3.255 65.612 1.00 16.62 C ATOM 1654 C SER A 603 7.669 2.928 66.800 1.00 16.05 C ATOM 1655 O SER A 603 7.965 1.993 67.558 1.00 15.67 O ATOM 1656 CB SER A 603 9.690 4.245 65.987 1.00 16.70 C ATOM 1657 OG SER A 603 9.209 5.478 66.483 1.00 16.38 O ATOM 1658 HG SER A 603 8.670 5.317 67.297 1.00 0.00 H ATOM 1659 H SER A 603 7.815 4.723 64.181 1.00 0.00 H ATOM 1660 N ASP A 604 6.536 3.636 66.950 1.00 14.85 N ATOM 1661 CA ASP A 604 5.541 3.232 67.945 1.00 14.43 C ATOM 1662 C ASP A 604 5.043 1.813 67.669 1.00 15.30 C ATOM 1663 O ASP A 604 4.812 1.032 68.598 1.00 15.14 O ATOM 1664 CB ASP A 604 4.357 4.210 67.944 1.00 18.83 C ATOM 1665 CG ASP A 604 4.595 5.482 68.773 1.00 21.72 C ATOM 1666 OD1 ASP A 604 5.617 5.613 69.493 1.00 17.54 O ATOM 1667 OD2 ASP A 604 3.709 6.361 68.678 1.00 19.61 O ATOM 1668 H ASP A 604 6.366 4.473 66.357 1.00 0.00 H ATOM 1669 N VAL A 605 4.826 1.476 66.391 1.00 13.19 N ATOM 1670 CA VAL A 605 4.343 0.145 66.033 1.00 13.35 C ATOM 1671 C VAL A 605 5.318 -0.936 66.506 1.00 15.41 C ATOM 1672 O VAL A 605 4.904 -1.977 67.045 1.00 14.37 O ATOM 1673 CB VAL A 605 4.083 0.078 64.513 1.00 12.88 C ATOM 1674 CG1 VAL A 605 4.059 -1.395 64.034 1.00 13.72 C ATOM 1675 CG2 VAL A 605 2.759 0.730 64.177 1.00 13.43 C ATOM 1676 H VAL A 605 5.004 2.174 65.641 1.00 0.00 H ATOM 1677 N TRP A 606 6.625 -0.705 66.347 1.00 14.35 N ATOM 1678 CA TRP A 606 7.622 -1.635 66.879 1.00 14.79 C ATOM 1679 C TRP A 606 7.448 -1.842 68.381 1.00 15.33 C ATOM 1680 O TRP A 606 7.408 -2.989 68.863 1.00 13.42 O ATOM 1681 CB TRP A 606 9.037 -1.126 66.571 1.00 14.39 C ATOM 1682 CG TRP A 606 10.143 -2.024 67.078 1.00 14.45 C ATOM 1683 CD1 TRP A 606 10.484 -2.254 68.390 1.00 11.89 C ATOM 1684 CD2 TRP A 606 11.052 -2.805 66.287 1.00 13.86 C ATOM 1685 NE1 TRP A 606 11.543 -3.130 68.454 1.00 14.59 N ATOM 1686 CE2 TRP A 606 11.916 -3.475 67.181 1.00 15.22 C ATOM 1687 CE3 TRP A 606 11.233 -2.980 64.915 1.00 13.89 C ATOM 1688 CZ2 TRP A 606 12.930 -4.347 66.744 1.00 18.14 C ATOM 1689 CZ3 TRP A 606 12.248 -3.831 64.473 1.00 14.72 C ATOM 1690 CH2 TRP A 606 13.090 -4.498 65.392 1.00 15.75 C ATOM 1691 HE1 TRP A 606 11.989 -3.475 69.328 1.00 0.00 H ATOM 1692 H TRP A 606 6.937 0.147 65.839 1.00 0.00 H ATOM 1693 N MET A 607 7.379 -0.736 69.142 1.00 13.51 N ATOM 1694 CA MET A 607 7.172 -0.815 70.582 1.00 11.90 C ATOM 1695 C MET A 607 5.910 -1.595 70.903 1.00 16.05 C ATOM 1696 O MET A 607 5.888 -2.399 71.845 1.00 16.17 O ATOM 1697 CB MET A 607 7.070 0.588 71.193 1.00 12.48 C ATOM 1698 CG MET A 607 8.257 1.449 70.850 1.00 14.39 C ATOM 1699 SD MET A 607 8.230 2.977 71.816 1.00 18.72 S ATOM 1700 CE MET A 607 9.204 2.458 73.242 1.00 19.29 C ATOM 1701 H MET A 607 7.476 0.197 68.693 1.00 0.00 H ATOM 1702 N PHE A 608 4.839 -1.362 70.135 1.00 12.17 N ATOM 1703 CA PHE A 608 3.599 -2.084 70.397 1.00 14.04 C ATOM 1704 C PHE A 608 3.763 -3.577 70.176 1.00 14.54 C ATOM 1705 O PHE A 608 3.162 -4.381 70.896 1.00 15.93 O ATOM 1706 CB PHE A 608 2.466 -1.539 69.525 1.00 13.14 C ATOM 1707 CG PHE A 608 1.133 -2.232 69.755 1.00 13.65 C ATOM 1708 CD1 PHE A 608 0.559 -2.234 71.011 1.00 14.98 C ATOM 1709 CD2 PHE A 608 0.464 -2.846 68.707 1.00 13.89 C ATOM 1710 CE1 PHE A 608 -0.667 -2.854 71.226 1.00 17.13 C ATOM 1711 CE2 PHE A 608 -0.765 -3.487 68.925 1.00 16.35 C ATOM 1712 CZ PHE A 608 -1.322 -3.476 70.176 1.00 17.52 C ATOM 1713 H PHE A 608 4.890 -0.672 69.358 1.00 0.00 H ATOM 1714 N GLY A 609 4.543 -3.975 69.172 1.00 14.36 N ATOM 1715 CA GLY A 609 4.839 -5.390 69.020 1.00 13.55 C ATOM 1716 C GLY A 609 5.439 -5.975 70.280 1.00 13.61 C ATOM 1717 O GLY A 609 5.056 -7.071 70.710 1.00 14.86 O ATOM 1718 H GLY A 609 4.936 -3.281 68.504 1.00 0.00 H ATOM 1719 N VAL A 610 6.373 -5.245 70.899 1.00 14.94 N ATOM 1720 CA VAL A 610 6.999 -5.713 72.133 1.00 14.34 C ATOM 1721 C VAL A 610 5.971 -5.756 73.256 1.00 14.65 C ATOM 1722 O VAL A 610 5.918 -6.718 74.027 1.00 15.85 O ATOM 1723 CB VAL A 610 8.203 -4.831 72.517 1.00 13.84 C ATOM 1724 CG1 VAL A 610 8.798 -5.326 73.808 1.00 15.91 C ATOM 1725 CG2 VAL A 610 9.268 -4.844 71.402 1.00 15.74 C ATOM 1726 H VAL A 610 6.658 -4.330 70.496 1.00 0.00 H ATOM 1727 N CYS A 611 5.129 -4.719 73.357 1.00 13.51 N ATOM 1728 CA CYS A 611 4.045 -4.729 74.336 1.00 12.24 C ATOM 1729 C CYS A 611 3.150 -5.960 74.176 1.00 14.96 C ATOM 1730 O CYS A 611 2.770 -6.596 75.170 1.00 15.22 O ATOM 1731 CB CYS A 611 3.213 -3.449 74.196 1.00 14.99 C ATOM 1732 SG CYS A 611 1.977 -3.166 75.512 1.00 17.41 S ATOM 1733 H CYS A 611 5.249 -3.897 72.731 1.00 0.00 H ATOM 1734 N MET A 612 2.751 -6.274 72.932 1.00 15.25 N ATOM 1735 CA MET A 612 1.929 -7.472 72.699 1.00 14.63 C ATOM 1736 C MET A 612 2.637 -8.733 73.180 1.00 13.95 C ATOM 1737 O MET A 612 2.012 -9.611 73.789 1.00 16.05 O ATOM 1738 CB MET A 612 1.587 -7.606 71.214 1.00 14.16 C ATOM 1739 CG MET A 612 0.551 -6.602 70.743 1.00 14.63 C ATOM 1740 SD MET A 612 -0.206 -7.091 69.170 1.00 18.25 S ATOM 1741 CE MET A 612 1.077 -6.673 67.973 1.00 18.26 C ATOM 1742 H MET A 612 3.024 -5.669 72.132 1.00 0.00 H ATOM 1743 N TRP A 613 3.942 -8.843 72.916 1.00 15.98 N ATOM 1744 CA TRP A 613 4.723 -9.973 73.417 1.00 13.93 C ATOM 1745 C TRP A 613 4.695 -10.028 74.941 1.00 14.46 C ATOM 1746 O TRP A 613 4.515 -11.106 75.524 1.00 15.09 O ATOM 1747 CB TRP A 613 6.153 -9.858 72.879 1.00 15.75 C ATOM 1748 CG TRP A 613 7.079 -10.975 73.225 1.00 13.99 C ATOM 1749 CD1 TRP A 613 7.347 -12.086 72.456 1.00 14.46 C ATOM 1750 CD2 TRP A 613 7.891 -11.110 74.411 1.00 17.56 C ATOM 1751 NE1 TRP A 613 8.251 -12.895 73.099 1.00 18.21 N ATOM 1752 CE2 TRP A 613 8.600 -12.325 74.293 1.00 18.14 C ATOM 1753 CE3 TRP A 613 8.073 -10.333 75.560 1.00 15.46 C ATOM 1754 CZ2 TRP A 613 9.492 -12.769 75.273 1.00 19.28 C ATOM 1755 CZ3 TRP A 613 8.949 -10.775 76.533 1.00 16.45 C ATOM 1756 CH2 TRP A 613 9.652 -11.980 76.378 1.00 18.16 C ATOM 1757 HE1 TRP A 613 8.614 -13.799 72.735 1.00 0.00 H ATOM 1758 H TRP A 613 4.411 -8.112 72.344 1.00 0.00 H ATOM 1759 N GLU A 614 4.817 -8.868 75.604 1.00 14.09 N ATOM 1760 CA GLU A 614 4.756 -8.838 77.063 1.00 14.09 C ATOM 1761 C GLU A 614 3.432 -9.380 77.566 1.00 15.19 C ATOM 1762 O GLU A 614 3.392 -10.105 78.565 1.00 16.62 O ATOM 1763 CB GLU A 614 4.937 -7.414 77.589 1.00 15.20 C ATOM 1764 CG GLU A 614 6.329 -6.836 77.462 1.00 17.90 C ATOM 1765 CD GLU A 614 6.397 -5.431 78.050 1.00 17.40 C ATOM 1766 OE1 GLU A 614 6.889 -5.268 79.192 1.00 19.02 O ATOM 1767 OE2 GLU A 614 5.963 -4.503 77.352 1.00 18.55 O ATOM 1768 H GLU A 614 4.956 -7.983 75.075 1.00 0.00 H ATOM 1769 N ILE A 615 2.329 -8.997 76.913 1.00 16.86 N ATOM 1770 CA ILE A 615 1.009 -9.444 77.352 1.00 18.20 C ATOM 1771 C ILE A 615 0.893 -10.956 77.229 1.00 16.47 C ATOM 1772 O ILE A 615 0.429 -11.642 78.154 1.00 16.60 O ATOM 1773 CB ILE A 615 -0.092 -8.738 76.544 1.00 14.56 C ATOM 1774 CG1 ILE A 615 -0.042 -7.228 76.812 1.00 15.34 C ATOM 1775 CG2 ILE A 615 -1.475 -9.323 76.896 1.00 17.58 C ATOM 1776 CD1 ILE A 615 -1.044 -6.439 75.994 1.00 17.95 C ATOM 1777 H ILE A 615 2.412 -8.374 76.084 1.00 0.00 H ATOM 1778 N LEU A 616 1.291 -11.496 76.076 1.00 15.89 N ATOM 1779 CA LEU A 616 1.176 -12.931 75.845 1.00 15.95 C ATOM 1780 C LEU A 616 2.186 -13.719 76.667 1.00 16.68 C ATOM 1781 O LEU A 616 2.020 -14.943 76.827 1.00 20.08 O ATOM 1782 CB LEU A 616 1.322 -13.220 74.347 1.00 17.35 C ATOM 1783 CG LEU A 616 0.040 -13.091 73.497 1.00 14.89 C ATOM 1784 CD1 LEU A 616 -0.915 -14.232 73.835 1.00 20.63 C ATOM 1785 CD2 LEU A 616 -0.678 -11.747 73.650 1.00 18.24 C ATOM 1786 H LEU A 616 1.688 -10.886 75.333 1.00 0.00 H ATOM 1787 N MET A 617 3.220 -13.055 77.194 1.00 16.05 N ATOM 1788 CA MET A 617 4.135 -13.632 78.170 1.00 19.56 C ATOM 1789 C MET A 617 3.690 -13.403 79.610 1.00 19.02 C ATOM 1790 O MET A 617 4.466 -13.678 80.528 1.00 20.74 O ATOM 1791 CB MET A 617 5.541 -13.056 77.995 1.00 20.93 C ATOM 1792 CG MET A 617 6.220 -13.454 76.712 1.00 19.23 C ATOM 1793 SD MET A 617 6.737 -15.180 76.774 1.00 22.79 S ATOM 1794 CE MET A 617 8.042 -15.153 78.013 1.00 22.19 C ATOM 1795 H MET A 617 3.380 -12.073 76.891 1.00 0.00 H ATOM 