Browse entries in the PDBbind-CN Database
HEADER 5TOB_COMPLEX COMPND 5TOB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 26 ILE ALA ARG GLU ASP VAL VAL LEU ASN ARG ILE LEU GLY SEQRES 2 A 26 GLU GLY PHE PHE GLY GLU VAL TYR GLU GLY VAL TYR THR SEQRES 1 A 14 HIS LYS GLY GLU LYS ILE ASN VAL ALA VAL LYS THR CYS SEQRES 2 A 14 LYS SEQRES 1 A 29 ASP ASN LYS GLU LYS PHE MET SER GLU ALA VAL ILE MET SEQRES 2 A 29 LYS ASN LEU ASP HIS PRO HIS ILE VAL LYS LEU ILE GLY SEQRES 3 A 29 ILE ILE GLU SEQRES 1 A 73 PRO THR TRP ILE ILE MET GLU LEU TYR PRO TYR GLY GLU SEQRES 2 A 73 LEU GLY HIS TYR LEU GLU ARG ASN LYS ASN SER LEU LYS SEQRES 3 A 73 VAL LEU THR LEU VAL LEU TYR SER LEU GLN ILE CYS LYS SEQRES 4 A 73 ALA MET ALA TYR LEU GLU SER ILE ASN CYS VAL HIS ARG SEQRES 5 A 73 ASP ILE ALA VAL ARG ASN ILE LEU VAL ALA SER PRO GLU SEQRES 6 A 73 CYS VAL LYS LEU GLY ASP PHE GLY SEQRES 1 A 103 PRO ILE LYS TRP MET SER PRO GLU SER ILE ASN PHE ARG SEQRES 2 A 103 ARG PHE THR THR ALA SER ASP VAL TRP MET PHE ALA VAL SEQRES 3 A 103 CYS MET TRP GLU ILE LEU SER PHE GLY LYS GLN PRO PHE SEQRES 4 A 103 PHE TRP LEU GLU ASN LYS ASP VAL ILE GLY VAL LEU GLU SEQRES 5 A 103 LYS GLY ASP ARG LEU PRO LYS PRO ASP LEU CYS PRO PRO SEQRES 6 A 103 VAL LEU TYR THR LEU MET THR ARG CYS TRP ASP TYR ASP SEQRES 7 A 103 PRO SER ASP ARG PRO ARG PHE THR GLU LEU VAL CYS SER SEQRES 8 A 103 LEU SER ASP VAL TYR GLN MET GLU LYS ASP ILE ALA HET YAM A 368 55 ATOM 1 N ILE A 420 21.828 -15.208 40.649 1.00 36.44 N ATOM 2 CA ILE A 420 20.607 -15.843 41.121 1.00 35.44 C ATOM 3 C ILE A 420 20.579 -17.291 40.645 1.00 35.95 C ATOM 4 O ILE A 420 20.697 -17.570 39.450 1.00 30.71 O ATOM 5 CB ILE A 420 19.354 -15.062 40.655 1.00 44.86 C ATOM 6 HN3 ILE A 420 21.852 -15.235 39.610 1.00 0.00 H ATOM 7 HN2 ILE A 420 22.651 -15.717 41.029 1.00 0.00 H ATOM 8 HN1 ILE A 420 21.851 -14.220 40.972 1.00 0.00 H ATOM 9 N ALA A 421 20.443 -18.215 41.592 1.00 28.56 N ATOM 10 CA ALA A 421 20.451 -19.640 41.306 1.00 44.64 C ATOM 11 C ALA A 421 19.054 -20.210 41.503 1.00 30.02 C ATOM 12 O ALA A 421 18.349 -19.829 42.443 1.00 37.54 O ATOM 13 CB ALA A 421 21.461 -20.370 42.202 1.00 49.74 C ATOM 14 H ALA A 421 20.326 -17.905 42.578 1.00 0.00 H ATOM 15 N ARG A 422 18.658 -21.124 40.612 1.00 32.66 N ATOM 16 CA ARG A 422 17.299 -21.669 40.651 1.00 38.46 C ATOM 17 C ARG A 422 17.003 -22.369 41.970 1.00 49.01 C ATOM 18 O ARG A 422 15.849 -22.383 42.416 1.00 32.55 O ATOM 19 CB ARG A 422 17.070 -22.633 39.484 1.00 28.70 C ATOM 20 H ARG A 422 19.323 -21.452 39.882 1.00 0.00 H ATOM 21 N GLU A 423 18.026 -22.937 42.617 1.00 33.87 N ATOM 22 CA GLU A 423 17.826 -23.553 43.922 1.00 24.29 C ATOM 23 C GLU A 423 17.394 -22.539 44.969 1.00 23.68 C ATOM 24 O GLU A 423 16.869 -22.921 46.021 1.00 33.80 O ATOM 25 CB GLU A 423 19.115 -24.262 44.370 1.00 44.27 C ATOM 26 H GLU A 423 18.972 -22.939 42.185 1.00 0.00 H ATOM 27 N ASP A 424 17.588 -21.254 44.709 1.00 32.71 N ATOM 28 CA ASP A 424 17.207 -20.229 45.666 1.00 26.53 C ATOM 29 C ASP A 424 15.767 -19.769 45.489 1.00 24.93 C ATOM 30 O ASP A 424 15.326 -18.896 46.240 1.00 21.99 O ATOM 31 CB ASP A 424 18.166 -19.031 45.574 1.00 27.66 C ATOM 32 CG ASP A 424 19.603 -19.389 45.993 1.00 52.77 C ATOM 33 OD1 ASP A 424 19.782 -20.283 46.855 1.00 38.36 O ATOM 34 OD2 ASP A 424 20.557 -18.781 45.451 1.00 66.79 O ATOM 35 H ASP A 424 18.020 -20.975 43.805 1.00 0.00 H ATOM 36 N VAL A 425 15.025 -20.369 44.557 1.00 19.28 N ATOM 37 CA VAL A 425 13.663 -19.969 44.206 1.00 20.38 C ATOM 38 C VAL A 425 12.772 -21.198 44.225 1.00 19.70 C ATOM 39 O VAL A 425 12.956 -22.123 43.427 1.00 19.55 O ATOM 40 CB VAL A 425 13.596 -19.288 42.828 1.00 26.13 C ATOM 41 CG1 VAL A 425 12.156 -19.071 42.407 1.00 18.55 C ATOM 42 CG2 VAL A 425 14.336 -17.959 42.852 1.00 25.41 C ATOM 43 H VAL A 425 15.442 -21.174 44.047 1.00 0.00 H ATOM 44 N VAL A 426 11.781 -21.191 45.102 1.00 22.60 N ATOM 45 CA VAL A 426 10.794 -22.257 45.184 1.00 32.11 C ATOM 46 C VAL A 426 9.483 -21.750 44.590 1.00 21.47 C ATOM 47 O VAL A 426 9.022 -20.661 44.938 1.00 15.72 O ATOM 48 CB VAL A 426 10.625 -22.713 46.642 1.00 18.68 C ATOM 49 CG1 VAL A 426 9.334 -23.483 46.836 1.00 35.61 C ATOM 50 CG2 VAL A 426 11.847 -23.530 47.050 1.00 36.49 C ATOM 51 H VAL A 426 11.704 -20.390 45.760 1.00 0.00 H ATOM 52 N LEU A 427 8.891 -22.531 43.695 1.00 12.20 N ATOM 53 CA LEU A 427 7.598 -22.194 43.103 1.00 19.15 C ATOM 54 C LEU A 427 6.478 -22.752 43.971 1.00 24.21 C ATOM 55 O LEU A 427 6.512 -23.929 