1796 N HIS A 618 2.474 -12.894 79.827 1.00 20.44 N ATOM 1797 CA HIS A 618 1.933 -12.663 81.177 1.00 18.37 C ATOM 1798 C HIS A 618 2.824 -11.729 82.000 1.00 21.01 C ATOM 1799 O HIS A 618 3.032 -11.930 83.201 1.00 22.40 O ATOM 1800 CB HIS A 618 1.693 -13.987 81.920 1.00 19.70 C ATOM 1801 CG HIS A 618 0.550 -14.784 81.365 1.00 37.17 C ATOM 1802 ND1 HIS A 618 0.722 -15.806 80.456 1.00 38.25 N ATOM 1803 CD2 HIS A 618 -0.785 -14.690 81.578 1.00 40.54 C ATOM 1804 CE1 HIS A 618 -0.456 -16.314 80.140 1.00 31.05 C ATOM 1805 NE2 HIS A 618 -1.389 -15.653 80.806 1.00 40.48 N ATOM 1806 H HIS A 618 1.883 -12.650 79.006 1.00 0.00 H ATOM 1807 N GLY A 619 3.342 -10.683 81.358 1.00 19.00 N ATOM 1808 CA GLY A 619 4.073 -9.647 82.069 1.00 20.29 C ATOM 1809 C GLY A 619 5.533 -9.916 82.345 1.00 23.27 C ATOM 1810 O GLY A 619 6.078 -9.360 83.308 1.00 28.47 O ATOM 1811 H GLY A 619 3.221 -10.606 80.328 1.00 0.00 H ATOM 1812 N VAL A 620 6.179 -10.748 81.550 1.00 20.76 N ATOM 1813 CA VAL A 620 7.627 -10.877 81.574 1.00 26.90 C ATOM 1814 C VAL A 620 8.222 -9.759 80.731 1.00 21.85 C ATOM 1815 O VAL A 620 7.684 -9.403 79.677 1.00 20.23 O ATOM 1816 CB VAL A 620 8.034 -12.265 81.051 1.00 23.69 C ATOM 1817 CG1 VAL A 620 9.538 -12.353 80.799 1.00 28.18 C ATOM 1818 CG2 VAL A 620 7.578 -13.357 82.039 1.00 26.20 C ATOM 1819 H VAL A 620 5.634 -11.331 80.884 1.00 0.00 H ATOM 1820 N LYS A 621 9.335 -9.201 81.185 1.00 22.92 N ATOM 1821 CA LYS A 621 9.965 -8.144 80.414 1.00 22.93 C ATOM 1822 C LYS A 621 10.760 -8.733 79.248 1.00 21.09 C ATOM 1823 O LYS A 621 11.211 -9.880 79.313 1.00 22.81 O ATOM 1824 CB LYS A 621 10.893 -7.313 81.306 1.00 23.47 C ATOM 1825 CG LYS A 621 10.164 -6.465 82.338 1.00 28.61 C ATOM 1826 CD LYS A 621 11.044 -5.345 82.855 1.00 39.12 C ATOM 1827 CE LYS A 621 11.534 -5.620 84.264 1.00 45.47 C ATOM 1828 NZ LYS A 621 12.319 -4.473 84.817 1.00 49.24 N ATOM 1829 HZ1 LYS A 621 13.147 -4.298 84.213 1.00 0.00 H ATOM 1830 HZ2 LYS A 621 11.719 -3.624 84.841 1.00 0.00 H ATOM 1831 HZ3 LYS A 621 12.634 -4.703 85.781 1.00 0.00 H ATOM 1832 H LYS A 621 9.753 -9.517 82.084 1.00 0.00 H ATOM 1833 N PRO A 622 10.936 -7.972 78.166 1.00 16.59 N ATOM 1834 CA PRO A 622 11.734 -8.463 77.039 1.00 18.74 C ATOM 1835 C PRO A 622 13.222 -8.404 77.357 1.00 20.46 C ATOM 1836 O PRO A 622 13.692 -7.543 78.103 1.00 21.60 O ATOM 1837 CB PRO A 622 11.373 -7.488 75.910 1.00 24.58 C ATOM 1838 CG PRO A 622 11.061 -6.220 76.621 1.00 19.56 C ATOM 1839 CD PRO A 622 10.322 -6.667 77.870 1.00 17.89 C ATOM 1840 N PHE A 623 13.963 -9.358 76.788 1.00 21.70 N ATOM 1841 CA PHE A 623 15.432 -9.355 76.819 1.00 25.53 C ATOM 1842 C PHE A 623 15.975 -9.371 78.247 1.00 28.30 C ATOM 1843 O PHE A 623 16.954 -8.690 78.573 1.00 24.64 O ATOM 1844 CB PHE A 623 15.993 -8.167 76.032 1.00 24.39 C ATOM 1845 CG PHE A 623 15.645 -8.197 74.567 1.00 28.21 C ATOM 1846 CD1 PHE A 623 16.057 -9.247 73.764 1.00 39.38 C ATOM 1847 CD2 PHE A 623 14.890 -7.191 74.004 1.00 23.64 C ATOM 1848 CE1 PHE A 623 15.734 -9.277 72.421 1.00 41.26 C ATOM 1849 CE2 PHE A 623 14.567 -7.216 72.665 1.00 27.59 C ATOM 1850 CZ PHE A 623 14.985 -8.256 71.873 1.00 33.72 C ATOM 1851 H PHE A 623 13.478 -10.139 76.301 1.00 0.00 H ATOM 1852 N GLN A 624 15.343 -10.167 79.107 1.00 30.34 N ATOM 1853 CA GLN A 624 15.843 -10.325 80.464 1.00 29.60 C ATOM 1854 C GLN A 624 17.288 -10.816 80.436 1.00 34.50 C ATOM 1855 O GLN A 624 17.659 -11.662 79.614 1.00 34.56 O ATOM 1856 CB GLN A 624 14.950 -11.300 81.241 1.00 36.18 C ATOM 1857 CG GLN A 624 14.975 -11.102 82.754 1.00 48.27 C ATOM 1858 CD GLN A 624 14.011 -10.028 83.230 1.00 47.79 C ATOM 1859 OE1 GLN A 624 13.937 -8.935 82.660 1.00 51.58 O ATOM 1860 NE2 GLN A 624 13.269 -10.335 84.284 1.00 51.78 N ATOM 1861 HE22 GLN A 624 13.364 -11.268 84.733 1.00 0.00 H ATOM 1862 HE21 GLN A 624 12.591 -9.643 84.662 1.00 0.00 H ATOM 1863 H GLN A 624 14.488 -10.678 78.807 1.00 0.00 H ATOM 1864 N GLY A 625 18.111 -10.252 81.319 1.00 33.90 N ATOM 1865 CA GLY A 625 19.502 -10.643 81.430 1.00 37.23 C ATOM 1866 C GLY A 625 20.410 -10.170 80.314 1.00 37.61 C ATOM 1867 O GLY A 625 21.593 -10.526 80.309 1.00 43.23 O ATOM 1868 H GLY A 625 17.744 -9.509 81.947 1.00 0.00 H ATOM 1869 N VAL A 626 19.901 -9.388 79.368 1.00 33.00 N ATOM 1870 CA VAL A 626 20.691 -8.839 78.271 1.00 29.51 C ATOM 1871 C VAL A 626 21.004 -7.384 78.589 1.00 36.70 C ATOM 1872 O VAL A 626 20.151 -6.654 79.104 1.00 32.40 O ATOM 1873 CB VAL A 626 19.928 -8.970 76.937 1.00 35.05 C ATOM 1874 CG1 VAL A 626 20.743 -8.419 75.771 1.00 26.02 C ATOM 1875 CG2 VAL A 626 19.548 -10.417 76.683 1.00 38.68 C ATOM 1876 H VAL A 626 18.888 -9.155 79.412 1.00 0.00 H ATOM 1877 N LYS A 627 22.236 -6.966 78.312 1.00 30.47 N ATOM 1878 CA LYS A 627 22.604 -5.565 78.467 1.00 32.01 C ATOM 1879 C LYS A 627 21.957 -4.721 77.382 1.00 29.97 C ATOM 1880 O LYS A 627 21.912 -5.119 76.216 1.00 26.39 O ATOM 1881 CB LYS A 627 24.123 -5.402 78.392 1.00 35.09 C ATOM 1882 CG LYS A 627 24.891 -6.268 79.350 1.00 36.05 C ATOM 1883 CD LYS A 627 26.243 -5.654 79.688 1.00 41.58 C ATOM 1884 CE LYS A 627 26.470 -5.647 81.196 1.00 49.23 C ATOM 1885 NZ LYS A 627 27.481 -4.633 81.608 1.00 58.15 N ATOM 1886 HZ1 LYS A 627 28.388 -4.842 81.145 1.00 0.00 H ATOM 1887 HZ2 LYS A 627 27.156 -3.686 81.325 1.00 0.00 H ATOM 1888 HZ3 LYS A 627 27.602 -4.665 82.640 1.00 0.00 H ATOM 1889 H LYS A 627 22.947 -7.649 77.980 1.00 0.00 H ATOM 1890 N ASN A 628 21.470 -3.539 77.776 1.00 29.33 N ATOM 1891 CA ASN A 628 20.888 -2.597 76.822 1.00 22.88 C ATOM 1892 C ASN A 628 21.778 -2.421 75.594 1.00 22.77 C ATOM 1893 O ASN A 628 21.298 -2.453 74.456 1.00 24.50 O ATOM 1894 CB ASN A 628 20.655 -1.242 77.498 1.00 30.64 C ATOM 1895 CG ASN A 628 19.360 -1.193 78.295 1.00 34.04 C ATOM 1896 OD1 ASN A 628 18.530 -2.106 78.234 1.00 29.53 O ATOM 1897 ND2 ASN A 628 19.179 -0.112 79.042 1.00 36.64 N ATOM 1898 HD22 ASN A 628 19.905 0.633 79.064 1.00 0.00 H ATOM 1899 HD21 ASN A 628 18.311 -0.009 79.606 1.00 0.00 H ATOM 1900 H ASN A 628 21.506 -3.285 78.784 1.00 0.00 H ATOM 1901 N ASN A 629 23.084 -2.236 75.808 1.00 33.68 N ATOM 1902 CA ASN A 629 23.994 -1.942 74.700 1.00 24.70 C ATOM 1903 C ASN A 629 24.086 -3.074 73.685 1.00 39.20 C ATOM 1904 O ASN A 629 24.554 -2.844 72.559 1.00 28.62 O ATOM 1905 CB ASN A 629 25.395 -1.654 75.226 1.00 30.63 C ATOM 1906 CG ASN A 629 25.494 -0.304 75.881 1.00 40.96 C ATOM 1907 OD1 ASN A 629 24.584 0.519 75.765 1.00 45.32 O ATOM 1908 ND2 ASN A 629 26.612 -0.054 76.559 1.00 39.16 N ATOM 1909 HD22 ASN A 629 27.352 -0.782 76.628 1.00 0.00 H ATOM 1910 HD21 ASN A 629 26.746 0.869 77.019 1.00 0.00 H ATOM 1911 H ASN A 629 23.459 -2.302 76.776 1.00 0.00 H ATOM 1912 N ASP A 630 23.678 -4.284 74.063 1.00 36.06 N ATOM 1913 CA ASP A 630 23.769 -5.449 73.194 1.00 33.16 C ATOM 1914 C ASP A 630 22.507 -5.676 72.379 1.00 30.27 C ATOM 1915 O ASP A 630 22.510 -6.532 71.493 1.00 24.34 O ATOM 1916 CB ASP A 630 24.060 -6.706 74.021 1.00 28.84 C ATOM 1917 CG ASP A 630 25.488 -6.748 74.555 1.00 33.69 C ATOM 1918 OD1 ASP A 630 26.352 -6.007 74.044 1.00 39.44 O ATOM 1919 OD2 ASP A 630 25.741 -7.527 75.498 1.00 37.02 O ATOM 1920 H ASP A 630 23.279 -4.402 75.016 1.00 0.00 H ATOM 1921 N VAL A 631 21.440 -4.928 72.651 1.00 23.01 N ATOM 1922 CA VAL A 631 20.151 -5.191 72.016 1.00 26.82 C ATOM 1923 C VAL A 631 20.207 -4.891 70.521 1.00 23.93 C ATOM 1924 O VAL A 631 19.728 -5.679 69.693 1.00 18.40 O ATOM 1925 CB VAL A 631 19.042 -4.386 72.721 1.00 23.67 C ATOM 1926 CG1 VAL A 631 17.752 -4.436 71.919 1.00 24.77 C ATOM 1927 CG2 VAL A 631 18.811 -4.924 74.138 1.00 22.53 C ATOM 1928 H VAL A 631 21.526 -4.143 73.327 1.00 0.00 H ATOM 1929 N ILE A 632 20.797 -3.753 70.138 1.00 21.36 N ATOM 1930 CA ILE A 632 20.738 -3.387 68.728 1.00 20.64 C ATOM 1931 C ILE A 632 21.523 -4.393 67.882 1.00 20.53 C ATOM 1932 O ILE A 632 21.090 -4.752 66.780 1.00 18.15 O ATOM 1933 CB ILE A 632 21.188 -1.923 68.511 1.00 20.52 C ATOM 1934 CG1 ILE A 632 20.955 -1.495 67.063 1.00 19.03 C ATOM 1935 CG2 ILE A 632 22.644 -1.721 68.834 1.00 21.41 C ATOM 1936 CD1 ILE A 632 19.517 -1.451 66.639 1.00 18.07 C ATOM 1937 H ILE A 632 21.285 -3.146 70.827 1.00 0.00 H ATOM 1938 N GLY A 633 22.630 -4.923 68.407 1.00 20.01 N ATOM 1939 CA GLY A 633 23.382 -5.922 67.660 1.00 21.18 C ATOM 1940 C GLY A 633 22.588 -7.193 67.407 1.00 20.75 C ATOM 1941 O GLY A 633 22.687 -7.795 66.332 1.00 24.62 O ATOM 1942 H GLY A 633 22.955 -4.623 69.348 1.00 0.00 H ATOM 1943 N ARG A 634 21.808 -7.630 68.396 1.00 22.65 N ATOM 1944 CA ARG A 634 20.948 -8.793 68.196 1.00 22.70 C ATOM 1945 C ARG A 634 19.876 -8.506 67.149 1.00 20.20 C ATOM 1946 O ARG A 634 19.610 -9.347 66.286 1.00 26.05 O ATOM 1947 CB ARG A 634 20.303 -9.210 69.519 1.00 29.15 C ATOM 1948 CG ARG A 634 21.240 -9.220 70.709 1.00 42.45 C ATOM 1949 CD ARG A 634 21.913 -10.559 70.880 1.00 43.11 C ATOM 1950 NE ARG A 634 23.136 -10.450 71.674 1.00 50.65 N ATOM 1951 CZ ARG A 634 23.247 -10.858 72.935 1.00 47.83 C ATOM 1952 NH1 ARG A 634 22.202 -11.407 73.550 1.00 50.88 N ATOM 1953 NH2 ARG A 634 24.400 -10.716 73.581 1.00 47.61 N ATOM 1954 HE ARG A 634 23.972 -10.026 71.224 1.00 0.00 H ATOM 1955 HH12 ARG A 634 22.288 -11.726 74.536 1.00 0.00 H ATOM 1956 HH11 ARG A 634 21.300 -11.517 73.045 1.00 0.00 H ATOM 1957 HH22 ARG A 634 24.486 -11.035 74.567 1.00 0.00 H ATOM 1958 HH21 ARG A 634 25.216 -10.286 73.100 1.00 0.00 H ATOM 1959 H ARG A 634 21.812 -7.141 69.314 1.00 0.00 H ATOM 1960 N ILE A 635 19.246 -7.324 67.204 1.00 19.83 N ATOM 1961 CA ILE A 635 18.239 -6.973 66.202 1.00 17.67 C ATOM 1962 C ILE A 635 18.860 -7.006 64.812 1.00 21.42 C ATOM 1963 O ILE A 635 18.274 -7.512 63.848 1.00 20.02 O ATOM 1964 CB ILE A 635 17.646 -5.582 66.502 1.00 21.25 C ATOM 1965 CG1 ILE A 635 16.817 -5.599 67.779 1.00 20.48 C ATOM 1966 CG2 ILE A 635 16.844 -5.078 65.323 1.00 19.83 C ATOM 1967 CD1 ILE A 635 16.313 -4.207 68.179 1.00 23.97 C ATOM 1968 H ILE A 635 19.475 -6.652 67.964 1.00 0.00 H ATOM 1969 N GLU A 636 20.046 -6.428 64.684 1.00 18.92 N ATOM 1970 CA GLU A 636 20.648 -6.341 63.366 1.00 19.88 C ATOM 1971 C GLU A 636 21.145 -7.690 62.876 1.00 19.96 C ATOM 1972 O GLU A 636 21.283 -7.875 61.664 1.00 24.80 O ATOM 1973 CB GLU A 636 21.723 -5.258 63.402 1.00 25.02 C ATOM 1974 CG GLU A 636 21.018 -3.923 63.682 1.00 32.55 C ATOM 1975 CD GLU A 636 21.888 -2.693 63.648 1.00 36.70 C ATOM 1976 OE1 GLU A 636 23.082 -2.773 64.005 1.00 38.77 O ATOM 1977 OE2 GLU A 636 21.339 -1.620 63.290 1.00 37.51 O ATOM 1978 H GLU A 636 20.538 -6.043 65.515 1.00 0.00 H ATOM 1979 N ASN A 637 21.345 -8.656 63.781 1.00 17.95 N ATOM 1980 CA ASN A 637 21.625 -10.031 63.395 1.00 20.98 C ATOM 1981 C ASN A 637 20.398 -10.767 62.883 1.00 20.63 C ATOM 1982 O ASN A 637 20.529 -11.917 62.457 1.00 19.27 O ATOM 1983 CB ASN A 637 22.167 -10.823 64.590 1.00 20.22 C ATOM 1984 CG ASN A 637 23.620 -10.524 64.901 1.00 26.08 C ATOM 1985 OD1 ASN A 637 24.309 -9.802 64.169 1.00 26.27 O ATOM 1986 ND2 ASN A 637 24.100 -11.094 65.998 1.00 42.86 N ATOM 1987 HD22 ASN A 637 23.485 -11.694 66.584 1.00 0.00 H ATOM 1988 HD21 ASN A 637 25.092 -10.941 66.272 1.00 0.00 H ATOM 1989 H ASN A 637 21.299 -8.416 64.792 1.00 0.00 H ATOM 1990 N GLY A 638 19.219 -10.161 62.961 1.00 16.93 N ATOM 1991 CA GLY A 638 17.978 -10.799 62.578 1.00 19.27 C ATOM 1992 C GLY A 638 17.251 -11.479 63.714 1.00 17.38 C ATOM 1993 O GLY A 638 16.177 -12.045 63.489 1.00 17.06 O ATOM 1994 H GLY A 638 19.186 -9.183 63.313 1.00 0.00 H ATOM 1995 N GLU A 639 17.809 -11.446 64.919 1.00 16.43 N ATOM 1996 CA GLU A 639 17.191 -12.093 66.066 1.00 16.43 C ATOM 1997 C GLU A 639 15.975 -11.316 66.546 1.00 17.64 C ATOM 1998 O GLU A 639 15.917 -10.095 66.449 1.00 16.41 O ATOM 1999 CB GLU A 639 18.192 -12.215 67.204 1.00 17.21 C ATOM 2000 CG GLU A 639 19.424 -13.008 66.795 1.00 20.46 C ATOM 2001 CD GLU A 639 20.423 -13.142 67.916 1.00 33.02 C ATOM 2002 OE1 GLU A 639 21.623 -12.905 67.670 1.00 39.85 O ATOM 2003 OE2 GLU A 639 20.010 -13.485 69.041 1.00 36.60 O ATOM 2004 H GLU A 639 18.711 -10.945 65.046 1.00 0.00 H ATOM 2005 N ARG A 640 15.001 -12.053 67.086 1.00 18.17 N ATOM 2006 CA ARG A 640 13.749 -11.470 67.541 1.00 14.94 C ATOM 2007 C ARG A 640 13.286 -12.184 68.807 1.00 15.39 C ATOM 2008 O ARG A 640 13.695 -13.309 69.092 1.00 19.43 O ATOM 2009 CB ARG A 640 12.666 -11.560 66.444 1.00 16.89 C ATOM 2010 CG ARG A 640 12.962 -10.783 65.130 1.00 19.13 C ATOM 2011 CD ARG A 640 12.986 -9.266 65.360 1.00 16.73 C ATOM 2012 NE ARG A 640 13.085 -8.449 64.144 1.00 16.47 N ATOM 2013 CZ ARG A 640 14.238 -8.057 63.603 1.00 18.34 C ATOM 2014 NH1 ARG A 640 15.391 -8.408 64.163 1.00 16.55 N ATOM 2015 NH2 ARG A 640 14.246 -7.291 62.518 1.00 18.55 N ATOM 2016 HE ARG A 640 12.202 -8.159 63.677 1.00 0.00 H ATOM 2017 HH12 ARG A 640 16.290 -8.101 63.739 1.00 0.00 H ATOM 2018 HH11 ARG A 640 15.395 -8.990 65.025 1.00 0.00 H ATOM 2019 HH22 ARG A 640 15.150 -6.989 62.101 1.00 0.00 H ATOM 2020 HH21 ARG A 640 13.349 -6.993 62.085 1.00 0.00 H ATOM 2021 H ARG A 640 15.143 -13.079 67.184 1.00 0.00 H ATOM 2022 N LEU A 641 12.435 -11.501 69.582 1.00 16.92 N ATOM 2023 CA LEU A 641 11.792 -12.158 70.712 1.00 16.70 C ATOM 2024 C LEU A 641 11.022 -13.376 70.203 1.00 15.88 C ATOM 2025 O LEU A 641 10.366 -13.301 69.153 1.00 17.74 O ATOM 2026 CB LEU A 641 10.845 -11.185 71.425 1.00 17.52 C ATOM 2027 CG LEU A 641 11.490 -9.958 72.096 1.00 16.99 C ATOM 2028 CD1 LEU A 641 10.470 -8.838 72.347 1.00 16.47 C ATOM 2029 CD2 LEU A 641 12.206 -10.327 73.407 1.00 18.45 C ATOM 2030 H LEU A 641 12.233 -10.502 69.378 1.00 0.00 H ATOM 2031 N PRO A 642 11.117 -14.522 70.878 1.00 19.87 N ATOM 2032 CA PRO A 642 10.507 -15.749 70.358 1.00 18.19 C ATOM 2033 C PRO A 642 9.011 -15.828 70.636 1.00 20.17 C ATOM 2034 O PRO A 642 8.445 -15.071 71.424 1.00 19.49 O ATOM 2035 CB PRO A 642 11.258 -16.851 71.116 1.00 26.01 C ATOM 2036 CG PRO A 642 11.511 -16.234 72.441 1.00 22.91 C ATOM 2037 CD PRO A 642 11.845 -14.772 72.134 1.00 23.49 C ATOM 2038 N MET A 643 8.377 -16.806 69.993 1.00 19.00 N ATOM 2039 CA MET A 643 6.943 -17.005 70.167 1.00 21.12 C ATOM 2040 C MET A 643 6.619 -17.387 71.607 1.00 21.41 C ATOM 2041 O MET A 643 7.128 -18.408 72.098 1.00 20.05 O ATOM 2042 CB MET A 643 6.417 -18.090 69.233 1.00 21.79 C ATOM 2043 CG MET A 643 4.900 -18.211 69.269 1.00 20.66 C ATOM 2044 SD MET A 643 4.207 -19.093 67.854 1.00 28.02 S ATOM 2045 CE MET A 643 5.126 -20.615 67.957 1.00 41.59 C ATOM 2046 H MET A 643 8.910 -17.435 69.359 1.00 0.00 H ATOM 2047 N PRO A 644 5.763 -16.632 72.296 1.00 20.13 N ATOM 2048 CA PRO A 644 5.400 -17.001 73.660 1.00 24.83 C ATOM 2049 C PRO A 644 4.657 -18.320 73.685 1.00 28.28 C ATOM 2050 O PRO A 644 3.898 -18.645 72.750 1.00 24.39 O ATOM 2051 CB PRO A 644 4.497 -15.843 74.110 1.00 23.20 C ATOM 2052 CG PRO A 644 4.917 -14.689 73.232 1.00 20.33 C ATOM 2053 CD PRO A 644 5.187 -15.335 71.903 1.00 21.13 C ATOM 2054 N PRO A 645 4.839 -19.111 74.741 1.00 26.41 N ATOM 2055 CA PRO A 645 4.090 -20.361 74.870 1.00 29.17 C ATOM 2056 C PRO A 645 2.600 -20.102 74.764 1.00 28.00 C ATOM 2057 O PRO A 645 2.086 -19.123 75.306 1.00 27.95 O ATOM 2058 CB PRO A 645 4.478 -20.862 76.262 1.00 28.82 C ATOM 2059 CG PRO A 645 5.826 -20.275 76.513 1.00 33.85 C ATOM 2060 CD PRO A 645 5.826 -18.937 75.821 1.00 26.98 C ATOM 2061 N ASN A 646 1.917 -20.965 74.013 1.00 28.78 N ATOM 2062 CA ASN A 646 0.472 -20.934 73.806 1.00 34.23 C ATOM 2063 C ASN A 646 0.000 -19.722 73.016 1.00 34.10 C ATOM 2064 O ASN A 646 -1.209 -19.492 72.917 1.00 33.65 O ATOM 2065 CB ASN A 646 -0.283 -21.014 75.138 1.00 28.98 C ATOM 2066 CG ASN A 646 0.090 -22.246 75.929 1.00 46.48 C ATOM 2067 OD1 ASN A 646 -0.195 -23.370 75.513 1.00 50.92 O ATOM 2068 ND2 ASN A 646 0.751 -22.046 77.066 1.00 45.04 N ATOM 2069 HD22 ASN A 646 0.969 -21.078 77.377 1.00 0.00 H ATOM 2070 HD21 ASN A 646 1.049 -22.858 77.644 1.00 0.00 H ATOM 2071 H ASN A 646 2.454 -21.718 73.538 1.00 0.00 H ATOM 2072 N CYS A 647 0.910 -18.946 72.438 1.00 27.26 N ATOM 2073 CA CYS A 647 0.492 -17.828 71.600 1.00 27.43 C ATOM 2074 C CYS A 647 0.067 -18.352 70.232 1.00 34.93 C ATOM 2075 O CYS A 647 0.800 -19.140 69.630 1.00 27.98 O ATOM 2076 CB CYS A 647 1.634 -16.831 71.440 1.00 21.23 C ATOM 2077 SG CYS A 647 1.270 -15.389 70.401 1.00 24.30 S ATOM 2078 H CYS A 647 1.922 -19.136 72.583 1.00 0.00 H ATOM 2079 N PRO A 648 -1.093 -17.955 69.718 1.00 22.07 N ATOM 2080 CA PRO A 648 -1.481 -18.377 68.366 1.00 22.42 C ATOM 2081 C PRO A 648 -0.445 -17.937 67.349 1.00 24.81 C ATOM 2082 O PRO A 648 0.057 -16.804 67.413 1.00 21.48 O ATOM 2083 CB PRO A 648 -2.824 -17.667 68.139 1.00 25.71 C ATOM 2084 CG PRO A 648 -3.346 -17.394 69.522 1.00 25.51 C ATOM 2085 CD PRO A 648 -2.138 -17.152 70.379 1.00 21.64 C ATOM 2086 N PRO A 649 -0.066 -18.807 66.411 1.00 23.38 N ATOM 2087 CA PRO A 649 0.949 -18.387 65.432 1.00 20.84 C ATOM 2088 C PRO A 649 0.526 -17.189 64.598 1.00 19.31 C ATOM 2089 O PRO A 649 1.389 -16.384 64.225 1.00 22.22 O ATOM 2090 CB PRO A 649 1.151 -19.650 64.581 1.00 22.88 C ATOM 2091 CG PRO A 649 0.854 -20.765 65.514 1.00 29.52 C ATOM 2092 CD PRO A 649 -0.296 -20.266 66.366 1.00 24.29 C ATOM 2093 N THR A 650 -0.777 -17.007 64.325 1.00 21.92 N ATOM 2094 CA THR A 650 -1.191 -15.816 63.582 1.00 22.75 C ATOM 2095 C THR A 650 -0.876 -14.551 64.362 1.00 20.22 C ATOM 2096 O THR A 650 -0.536 -13.515 63.770 1.00 21.07 O ATOM 2097 CB THR A 650 -2.688 -15.835 63.273 1.00 27.31 C ATOM 2098 OG1 THR A 650 -3.424 -16.003 64.489 1.00 25.52 O ATOM 2099 CG2 THR A 650 -3.036 -16.952 62.314 1.00 32.83 C ATOM 2100 HG1 THR A 650 -4.393 -16.015 64.288 1.00 0.00 H ATOM 2101 H THR A 650 -1.483 -17.704 64.638 1.00 0.00 H ATOM 2102 N LEU A 651 -0.988 -14.613 65.687 1.00 20.71 N ATOM 2103 CA LEU A 651 -0.731 -13.435 66.505 1.00 21.65 C ATOM 2104 C LEU A 651 0.761 -13.185 66.635 1.00 18.55 C ATOM 2105 O LEU A 651 1.210 -12.036 66.570 1.00 19.70 O ATOM 2106 CB LEU A 651 -1.382 -13.604 67.884 1.00 18.63 C ATOM 2107 CG LEU A 651 -1.134 -12.477 68.898 1.00 17.23 C ATOM 2108 CD1 LEU A 651 -1.679 -11.137 68.414 1.00 20.07 C ATOM 2109 CD2 LEU A 651 -1.759 -12.810 70.229 1.00 22.80 C ATOM 2110 H LEU A 651 -1.261 -15.508 66.141 1.00 0.00 H ATOM 2111 N TYR A 652 1.555 -14.251 66.769 1.00 17.41 N ATOM 2112 CA TYR A 652 2.996 -14.044 66.784 1.00 17.68 C ATOM 2113 C TYR A 652 3.478 -13.505 65.446 1.00 20.01 C ATOM 2114 O TYR A 652 4.327 -12.606 65.401 1.00 18.85 O ATOM 2115 CB TYR A 652 3.737 -15.336 67.135 1.00 18.52 C ATOM 2116 CG TYR A 652 5.244 -15.135 67.155 1.00 18.89 C ATOM 2117 CD1 TYR A 652 5.836 -14.263 68.069 1.00 19.14 C ATOM 2118 CD2 TYR A 652 6.081 -15.806 66.253 1.00 19.47 C ATOM 2119 CE1 TYR A 652 7.207 -14.052 68.074 1.00 17.12 C ATOM 2120 CE2 TYR A 652 7.474 -15.608 66.265 1.00 17.09 C ATOM 2121 CZ TYR A 652 8.026 -14.734 67.175 1.00 18.03 C ATOM 2122 OH TYR A 652 9.390 -14.536 67.177 1.00 19.28 O ATOM 2123 HH TYR A 652 9.627 -13.885 67.884 1.00 0.00 H ATOM 2124 H TYR A 652 1.153 -15.206 66.860 1.00 0.00 H ATOM 2125 N SER A 653 2.953 -14.041 64.342 1.00 18.62 N ATOM 2126 CA SER A 653 3.283 -13.489 63.029 1.00 18.67 C ATOM 2127 C SER A 653 2.983 -11.993 62.961 1.00 15.49 C ATOM 2128 O SER A 653 3.776 -11.216 62.417 1.00 18.70 O ATOM 2129 CB SER A 653 2.509 -14.238 61.945 1.00 31.86 C ATOM 2130 OG SER A 653 2.904 -13.811 60.650 1.00 33.18 O ATOM 2131 HG SER A 653 2.389 -14.310 59.968 1.00 0.00 H ATOM 2132 H SER A 653 2.308 -14.853 64.416 1.00 0.00 H ATOM 2133 N LEU A 654 1.853 -11.560 63.519 1.00 17.97 N ATOM 2134 CA LEU A 654 1.572 -10.130 63.563 1.00 16.32 C ATOM 2135 C LEU A 654 2.642 -9.374 64.347 1.00 15.41 C ATOM 2136 O LEU A 654 3.087 -8.290 63.924 1.00 17.30 O ATOM 2137 CB LEU A 654 0.187 -9.898 64.160 1.00 17.84 C ATOM 2138 CG LEU A 654 -0.360 -8.496 63.947 1.00 20.04 C ATOM 2139 CD1 LEU A 654 -0.433 -8.206 62.463 1.00 19.05 C ATOM 2140 CD2 LEU A 654 -1.735 -8.364 64.584 1.00 23.02 C ATOM 2141 H LEU A 654 1.175 -12.239 63.921 1.00 0.00 H ATOM 2142 N MET A 655 3.071 -9.916 65.493 1.00 16.02 N ATOM 2143 CA MET A 655 4.169 -9.280 66.228 1.00 15.92 C ATOM 2144 C MET A 655 5.403 -9.130 65.348 1.00 16.69 C ATOM 2145 O MET A 655 6.037 -8.061 65.319 1.00 16.11 O ATOM 2146 CB MET A 655 4.512 -10.081 67.483 1.00 17.60 C ATOM 2147 CG MET A 655 3.409 -10.178 68.532 1.00 17.60 C ATOM 2148 SD MET A 655 4.035 -11.259 69.848 1.00 19.52 S ATOM 2149 CE MET A 655 2.531 -11.694 70.728 1.00 22.86 C ATOM 2150 H MET A 655 2.628 -10.783 65.860 1.00 0.00 H ATOM 2151 N THR A 656 5.763 -10.190 64.609 1.00 13.93 N ATOM 2152 CA THR A 656 6.994 -10.108 63.833 1.00 16.24 C ATOM 2153 C THR A 656 6.875 -9.082 62.706 1.00 16.18 C ATOM 2154 O THR A 656 7.889 -8.521 62.274 1.00 17.47 O ATOM 2155 CB THR A 656 7.392 -11.487 63.289 1.00 14.55 C ATOM 2156 OG1 THR A 656 6.433 -11.940 62.328 1.00 17.04 O ATOM 2157 CG2 THR A 656 7.526 -12.483 64.427 1.00 16.72 C ATOM 2158 HG1 THR A 656 6.391 -11.296 61.577 1.00 0.00 H ATOM 2159 H THR A 656 5.178 -11.050 64.590 1.00 0.00 H ATOM 2160 N LYS A 657 5.651 -8.793 62.245 1.00 15.97 N ATOM 2161 CA LYS A 657 5.495 -7.741 61.243 1.00 17.05 C ATOM 2162 C LYS A 657 5.756 -6.363 61.838 1.00 15.93 C ATOM 2163 O LYS A 657 6.230 -5.463 61.132 1.00 15.41 O ATOM 2164 CB LYS A 657 4.100 -7.779 60.617 1.00 18.68 C ATOM 2165 CG LYS A 657 3.714 -9.109 59.995 1.00 24.85 C ATOM 2166 CD LYS A 657 4.357 -9.311 58.649 1.00 33.31 C ATOM 2167 CE LYS A 657 3.912 -10.653 58.054 1.00 38.56 C ATOM 2168 NZ LYS A 657 2.459 -10.920 58.260 1.00 45.79 N ATOM 2169 HZ1 LYS A 657 2.252 -10.938 59.279 1.00 0.00 H ATOM 2170 HZ2 LYS A 657 1.902 -10.169 57.805 1.00 0.00 H ATOM 2171 HZ3 LYS A 657 2.213 -11.839 57.839 1.00 0.00 H ATOM 2172 H LYS A 657 4.821 -9.312 62.596 1.00 0.00 H ATOM 2173 N CYS A 658 5.451 -6.181 63.125 1.00 14.88 N ATOM 2174 CA CYS A 658 5.788 -4.926 63.793 1.00 13.25 C ATOM 2175 C CYS A 658 7.297 -4.734 63.903 1.00 14.64 C ATOM 2176 O CYS A 658 7.771 -3.600 64.025 1.00 14.87 O ATOM 2177 CB CYS A 658 5.162 -4.903 65.197 1.00 15.85 C ATOM 2178 SG CYS A 658 3.362 -4.977 65.273 1.00 15.81 S ATOM 2179 H CYS A 658 4.971 -6.936 63.655 1.00 0.00 H ATOM 2180 N TRP A 659 8.065 -5.820 63.836 1.00 16.78 N ATOM 2181 CA TRP A 659 9.508 -5.773 63.990 1.00 15.52 C ATOM 2182 C TRP A 659 10.235 -5.892 62.654 1.00 14.67 C ATOM 2183 O TRP A 659 11.392 -6.316 62.618 1.00 16.16 O ATOM 2184 CB TRP A 659 9.997 -6.851 64.958 1.00 15.87 C ATOM 2185 CG TRP A 659 9.318 -6.848 66.324 1.00 15.23 C ATOM 2186 CD1 TRP A 659 8.923 -5.756 67.050 1.00 13.71 C ATOM 2187 CD2 TRP A 659 8.954 -7.998 67.097 1.00 14.96 C ATOM 2188 NE1 TRP A 659 8.319 -6.164 68.232 1.00 13.74 N ATOM 2189 CE2 TRP A 659 8.334 -7.534 68.284 1.00 15.12 C ATOM 2190 CE3 TRP A 659 9.073 -9.377 66.895 1.00 14.85 C ATOM 2191 CZ2 TRP A 659 7.857 -8.403 69.280 1.00 14.76 C ATOM 2192 CZ3 TRP A 659 8.598 -10.243 67.885 1.00 15.81 C ATOM 2193 CH2 TRP A 659 7.984 -9.746 69.062 1.00 15.85 C ATOM 2194 HE1 TRP A 659 7.921 -5.534 68.958 1.00 0.00 H ATOM 2195 H TRP A 659 7.612 -6.741 63.666 1.00 0.00 H ATOM 2196 N ALA A 660 9.596 -5.505 61.552 1.00 13.89 N ATOM 2197 CA ALA A 660 10.343 -5.326 60.320 1.00 15.06 C ATOM 2198 C ALA A 660 11.418 -4.263 60.529 1.00 15.85 C ATOM 2199 O ALA A 660 11.162 -3.215 61.140 1.00 17.24 O ATOM 2200 CB ALA A 660 9.398 -4.940 59.183 1.00 19.15 C ATOM 2201 H ALA A 660 8.571 -5.332 61.573 1.00 0.00 H ATOM 2202 N TYR A 661 12.642 -4.555 60.074 1.00 16.15 N ATOM 2203 CA TYR A 661 13.741 -3.622 60.305 1.00 18.23 C ATOM 2204 C TYR A 661 13.464 -2.291 59.625 1.00 19.26 C ATOM 2205 O TYR A 661 13.665 -1.222 60.219 1.00 18.95 O ATOM 2206 CB TYR A 661 15.068 -4.220 59.808 1.00 16.94 C ATOM 2207 CG TYR A 661 16.271 -3.381 60.176 1.00 18.25 C ATOM 2208 CD1 TYR A 661 16.897 -3.538 61.415 1.00 20.02 C ATOM 2209 CD2 TYR A 661 16.762 -2.403 59.308 1.00 18.08 C ATOM 2210 CE1 TYR A 661 17.991 -2.757 61.766 1.00 22.30 C ATOM 2211 CE2 TYR A 661 17.858 -1.612 59.658 1.00 22.29 C ATOM 2212 CZ TYR A 661 18.461 -1.794 60.888 1.00 23.99 C ATOM 2213 OH TYR A 661 19.552 -1.013 61.239 1.00 25.84 O ATOM 2214 HH TYR A 661 19.862 -1.268 62.144 1.00 0.00 H ATOM 2215 H TYR A 661 12.810 -5.442 59.558 1.00 0.00 H ATOM 2216 N ASP A 662 12.963 -2.335 58.396 1.00 17.45 N ATOM 2217 CA ASP A 662 12.623 -1.121 57.658 1.00 19.92 C ATOM 2218 C ASP A 662 11.275 -0.600 58.148 1.00 20.66 C ATOM 2219 O ASP A 662 10.268 -1.308 58.017 1.00 18.56 O ATOM 2220 CB ASP A 662 12.576 -1.439 56.165 1.00 20.21 C ATOM 2221 CG ASP A 662 12.205 -0.248 55.295 1.00 28.18 C ATOM 2222 OD1 ASP A 662 11.829 0.831 55.799 1.00 24.79 O ATOM 2223 OD2 ASP A 662 12.270 -0.411 54.063 1.00 29.56 O ATOM 2224 H ASP A 662 12.808 -3.260 57.946 1.00 0.00 H ATOM 2225 N PRO A 663 11.203 0.609 58.717 1.00 17.61 N ATOM 2226 CA PRO A 663 9.921 1.055 59.285 1.00 19.51 C ATOM 2227 C PRO A 663 8.814 1.175 58.257 1.00 17.16 C ATOM 2228 O PRO A 663 7.635 1.066 58.617 1.00 18.84 O ATOM 2229 CB PRO A 663 10.245 2.426 59.909 1.00 18.46 C ATOM 2230 CG PRO A 663 11.572 2.831 59.329 1.00 22.04 C ATOM 2231 CD PRO A 663 12.297 1.574 58.963 1.00 21.45 C ATOM 2232 N SER A 664 9.155 1.412 56.987 1.00 18.02 N ATOM 2233 CA SER A 664 8.129 1.540 55.964 1.00 21.93 C ATOM 2234 C SER A 664 7.437 0.210 55.674 1.00 21.94 C ATOM 2235 O SER A 664 6.349 0.211 55.090 1.00 23.35 O ATOM 2236 CB SER A 664 8.736 2.126 54.686 1.00 31.03 C ATOM 2237 OG SER A 664 9.613 1.195 54.080 1.00 35.74 O ATOM 2238 HG SER A 664 10.343 0.973 54.710 1.00 0.00 H ATOM 2239 H SER A 664 10.158 1.505 56.729 1.00 0.00 H ATOM 2240 N ARG A 665 8.006 -0.917 56.111 1.00 18.85 N ATOM 2241 CA ARG A 665 7.387 -2.218 55.879 1.00 18.14 C ATOM 2242 C ARG A 665 6.497 -2.679 57.029 1.00 19.58 C ATOM 2243 O ARG A 665 5.836 -3.721 56.906 1.00 23.43 O ATOM 2244 CB ARG A 665 8.470 -3.273 55.628 1.00 21.52 C ATOM 2245 CG ARG A 665 9.294 -3.000 54.385 1.00 23.82 C ATOM 2246 CD ARG A 665 8.524 -3.402 53.147 1.00 40.61 C ATOM 2247 NE ARG A 665 8.350 -4.852 53.067 1.00 55.19 N ATOM 2248 CZ ARG A 665 9.231 -5.684 52.517 1.00 55.94 C ATOM 2249 NH1 ARG A 665 10.353 -5.213 51.991 1.00 57.81 N ATOM 2250 NH2 ARG A 665 8.987 -6.988 52.488 1.00 54.21 N ATOM 2251 HE ARG A 665 7.481 -5.260 53.466 1.00 0.00 H ATOM 2252 HH12 ARG A 665 11.040 -5.865 51.562 1.00 0.00 H ATOM 2253 HH11 ARG A 665 10.546 -4.191 52.008 1.00 0.00 H ATOM 2254 HH22 ARG A 665 9.677 -7.637 52.058 1.00 0.00 H ATOM 2255 HH21 ARG A 665 8.106 -7.361 52.896 1.00 0.00 H ATOM 2256 H ARG A 665 8.908 -0.866 56.627 1.00 0.00 H ATOM 2257 N ARG A 666 6.458 -1.940 58.125 1.00 18.69 N ATOM 2258 CA ARG A 666 5.596 -2.264 59.254 1.00 16.38 C ATOM 2259 C ARG A 666 4.148 -1.893 58.939 1.00 16.66 C ATOM 2260 O ARG A 666 3.892 -0.941 58.199 1.00 19.80 O ATOM 2261 CB ARG A 666 6.066 -1.511 60.499 1.00 15.70 C ATOM 2262 CG ARG A 666 7.480 -1.919 60.925 1.00 16.75 C ATOM 2263 CD ARG A 666 8.032 -1.041 62.065 1.00 14.23 C ATOM 2264 NE ARG A 666 9.495 -1.141 62.103 1.00 15.04 N ATOM 2265 CZ ARG A 666 10.325 -0.194 62.540 1.00 17.46 C ATOM 2266 NH1 ARG A 666 9.853 0.934 63.064 1.00 14.71 N ATOM 2267 NH2 ARG A 666 11.642 -0.403 62.487 1.00 16.01 N ATOM 2268 HE ARG A 666 9.921 -2.026 61.760 1.00 0.00 H ATOM 2269 HH12 ARG A 666 10.511 1.666 63.402 1.00 0.00 H ATOM 2270 HH11 ARG A 666 8.826 1.084 63.136 1.00 0.00 H ATOM 2271 HH22 ARG A 666 12.299 0.329 62.825 1.00 0.00 H ATOM 2272 HH21 ARG A 666 12.012 -1.298 62.107 1.00 0.00 H ATOM 2273 H ARG A 666 7.065 -1.097 58.183 1.00 0.00 H ATOM 2274 N PRO A 667 3.183 -2.619 59.491 1.00 17.40 N ATOM 2275 CA PRO A 667 1.783 -2.190 59.367 1.00 16.75 C ATOM 2276 C PRO A 667 1.541 -0.881 60.106 1.00 16.81 C ATOM 2277 O PRO A 667 2.217 -0.566 61.087 1.00 16.66 O ATOM 2278 CB PRO A 667 0.984 -3.330 60.020 1.00 18.65 C ATOM 2279 CG PRO A 667 1.955 -4.370 60.415 1.00 25.50 C ATOM 2280 CD PRO A 667 3.347 -3.842 60.296 1.00 17.08 C ATOM 2281 N ARG A 668 0.541 -0.125 59.645 1.00 17.84 N ATOM 2282 CA ARG A 668 0.016 0.989 60.419 1.00 18.14 C ATOM 2283 C ARG A 668 -0.862 0.451 61.545 1.00 17.80 C ATOM 2284 O ARG A 668 -1.324 -0.689 61.497 1.00 18.44 O ATOM 2285 CB ARG A 668 -0.809 1.924 59.534 1.00 19.86 C ATOM 2286 CG ARG A 668 -0.028 2.552 58.378 1.00 23.00 C ATOM 2287 CD ARG A 668 -0.918 3.504 57.581 1.00 27.47 C ATOM 2288 NE ARG A 668 -1.151 4.769 58.283 1.00 31.26 N ATOM 2289 CZ ARG A 668 -2.315 5.426 58.310 1.00 33.45 C ATOM 2290 NH1 ARG A 668 -3.390 4.954 57.668 1.00 28.01 N ATOM 2291 NH2 ARG A 668 -2.403 6.572 58.978 1.00 30.57 N ATOM 2292 HE ARG A 668 -0.351 5.187 58.799 1.00 0.00 H ATOM 2293 HH12 ARG A 668 -4.287 5.479 57.700 1.00 0.00 H ATOM 2294 HH11 ARG A 668 -3.328 4.062 57.137 1.00 0.00 H ATOM 2295 HH22 ARG A 668 -3.304 7.090 59.005 1.00 0.00 H ATOM 2296 HH21 ARG A 668 -1.571 6.950 59.474 1.00 0.00 H ATOM 2297 H ARG A 668 0.129 -0.337 58.714 1.00 0.00 H ATOM 2298 N PHE A 669 -1.100 1.287 62.557 1.00 15.55 N ATOM 2299 CA PHE A 669 -1.926 0.828 63.680 1.00 16.57 C ATOM 2300 C PHE A 669 -3.338 0.473 63.242 1.00 19.90 C ATOM 2301 O PHE A 669 -3.935 -0.450 63.803 1.00 19.49 O ATOM 2302 CB PHE A 669 -1.983 1.889 64.791 1.00 16.31 C ATOM 2303 CG PHE A 669 -0.812 1.844 65.750 1.00 16.59 C ATOM 2304 CD1 PHE A 669 -0.563 0.728 66.554 1.00 14.38 C ATOM 2305 CD2 PHE A 669 0.055 2.924 65.849 1.00 15.81 C ATOM 2306 CE1 PHE A 669 0.508 0.718 67.441 1.00 15.07 C ATOM 2307 CE2 PHE A 669 1.118 2.919 66.719 1.00 15.56 C ATOM 2308 CZ PHE A 669 1.375 1.805 67.516 1.00 15.42 C ATOM 2309 H PHE A 669 -0.706 2.250 62.550 1.00 0.00 H ATOM 2310 N THR A 670 -3.893 1.175 62.248 1.00 18.86 N ATOM 2311 CA THR A 670 -5.241 0.832 61.795 1.00 23.18 C ATOM 2312 C THR A 670 -5.279 -0.566 61.166 1.00 25.07 C ATOM 2313 O THR A 670 -6.298 -1.267 61.255 1.00 23.89 O ATOM 2314 CB THR A 670 -5.758 1.916 60.836 1.00 23.83 C ATOM 2315 OG1 THR A 670 -7.156 1.725 60.574 1.00 31.46 O ATOM 2316 CG2 THR A 670 -4.994 1.889 59.520 1.00 26.30 C ATOM 2317 HG1 THR A 670 -7.474 2.430 59.956 1.00 0.00 H ATOM 2318 H THR A 670 -3.372 1.957 61.802 1.00 0.00 H ATOM 2319 N GLU A 671 -4.164 -1.011 60.558 1.00 20.38 N ATOM 2320 CA GLU A 671 -4.119 -2.378 60.033 1.00 21.65 C ATOM 2321 C GLU A 671 -3.979 -3.397 61.157 1.00 22.68 C ATOM 2322 O GLU A 671 -4.613 -4.465 61.116 1.00 21.55 O ATOM 2323 CB GLU A 671 -2.984 -2.532 59.009 1.00 31.36 C ATOM 2324 CG GLU A 671 -2.488 -3.987 58.745 1.00 36.00 C ATOM 2325 CD GLU A 671 -3.449 -4.862 57.921 1.00 49.73 C ATOM 2326 OE1 GLU A 671 -4.580 -4.392 57.593 1.00 48.69 O ATOM 2327 OE2 GLU A 671 -3.071 -6.027 57.584 1.00 51.33 O ATOM 2328 H GLU A 671 -3.338 -0.387 60.461 1.00 0.00 H ATOM 2329 N LEU A 672 -3.152 -3.092 62.167 1.00 17.24 N ATOM 2330 CA LEU A 672 -3.034 -3.985 63.315 1.00 18.32 C ATOM 2331 C LEU A 672 -4.378 -4.176 63.995 1.00 20.83 C ATOM 2332 O LEU A 672 -4.727 -5.293 64.395 1.00 19.21 O ATOM 2333 CB LEU A 672 -2.029 -3.426 64.321 1.00 16.61 C ATOM 2334 CG LEU A 672 -0.574 -3.461 63.849 1.00 22.17 C ATOM 2335 CD1 LEU A 672 0.304 -2.613 64.753 1.00 20.50 C ATOM 2336 CD2 LEU A 672 -0.032 -4.881 63.788 1.00 22.97 C ATOM 2337 H LEU A 672 -2.593 -2.216 62.132 1.00 0.00 H ATOM 2338 N LYS A 673 -5.142 -3.088 64.146 1.00 17.59 N ATOM 2339 CA LYS A 673 -6.465 -3.186 64.752 1.00 17.33 C ATOM 2340 C LYS A 673 -7.374 -4.126 63.963 1.00 20.66 C ATOM 2341 O LYS A 673 -8.041 -4.990 64.544 1.00 19.17 O ATOM 2342 CB LYS A 673 -7.083 -1.791 64.858 1.00 15.65 C ATOM 2343 CG LYS A 673 -8.574 -1.779 65.146 1.00 18.88 C ATOM 2344 CD LYS A 673 -9.035 -0.340 65.419 1.00 27.78 C ATOM 2345 CE LYS A 673 -8.923 0.547 64.188 1.00 34.61 C ATOM 2346 NZ LYS A 673 -9.652 1.842 64.364 1.00 48.20 N ATOM 2347 HZ1 LYS A 673 -10.659 1.651 64.537 1.00 0.00 H ATOM 2348 HZ2 LYS A 673 -9.251 2.357 65.174 1.00 0.00 H ATOM 2349 HZ3 LYS A 673 -9.550 2.416 63.503 1.00 0.00 H ATOM 2350 H LYS A 673 -4.789 -2.163 63.828 1.00 0.00 H ATOM 2351 N ALA A 674 -7.393 -3.994 62.635 1.00 19.57 N ATOM 2352 CA ALA A 674 -8.228 -4.874 61.820 1.00 21.88 C ATOM 2353 C ALA A 674 -7.812 -6.335 61.958 1.00 21.63 C ATOM 2354 O ALA A 674 -8.669 -7.227 62.057 1.00 18.54 O ATOM 2355 CB ALA A 674 -8.171 -4.438 60.356 1.00 24.47 C ATOM 2356 H ALA A 674 -6.812 -3.262 62.179 1.00 0.00 H ATOM 2357 N GLN A 675 -6.506 -6.605 61.956 1.00 20.33 N ATOM 2358 CA GLN A 675 -6.042 -7.984 62.073 1.00 22.51 C ATOM 2359 C GLN A 675 -6.278 -8.533 63.474 1.00 19.47 C ATOM 2360 O GLN A 675 -6.603 -9.715 63.637 1.00 19.42 O ATOM 2361 CB GLN A 675 -4.561 -8.078 61.708 1.00 24.79 C ATOM 2362 CG GLN A 675 -4.248 -7.694 60.279 1.00 28.57 C ATOM 2363 CD GLN A 675 -2.871 -8.154 59.852 1.00 31.96 C ATOM 2364 OE1 GLN A 675 -1.946 -7.352 59.743 1.00 38.88 O ATOM 2365 NE2 GLN A 675 -2.728 -9.452 59.602 1.00 34.11 N ATOM 2366 HE22 GLN A 675 -3.539 -10.094 59.708 1.00 0.00 H ATOM 2367 HE21 GLN A 675 -1.805 -9.825 59.301 1.00 0.00 H ATOM 2368 H GLN A 675 -5.816 -5.831 61.871 1.00 0.00 H ATOM 2369 N LEU A 676 -6.114 -7.696 64.499 1.00 16.16 N ATOM 2370 CA LEU A 676 -6.386 -8.156 65.849 1.00 14.55 C ATOM 2371 C LEU A 676 -7.868 -8.449 66.049 1.00 18.74 C ATOM 2372 O LEU A 676 -8.216 -9.362 66.815 1.00 21.18 O ATOM 2373 CB LEU A 676 -5.881 -7.120 66.857 1.00 15.76 C ATOM 2374 CG LEU A 676 -4.363 -7.160 67.032 1.00 18.83 C ATOM 2375 CD1 LEU A 676 -3.894 -5.913 67.734 1.00 16.02 C ATOM 2376 CD2 LEU A 676 -3.922 -8.388 67.822 1.00 19.64 C ATOM 2377 H LEU A 676 -5.794 -6.721 64.333 1.00 0.00 H ATOM 2378 N SER A 677 -8.753 -7.692 65.383 1.00 17.15 N ATOM 2379 CA SER A 677 -10.185 -7.983 65.462 1.00 18.72 C ATOM 2380 C SER A 677 -10.502 -9.400 64.990 1.00 19.63 C ATOM 2381 O SER A 677 -11.338 -10.089 65.592 1.00 21.08 O ATOM 2382 CB SER A 677 -10.984 -6.984 64.629 1.00 22.07 C ATOM 2383 OG SER A 677 -12.364 -7.301 64.695 1.00 30.01 O ATOM 2384 HG SER A 677 -12.509 -8.214 64.341 1.00 0.00 H ATOM 2385 H SER A 677 -8.419 -6.893 64.807 1.00 0.00 H ATOM 2386 N THR A 678 -9.873 -9.846 63.898 1.00 17.63 N ATOM 2387 CA THR A 678 -10.198 -11.178 63.387 1.00 18.45 C ATOM 2388 C THR A 678 -9.571 -12.267 64.249 1.00 17.73 C ATOM 2389 O THR A 678 -10.168 -13.334 64.432 1.00 18.40 O ATOM 2390 CB THR A 678 -9.741 -11.336 61.934 1.00 28.00 C ATOM 2391 OG1 THR A 678 -8.317 -11.451 61.889 1.00 33.13 O ATOM 2392 CG2 THR A 678 -10.189 -10.164 61.078 1.00 23.88 C ATOM 2393 HG1 THR A 678 -7.909 -10.636 62.276 1.00 0.00 H ATOM 2394 H THR A 678 -9.164 -9.255 63.419 1.00 0.00 H ATOM 2395 N ILE A 679 -8.355 -12.035 64.761 1.00 17.37 N ATOM 2396 CA ILE A 679 -7.734 -12.996 65.671 1.00 17.27 C ATOM 2397 C ILE A 679 -8.567 -13.139 66.936 1.00 17.49 C ATOM 2398 O ILE A 679 -8.811 -14.254 67.418 1.00 19.91 O ATOM 2399 CB ILE A 679 -6.283 -12.580 65.990 1.00 19.13 C ATOM 2400 CG1 ILE A 679 -5.408 -12.702 64.741 1.00 17.59 C ATOM 2401 CG2 ILE A 679 -5.703 -13.439 67.115 1.00 27.94 C ATOM 2402 CD1 ILE A 679 -4.042 -12.030 64.873 1.00 21.63 C ATOM 2403 H ILE A 679 -7.848 -11.163 64.509 1.00 0.00 H ATOM 2404 N LEU A 680 -9.014 -12.013 67.490 1.00 15.65 N ATOM 2405 CA LEU A 680 -9.890 -12.047 68.659 1.00 16.08 C ATOM 2406 C LEU A 680 -11.170 -12.830 68.378 1.00 19.28 C ATOM 2407 O LEU A 680 -11.558 -13.700 69.165 1.00 18.34 O ATOM 2408 CB LEU A 680 -10.223 -10.617 69.101 1.00 16.76 C ATOM 2409 CG LEU A 680 -11.144 -10.482 70.316 1.00 17.14 C ATOM 2410 CD1 LEU A 680 -10.568 -11.172 71.544 1.00 21.87 C ATOM 2411 CD2 LEU A 680 -11.408 -8.988 70.604 1.00 19.76 C ATOM 2412 H LEU A 680 -8.735 -11.097 67.085 1.00 0.00 H ATOM 2413 N GLU A 681 -11.866 -12.507 67.280 1.00 17.65 N ATOM 2414 CA GLU A 681 -13.141 -13.161 66.998 1.00 20.86 C ATOM 2415 C GLU A 681 -12.964 -14.655 66.767 1.00 19.46 C ATOM 2416 O GLU A 681 -13.831 -15.453 67.151 1.00 21.78 O ATOM 2417 CB GLU A 681 -13.821 -12.514 65.794 1.00 21.00 C ATOM 2418 CG GLU A 681 -15.246 -13.013 65.509 1.00 22.33 C ATOM 2419 CD GLU A 681 -16.318 -12.372 66.423 1.00 28.92 C ATOM 2420 OE1 GLU A 681 -15.964 -11.477 67.210 1.00 27.98 O ATOM 2421 OE2 GLU A 681 -17.510 -12.759 66.336 1.00 41.69 O ATOM 2422 H GLU A 681 -11.497 -11.788 66.626 1.00 0.00 H ATOM 2423 N GLU A 682 -11.852 -15.066 66.157 1.00 20.52 N ATOM 2424 CA GLU A 682 -11.653 -16.503 65.990 1.00 21.94 C ATOM 2425 C GLU A 682 -11.449 -17.186 67.335 1.00 25.65 C ATOM 2426 O GLU A 682 -11.945 -18.300 67.551 1.00 26.61 O ATOM 2427 CB GLU A 682 -10.482 -16.800 65.062 1.00 23.97 C ATOM 2428 CG GLU A 682 -10.248 -18.306 64.944 1.00 35.01 C ATOM 2429 CD GLU A 682 -10.111 -18.762 63.525 1.00 36.89 C ATOM 2430 OE1 GLU A 682 -10.246 -19.978 63.268 1.00 39.66 O ATOM 2431 OE2 GLU A 682 -9.842 -17.904 62.664 1.00 43.66 O ATOM 2432 H GLU A 682 -11.148 -14.384 65.811 1.00 0.00 H ATOM 2433 N GLU A 683 -10.743 -16.537 68.260 1.00 26.69 N ATOM 2434 CA GLU A 683 -10.564 -17.152 69.572 1.00 29.80 C ATOM 2435 C GLU A 683 -11.871 -17.171 70.360 1.00 21.77 C ATOM 2436 O GLU A 683 -12.195 -18.180 70.998 1.00 28.75 O ATOM 2437 CB GLU A 683 -9.466 -16.435 70.353 1.00 26.59 C ATOM 2438 CG GLU A 683 -9.206 -17.004 71.763 1.00 27.01 C ATOM 2439 CD GLU A 683 -8.728 -18.448 71.765 1.00 34.42 C ATOM 2440 OE1 GLU A 683 -8.135 -18.888 70.757 1.00 38.71 O ATOM 2441 OE2 GLU A 683 -8.933 -19.136 72.793 1.00 29.33 O ATOM 2442 H GLU A 683 -10.326 -15.607 68.051 1.00 0.00 H ATOM 2443 N LYS A 684 -12.641 -16.076 70.324 1.00 20.47 N ATOM 2444 CA LYS A 684 -13.895 -15.998 71.070 1.00 22.21 C ATOM 2445 C LYS A 684 -14.820 -14.967 70.435 1.00 26.26 C ATOM 2446 O LYS A 684 -14.416 -13.817 70.228 1.00 33.26 O ATOM 2447 CB LYS A 684 -13.639 -15.618 72.532 1.00 29.87 C ATOM 2448 CG LYS A 684 -14.897 -15.373 73.350 1.00 29.63 C ATOM 2449 CD LYS A 684 -14.571 -15.045 74.798 1.00 30.96 C ATOM 2450 CE LYS A 684 -15.840 -15.077 75.656 1.00 45.86 C ATOM 2451 NZ LYS A 684 -15.559 -15.360 77.096 1.00 51.68 N ATOM 2452 HZ1 LYS A 684 -15.094 -16.286 77.182 1.00 0.00 H ATOM 2453 HZ2 LYS A 684 -14.935 -14.621 77.478 1.00 0.00 H ATOM 2454 HZ3 LYS A 684 -16.453 -15.369 77.627 1.00 0.00 H ATOM 2455 H LYS A 684 -12.339 -15.262 69.752 1.00 0.00 H ATOM 2456 N LEU A 685 -16.063 -15.373 70.161 1.00 34.55 N ATOM 2457 CA LEU A 685 -17.040 -14.461 69.572 1.00 40.12 C ATOM 2458 C LEU A 685 -17.370 -13.323 70.535 1.00 43.59 C ATOM 2459 O LEU A 685 -17.719 -13.556 71.697 1.00 40.56 O ATOM 2460 CB LEU A 685 -18.314 -15.217 69.206 1.00 38.24 C ATOM 2461 H LEU A 685 -16.339 -16.354 70.370 1.00 0.00 H ATOM 2462 N GLN A 686 -17.279 -12.090 70.037 1.00 37.13 N ATOM 2463 CA GLN A 686 -17.522 -10.899 70.845 1.00 40.33 C ATOM 2464 C GLN A 686 -18.981 -10.448 70.748 1.00 52.17 C ATOM 2465 O GLN A 686 -19.679 -10.766 69.784 1.00 60.10 O ATOM 2466 CB GLN A 686 -16.581 -9.761 70.414 1.00 40.92 C ATOM 2467 CG GLN A 686 -15.097 -10.136 70.360 1.00 40.83 C ATOM 2468 CD GLN A 686 -14.502 -10.430 71.729 1.00 37.63 C ATOM 2469 OE1 GLN A 686 -14.343 -9.515 72.569 1.00 34.04 O ATOM 2470 NE2 GLN A 686 -14.174 -11.704 71.972 1.00 32.84 N ATOM 2471 HE22 GLN A 686 -14.325 -12.428 71.241 1.00 0.00 H ATOM 2472 HE21 GLN A 686 -13.768 -11.970 72.892 1.00 0.00 H ATOM 2473 H GLN A 686 -17.025 -11.972 69.035 1.00 0.00 H TER 2474 GLN A 686 HETATM 2475 O HOH 1 -9.577 -17.935 60.400 1.00 39.43 O HETATM 2476 O HOH 2 16.727 -7.461 61.235 1.00 25.34 O HETATM 2477 O HOH 3 24.908 -4.204 64.667 1.00 35.75 O HETATM 2478 O HOH 4 -19.641 -11.789 67.558 1.00 42.29 O HETATM 2479 O HOH 5 -14.856 -4.751 77.643 1.00 43.45 O HETATM 2480 O HOH 6 -8.325 2.559 57.957 1.00 36.16 O HETATM 2481 O HOH 7 -12.098 10.009 77.130 1.00 54.59 O HETATM 2482 O HOH 8 0.624 -17.083 75.534 1.00 33.26 O HETATM 2483 O HOH 9 -2.389 -4.708 89.041 1.00 29.11 O HETATM 2484 O HOH 10 -11.467 3.137 84.439 1.00 26.20 O HETATM 2485 O HOH 11 7.346 -11.453 60.013 1.00 40.56 O HETATM 2486 O HOH 12 5.108 13.131 70.388 1.00 31.56 O HETATM 2487 O HOH 13 0.320 13.198 81.036 1.00 42.01 O HETATM 2488 O HOH 14 1.737 -21.505 69.900 1.00 31.88 O HETATM 2489 O HOH 15 -10.276 13.459 70.035 1.00 32.61 O HETATM 2490 O HOH 16 8.778 1.760 76.327 1.00 38.10 O HETATM 2491 O HOH 17 -13.682 25.509 101.718 1.00 53.43 O HETATM 2492 O HOH 18 6.276 -7.214 80.796 1.00 23.47 O HETATM 2493 O HOH 19 -10.088 17.178 100.094 1.00 45.12 O HETATM 2494 O HOH 20 6.908 -2.947 80.399 1.00 18.27 O HETATM 2495 O HOH 21 -11.920 0.794 86.896 1.00 26.16 O HETATM 2496 O HOH 22 9.014 -18.604 73.907 1.00 38.64 O HETATM 2497 O HOH 23 -9.103 3.452 66.815 1.00 22.70 O HETATM 2498 O HOH 24 16.588 -12.988 77.606 1.00 44.95 O HETATM 2499 O HOH 25 2.477 -16.821 78.738 1.00 43.70 O HETATM 2500 O HOH 26 24.163 -8.806 77.224 1.00 32.03 O HETATM 2501 O HOH 27 -11.008 -6.891 60.819 1.00 43.92 O HETATM 2502 O HOH 28 -8.308 13.501 78.917 1.00 23.70 O HETATM 2503 O HOH 29 -1.890 4.790 101.519 1.00 45.59 O HETATM 2504 O HOH 30 17.942 -15.175 69.223 1.00 37.19 O HETATM 2505 O HOH 31 0.846 0.966 84.477 1.00 33.66 O HETATM 2506 O HOH 32 -15.793 18.014 86.801 1.00 48.08 O HETATM 2507 O HOH 33 -9.543 -18.227 75.249 1.00 26.20 O HETATM 2508 O HOH 34 23.614 -0.254 64.827 1.00 24.68 O HETATM 2509 O HOH 35 16.402 9.568 60.979 1.00 19.85 O HETATM 2510 O HOH 36 2.092 12.108 91.237 1.00 39.80 O HETATM 2511 O HOH 37 -14.600 17.152 101.737 1.00 28.10 O HETATM 2512 O HOH 38 15.022 -11.808 61.048 1.00 20.36 O HETATM 2513 O HOH 39 8.297 5.426 69.039 1.00 18.95 O HETATM 2514 O HOH 40 -15.453 21.885 91.745 1.00 40.54 O HETATM 2515 O HOH 41 -13.661 -9.019 63.035 1.00 30.13 O HETATM 2516 O HOH 42 16.573 10.993 63.289 1.00 20.86 O HETATM 2517 O HOH 43 14.912 -2.782 70.868 1.00 23.49 O HETATM 2518 O HOH 44 -1.194 -12.643 61.277 1.00 32.16 O HETATM 2519 O HOH 45 8.179 12.384 66.327 1.00 20.43 O HETATM 2520 O HOH 46 5.013 1.752 58.314 1.00 25.38 O HETATM 2521 O HOH 47 14.926 12.834 68.279 1.00 27.71 O HETATM 2522 O HOH 48 2.084 10.161 63.309 1.00 26.80 O HETATM 2523 O HOH 49 25.166 -0.333 71.678 1.00 29.84 O HETATM 2524 O HOH 50 0.633 5.724 78.167 1.00 25.73 O HETATM 2525 O HOH 51 8.620 0.016 51.822 1.00 46.04 O HETATM 2526 O HOH 52 13.811 -16.027 68.802 1.00 25.30 O HETATM 2527 O HOH 53 -9.648 27.541 85.944 1.00 40.00 O HETATM 2528 O HOH 54 10.559 5.501 62.264 1.00 20.74 O HETATM 2529 O HOH 55 -13.854 8.364 74.867 1.00 32.06 O HETATM 2530 O HOH 56 -6.081 -16.671 64.638 1.00 25.68 O HETATM 2531 O HOH 57 21.267 -1.417 71.915 1.00 24.31 O HETATM 2532 O HOH 58 -7.292 11.007 77.771 1.00 24.25 O HETATM 2533 O HOH 59 12.975 -11.866 78.609 1.00 26.84 O HETATM 2534 O HOH 60 -5.029 5.465 62.240 1.00 25.34 O HETATM 2535 O HOH 61 21.421 -9.769 59.674 1.00 24.68 O HETATM 2536 O HOH 62 6.323 -20.998 71.629 1.00 29.70 O HETATM 2537 O HOH 63 -7.450 -21.424 73.284 1.00 45.90 O HETATM 2538 O HOH 64 14.703 -6.713 80.550 1.00 26.80 O HETATM 2539 O HOH 65 1.814 16.761 60.961 1.00 36.34 O HETATM 2540 O HOH 66 -9.527 8.165 65.031 1.00 30.68 O HETATM 2541 O HOH 67 4.004 -2.002 85.667 1.00 37.68 O HETATM 2542 O HOH 68 12.847 -4.432 70.920 1.00 19.35 O HETATM 2543 O HOH 69 -13.516 1.784 77.962 1.00 38.05 O HETATM 2544 O HOH 70 -11.688 -10.437 79.632 1.00 32.79 O HETATM 2545 O HOH 71 1.602 7.018 66.939 1.00 21.20 O HETATM 2546 O HOH 72 10.440 -9.575 62.729 1.00 19.63 O HETATM 2547 O HOH 73 24.855 -7.706 70.517 1.00 33.22 O HETATM 2548 O HOH 74 5.889 -6.114 58.360 1.00 31.24 O HETATM 2549 O HOH 75 21.948 0.963 74.922 1.00 37.27 O HETATM 2550 O HOH 76 3.675 1.809 60.769 1.00 18.56 O HETATM 2551 O HOH 77 -9.500 24.501 93.257 1.00 45.53 O HETATM 2552 O HOH 78 8.699 -8.872 59.608 1.00 29.08 O HETATM 2553 O HOH 79 -7.409 -10.903 59.036 1.00 47.74 O HETATM 2554 O HOH 80 23.270 2.233 68.185 1.00 38.86 O HETATM 2555 O HOH 81 4.431 -13.949 84.575 1.00 31.52 O HETATM 2556 O HOH 82 -11.383 3.545 68.437 1.00 29.70 O HETATM 2557 O HOH 83 -12.362 -20.705 69.758 1.00 45.85 O HETATM 2558 O HOH 84 24.954 -4.096 70.063 1.00 23.97 O HETATM 2559 O HOH 85 -7.239 -16.578 67.054 1.00 27.69 O HETATM 2560 O HOH 86 22.458 -13.948 62.864 1.00 16.71 O HETATM 2561 O HOH 87 -14.243 2.457 80.828 1.00 41.29 O HETATM 2562 O HOH 88 4.987 11.549 73.339 1.00 40.73 O HETATM 2563 O HOH 89 9.843 -18.540 68.283 1.00 23.17 O HETATM 2564 O HOH 90 3.266 -14.939 86.991 1.00 45.16 O HETATM 2565 O HOH 91 13.198 -7.169 59.094 1.00 23.96 O HETATM 2566 O HOH 92 13.128 3.345 55.488 1.00 28.64 O HETATM 2567 O HOH 93 11.121 3.354 69.285 1.00 21.43 O HETATM 2568 O HOH 94 5.685 -4.827 54.076 1.00 44.97 O HETATM 2569 O HOH 95 -14.065 -0.081 82.469 1.00 35.19 O HETATM 2570 O HOH 96 18.710 6.335 80.444 1.00 45.82 O HETATM 2571 O HOH 97 11.761 -8.857 68.744 1.00 18.68 O HETATM 2572 O HOH 98 15.774 -1.372 78.101 1.00 25.68 O HETATM 2573 O HOH 99 20.358 1.410 59.951 1.00 37.55 O HETATM 2574 O HOH 100 14.641 3.988 57.469 1.00 22.99 O HETATM 2575 O HOH 101 13.123 -2.804 52.744 1.00 41.43 O HETATM 2576 O HOH 102 2.027 -2.424 84.160 1.00 25.74 O HETATM 2577 O HOH 103 -9.498 9.501 77.015 1.00 25.03 O HETATM 2578 O HOH 104 21.441 -2.707 80.521 1.00 43.06 O HETATM 2579 O HOH 105 -11.238 6.523 79.255 1.00 22.83 O HETATM 2580 O HOH 106 -16.546 5.307 90.018 1.00 41.47 O HETATM 2581 O HOH 107 3.527 -1.334 55.375 1.00 54.19 O HETATM 2582 O HOH 108 -3.905 2.562 56.156 1.00 30.12 O HETATM 2583 O HOH 109 15.375 0.910 61.126 1.00 18.52 O HETATM 2584 O HOH 110 -9.156 -0.896 61.256 1.00 28.54 O HETATM 2585 O HOH 111 8.903 -2.472 82.331 1.00 32.21 O HETATM 2586 O HOH 112 3.734 13.673 67.860 1.00 23.03 O HETATM 2587 O HOH 113 -9.864 24.118 96.141 1.00 42.72 O HETATM 2588 O HOH 114 -4.347 9.030 102.699 1.00 49.56 O HETATM 2589 O HOH 115 -12.158 0.434 70.954 1.00 44.19 O HETATM 2590 O HOH 116 17.617 -3.325 80.743 1.00 46.75 O HETATM 2591 O HOH 117 22.368 -14.753 65.512 1.00 25.82 O HETATM 2592 O HOH 118 3.236 -22.286 71.703 1.00 39.42 O HETATM 2593 O HOH 119 13.635 -12.204 75.966 1.00 30.58 O HETATM 2594 O HOH 120 -2.754 -19.231 64.643 1.00 34.39 O HETATM 2595 O HOH 121 12.434 -4.827 56.786 1.00 25.11 O HETATM 2596 O HOH 122 10.273 -9.895 83.968 1.00 34.27 O HETATM 2597 O HOH 123 10.188 -7.963 86.426 1.00 56.86 O HETATM 2598 O HOH 124 -11.823 8.324 99.621 1.00 45.00 O HETATM 2599 O HOH 125 2.356 15.902 64.349 1.00 39.60 O HETATM 2600 O HOH 126 10.818 6.119 59.630 1.00 23.40 O HETATM 2601 O HOH 127 11.862 6.101 73.327 1.00 41.33 O HETATM 2602 O HOH 128 -2.202 -17.389 88.548 1.00 39.58 O HETATM 2603 O HOH 129 -0.872 -1.068 57.084 1.00 63.53 O HETATM 2604 O HOH 130 3.233 -3.777 87.440 1.00 36.14 O HETATM 2605 O HOH 131 -6.657 -20.152 77.510 1.00 37.15 O HETATM 2606 O HOH 132 -13.412 -4.268 73.479 1.00 26.53 O HETATM 2607 O HOH 133 -10.657 5.699 98.172 1.00 41.84 O HETATM 2608 O HOH 134 4.891 6.376 60.518 1.00 35.32 O HETATM 2609 O HOH 135 -0.587 -2.087 90.494 1.00 44.42 O HETATM 2610 O HOH 136 -6.782 26.652 80.796 1.00 44.50 O HETATM 2611 O HOH 137 -11.715 26.255 92.511 1.00 46.21 O HETATM 2612 O HOH 138 2.382 4.194 61.068 1.00 29.03 O HETATM 2613 O HOH 139 15.932 -15.085 67.120 1.00 19.27 O HETATM 2614 O HOH 140 8.224 -2.390 84.806 1.00 42.63 O HETATM 2615 O HOH 141 1.728 0.011 56.049 1.00 55.24 O HETATM 2616 O HOH 142 -12.402 -11.869 74.719 1.00 27.69 O HETATM 2617 O HOH 143 14.591 12.727 64.495 1.00 32.36 O HETATM 2618 O HOH 144 15.462 -7.570 57.643 1.00 37.34 O HETATM 2619 O HOH 145 6.762 -12.023 85.111 1.00 56.59 O HETATM 2620 O HOH 146 -12.343 23.719 103.927 1.00 44.07 O HETATM 2621 O HOH 147 17.996 1.934 61.891 1.00 22.75 O HETATM 2622 O HOH 148 1.061 -19.013 78.588 1.00 39.86 O HETATM 2623 O HOH 149 4.123 12.033 88.964 1.00 48.03 O HETATM 2624 O HOH 150 11.830 -6.479 69.427 1.00 30.76 O HETATM 2625 O HOH 151 6.198 -1.176 51.878 1.00 48.82 O HETATM 2626 O HOH 152 2.058 15.844 68.037 1.00 38.94 O HETATM 2627 O HOH 153 8.938 -16.213 74.798 1.00 37.45 O HETATM 2628 O HOH 154 -23.115 14.006 84.659 1.00 52.51 O HETATM 2629 O HOH 155 -10.781 -2.612 62.190 1.00 34.86 O HETATM 2630 O HOH 156 14.186 -4.214 81.603 1.00 42.88 O HETATM 2631 O HOH 157 10.309 -6.809 56.049 1.00 38.88 O HETATM 2632 O HOH 158 -0.395 -22.721 70.326 1.00 44.28 O HETATM 2633 O HOH 159 10.711 13.561 65.982 1.00 23.89 O HETATM 2634 O HOH 160 -14.717 7.158 76.856 1.00 53.07 O HETATM 2635 O HOH 161 -15.130 -5.567 75.355 1.00 40.13 O HETATM 2636 O HOH 162 -5.642 -19.173 64.051 1.00 39.09 O HETATM 2637 O HOH 163 24.682 1.284 62.999 1.00 44.30 O HETATM 2638 O HOH 164 5.080 -17.844 79.226 1.00 40.05 O HETATM 2639 O HOH 165 22.649 1.506 60.729 1.00 29.90 O HETATM 2640 O HOH 166 -0.173 -3.588 56.188 1.00 59.11 O HETATM 2641 O HOH 167 15.945 1.671 58.502 1.00 21.57 O HETATM 2642 O HOH 168 14.508 -4.642 55.372 1.00 44.74 O HETATM 2643 O HOH 169 15.833 0.073 56.518 1.00 38.91 O HETATM 2644 O HOH 170 26.189 -2.800 68.111 1.00 39.91 O HETATM 2645 O HOH 171 15.524 14.683 66.227 1.00 37.15 O HETATM 2646 O HOH 172 6.262 5.017 57.851 1.00 38.53 O HETATM 2647 O HOH 173 22.520 0.831 71.644 1.00 34.16 O HETATM 2648 O HOH 174 -12.121 18.250 102.573 1.00 43.75 O HETATM 2649 O HOH 175 -15.989 -20.268 72.164 1.00 39.19 O HETATM 2650 O HOH 176 7.906 -22.058 69.477 1.00 38.10 O HETATM 2651 O HOH 177 8.192 -7.637 57.352 1.00 46.16 O HETATM 2652 O HOH 178 3.635 12.282 75.690 1.00 42.77 O HETATM 2653 O HOH 179 12.735 -14.162 80.310 1.00 38.50 O HETATM 2654 O HOH 180 11.516 -20.010 72.719 1.00 42.61 O HETATM 2655 O HOH 181 18.608 2.633 58.307 1.00 32.04 O HETATM 2656 O HOH 182 15.052 -17.613 70.882 1.00 38.81 O HETATM 2657 C4 EUW A 183 -3.131 5.678 87.283 1.00 0.15 C HETATM 2658 C5 EUW A 183 -4.128 6.397 86.633 1.00 0.10 C HETATM 2659 C6 EUW A 183 -5.434 5.951 86.720 1.00 0.02 C HETATM 2660 N1 EUW A 183 -5.706 4.795 87.465 1.00 -0.27 N HETATM 2661 C2 EUW A 183 -4.720 4.129 88.083 1.00 0.19 C HETATM 2662 N3 EUW A 183 -3.442 4.563 87.986 1.00 -0.23 N HETATM 2663 NAG EUW A 183 -5.132 3.039 88.746 1.00 -0.25 N HETATM 2664 CAH EUW A 183 -4.398 2.274 89.564 1.00 0.06 C HETATM 2665 CAI EUW A 183 -5.132 1.541 90.494 1.00 -0.04 C HETATM 2666 CAJ EUW A 183 -4.506 0.697 91.392 1.00 -0.07 C HETATM 2667 CAK EUW A 183 -3.124 0.572 91.366 1.00 -0.03 C HETATM 2668 CAL EUW A 183 -2.368 1.285 90.434 1.00 -0.07 C HETATM 2669 CAM EUW A 183 -3.009 2.136 89.527 1.00 -0.04 C HETATM 2670 H5 EUW A 183 -2.428 2.687 88.797 1.00 0.05 H HETATM 2671 H4 EUW A 183 -1.289 1.180 90.413 1.00 0.05 H HETATM 2672 CAN EUW A 183 -2.554 -0.304 92.275 1.00 0.05 C HETATM 2673 NAO EUW A 183 -3.592 -1.300 92.635 1.00 -0.31 N HETATM 2674 CAP EUW A 183 -3.146 -2.473 93.100 1.00 0.14 C HETATM 2675 CAQ EUW A 183 -2.717 -2.964 94.337 1.00 0.14 C HETATM 2676 CAR EUW A 183 -2.519 -4.220 93.764 1.00 0.22 C HETATM 2677 CAS EUW A 183 -2.948 -3.733 92.536 1.00 0.22 C HETATM 2678 OAT EUW A 183 -3.090 -4.225 91.416 1.00 -0.37 O HETATM 2679 OAU EUW A 183 -2.124 -5.313 94.171 1.00 -0.37 O HETATM 2680 NAV EUW A 183 -2.560 -2.477 95.575 1.00 -0.32 N HETATM 2681 CAW EUW A 183 -2.678 -1.012 95.624 1.00 0.04 C HETATM 2682 CAX EUW A 183 -2.982 -0.504 97.031 1.00 0.05 C HETATM 2683 NAY EUW A 183 -4.382 -0.060 97.104 1.00 -0.29 N HETATM 2684 CAZ EUW A 183 -4.851 0.592 98.175 1.00 0.18 C HETATM 2685 CBA EUW A 183 -6.330 0.979 98.105 1.00 0.03 C HETATM 2686 CBB EUW A 183 -7.044 0.084 97.090 1.00 -0.05 C HETATM 2687 H14 EUW A 183 -8.107 0.362 97.040 1.00 0.03 H HETATM 2688 H15 EUW A 183 -6.955 -0.967 97.401 1.00 0.03 H HETATM 2689 H16 EUW A 183 -6.584 0.214 96.099 1.00 0.03 H HETATM 2690 H12 EUW A 183 -6.420 2.030 97.794 1.00 0.05 H HETATM 2691 H13 EUW A 183 -6.790 0.849 99.096 1.00 0.05 H HETATM 2692 OBC EUW A 183 -4.165 0.870 99.158 1.00 -0.40 O HETATM 2693 H27 EUW A 183 -4.996 -0.249 96.338 1.00 0.19 H HETATM 2694 H10 EUW A 183 -2.318 0.340 97.267 1.00 0.05 H HETATM 2695 H11 EUW A 183 -2.817 -1.314 97.756 1.00 0.05 H HETATM 2696 H8 EUW A 183 -1.730 -0.569 95.285 1.00 0.05 H HETATM 2697 H9 EUW A 183 -3.490 -0.700 94.951 1.00 0.05 H HETATM 2698 H26 EUW A 183 -2.377 -3.064 96.401 1.00 0.17 H HETATM 2699 H25 EUW A 183 -4.597 -1.101 92.533 1.00 0.18 H HETATM 2700 H6 EUW A 183 -2.229 0.243 93.172 1.00 0.07 H HETATM 2701 H7 EUW A 183 -1.689 -0.809 91.820 1.00 0.07 H HETATM 2702 H3 EUW A 183 -5.091 0.136 92.112 1.00 0.05 H HETATM 2703 H2 EUW A 183 -6.212 1.634 90.514 1.00 0.05 H HETATM 2704 H24 EUW A 183 -6.115 2.761 88.612 1.00 0.22 H HETATM 2705 H1 EUW A 183 -6.234 6.486 86.221 1.00 0.09 H HETATM 2706 CL1 EUW A 183 -3.749 7.824 85.719 1.00 -0.07 CL HETATM 2707 NBD EUW A 183 -1.893 6.179 87.129 1.00 -0.25 N HETATM 2708 CBE EUW A 183 -0.833 5.556 87.661 1.00 0.09 C HETATM 2709 CBF EUW A 183 0.199 5.172 86.792 1.00 0.07 C HETATM 2710 CBG EUW A 183 1.315 4.528 87.328 1.00 -0.05 C HETATM 2711 CBH EUW A 183 1.411 4.281 88.695 1.00 -0.07 C HETATM 2712 CBI EUW A 183 0.386 4.676 89.548 1.00 -0.07 C HETATM 2713 CBJ EUW A 183 -0.732 5.317 89.031 1.00 -0.03 C HETATM 2714 H20 EUW A 183 -1.529 5.633 89.695 1.00 0.06 H HETATM 2715 H19 EUW A 183 0.460 4.484 90.612 1.00 0.06 H HETATM 2716 H18 EUW A 183 2.285 3.780 89.095 1.00 0.05 H HETATM 2717 H17 EUW A 183 2.119 4.216 86.671 1.00 0.06 H HETATM 2718 CBK EUW A 183 0.164 5.386 85.404 1.00 0.20 C HETATM 2719 NBM EUW A 183 1.073 4.667 84.709 1.00 -0.29 N HETATM 2720 CBN EUW A 183 1.093 4.840 83.250 1.00 0.02 C HETATM 2721 H21 EUW A 183 1.875 4.200 82.816 1.00 0.05 H HETATM 2722 H22 EUW A 183 1.304 5.892 83.008 1.00 0.05 H HETATM 2723 H23 EUW A 183 0.115 4.557 82.834 1.00 0.05 H HETATM 2724 H29 EUW A 183 1.706 4.043 85.168 1.00 0.18 H HETATM 2725 OBL EUW A 183 -0.632 6.168 84.873 1.00 -0.39 O HETATM 2726 H28 EUW A 183 -1.758 7.050 86.597 1.00 0.22 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 404 405 411 412 413 CONECT 411 404 CONECT 412 404 CONECT 413 404 CONECT 1455 1456 1463 1464 1465 CONECT 1463 1455 CONECT 1464 1455 CONECT 1465 1455 CONECT 2657 2658 2662 2707 CONECT 2658 2657 2659 2706 CONECT 2659 2658 2660 2705 CONECT 2660 2659 2661 CONECT 2661 2660 2662 2663 CONECT 2662 2657 2661 CONECT 2663 2661 2664 2704 CONECT 2664 2663 2665 2669 CONECT 2665 2664 2666 2703 CONECT 2666 2665 2667 2702 CONECT 2667 2666 2668 2672 CONECT 2668 2667 2669 2671 CONECT 2669 2664 2668 2670 CONECT 2670 2669 CONECT 2671 2668 CONECT 2672 2667 2673 2700 2701 CONECT 2673 2672 2674 2699 CONECT 2674 2673 2675 2677 CONECT 2675 2674 2676 2680 CONECT 2676 2675 2677 2679 CONECT 2677 2674 2676 2678 CONECT 2678 2677 CONECT 2679 2676 CONECT 2680 2675 2681 2698 CONECT 2681 2680 2682 2696 2697 CONECT 2682 2681 2683 2694 2695 CONECT 2683 2682 2684 2693 CONECT 2684 2683 2685 2692 CONECT 2685 2684 2686 2690 2691 CONECT 2686 2685 2687 2688 2689 CONECT 2687 2686 CONECT 2688 2686 CONECT 2689 2686 CONECT 2690 2685 CONECT 2691 2685 CONECT 2692 2684 CONECT 2693 2683 CONECT 2694 2682 CONECT 2695 2682 CONECT 2696 2681 CONECT 2697 2681 CONECT 2698 2680 CONECT 2699 2673 CONECT 2700 2672 CONECT 2701 2672 CONECT 2702 2666 CONECT 2703 2665 CONECT 2704 2663 CONECT 2705 2659 CONECT 2706 2658 CONECT 2707 2657 2708 2726 CONECT 2708 2707 2709 2713 CONECT 2709 2708 2710 2718 CONECT 2710 2709 2711 2717 CONECT 2711 2710 2712 2716 CONECT 2712 2711 2713 2715 CONECT 2713 2708 2712 2714 CONECT 2714 2713 CONECT 2715 2712 CONECT 2716 2711 CONECT 2717 2710 CONECT 2718 2709 2719 2725 CONECT 2719 2718 2720 2724 CONECT 2720 2719 2721 2722 2723 CONECT 2721 2720 CONECT 2722 2720 CONECT 2723 2720 CONECT 2724 2719 CONECT 2725 2718 CONECT 2726 2707 MASTER 0 0 0 0 0 0 0 0 2723 3 82 21 END
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Structure:
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6gcr
RCSB PDB
PDBbind
EUW
Entry Information
PDB ID
6gcx
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Focal adhesion kinase 1
Ligand Name
EUW
EC.Number
E.C.2.7.10.2
Resolution
1.55(Å)
Affinity (Kd/Ki/IC50)
IC50=0.6nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Acs Chem.Biol. Vol. 13: pp. 2067-2073
Ligand Properties
Formula
C
2
8
H
2
9
ClN
8
O
4
Molecular Weight
577.034
Exact Mass
576.200
No. of atoms
70
No. of bonds
73
Polar Surface Area
166.24
LOGP Value
3.73 (
Computed with XLOGP3
)
4.26 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 6
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 4
Canonical SMILES
CCC(=O)NCCNC1=C(C(=O)C1=O)NCc1ccc(cc1)Nc1ncc(c(n1)Nc1ccccc1C(=O)NC)Cl
InChI String
InChI=1S/C28H29ClN8O4/c1-3-21(38)31-12-13-32-22-23(25(40)24(22)39)33-14-16-8-10-17(11-9-16)35-28-34-15-19(29)26(37-28)36-20-7-5-4-6-18(20)27(41)30-2/h4-11,15,32-33H,3,12-14H2,1-2H3,(H,30,41)(H,31,38)(H2,34,35,36,37)
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):
Q00944
Entrez Gene ID
NCBI Entrez Gene ID:
396416
ASD
Information of known allosteric effects of PDB entries
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