44.348 1.00 23.17 O ATOM 56 CB LEU A 427 7.507 -22.774 41.695 1.00 22.26 C ATOM 57 CG LEU A 427 8.712 -22.383 40.851 1.00 25.10 C ATOM 58 CD1 LEU A 427 8.687 -23.062 39.503 1.00 20.79 C ATOM 59 CD2 LEU A 427 8.714 -20.861 40.702 1.00 18.21 C ATOM 60 H LEU A 427 9.363 -23.412 43.405 1.00 0.00 H ATOM 61 N ASN A 428 5.486 -21.921 44.279 1.00 14.66 N ATOM 62 CA ASN A 428 4.401 -22.319 45.168 1.00 23.55 C ATOM 63 C ASN A 428 3.064 -22.525 44.475 1.00 25.92 C ATOM 64 O ASN A 428 2.321 -23.407 44.888 1.00 24.12 O ATOM 65 CB ASN A 428 4.216 -21.298 46.300 1.00 15.66 C ATOM 66 CG ASN A 428 5.330 -21.350 47.326 1.00 34.28 C ATOM 67 OD1 ASN A 428 6.150 -22.277 47.335 1.00 32.67 O ATOM 68 ND2 ASN A 428 5.373 -20.346 48.202 1.00 40.98 N ATOM 69 HD22 ASN A 428 4.663 -19.587 48.158 1.00 0.00 H ATOM 70 HD21 ASN A 428 6.116 -20.322 48.929 1.00 0.00 H ATOM 71 H ASN A 428 5.484 -20.963 43.875 1.00 0.00 H ATOM 72 N ARG A 429 2.746 -21.760 43.425 1.00 22.96 N ATOM 73 CA ARG A 429 1.405 -21.731 42.840 1.00 17.97 C ATOM 74 C ARG A 429 1.464 -20.940 41.526 1.00 13.12 C ATOM 75 O ARG A 429 2.331 -20.089 41.355 1.00 14.49 O ATOM 76 CB ARG A 429 0.437 -21.127 43.863 1.00 29.35 C ATOM 77 CG ARG A 429 -1.026 -21.202 43.500 1.00 32.10 C ATOM 78 CD ARG A 429 -1.346 -22.612 43.100 1.00 54.51 C ATOM 79 NE ARG A 429 -1.871 -22.678 41.717 1.00 50.62 N ATOM 80 CZ ARG A 429 -1.827 -23.751 40.944 1.00 40.57 C ATOM 81 NH1 ARG A 429 -1.188 -24.836 41.364 1.00 52.83 N ATOM 82 NH2 ARG A 429 -2.349 -23.747 39.754 1.00 64.42 N ATOM 83 HE ARG A 429 -2.306 -21.819 41.325 1.00 0.00 H ATOM 84 HH12 ARG A 429 -1.150 -25.683 40.761 1.00 0.00 H ATOM 85 HH11 ARG A 429 -0.726 -24.839 42.296 1.00 0.00 H ATOM 86 HH22 ARG A 429 -2.303 -24.602 39.163 1.00 0.00 H ATOM 87 HH21 ARG A 429 -2.813 -22.889 39.392 1.00 0.00 H ATOM 88 H ARG A 429 3.484 -21.159 43.006 1.00 0.00 H ATOM 89 N ILE A 430 0.563 -21.257 40.586 1.00 19.29 N ATOM 90 CA ILE A 430 0.388 -20.461 39.364 1.00 21.37 C ATOM 91 C ILE A 430 -0.156 -19.101 39.746 1.00 16.36 C ATOM 92 O ILE A 430 -1.066 -18.994 40.576 1.00 16.36 O ATOM 93 CB ILE A 430 -0.569 -21.155 38.375 1.00 26.04 C ATOM 94 CG1 ILE A 430 0.134 -22.267 37.601 1.00 24.68 C ATOM 95 CG2 ILE A 430 -1.220 -20.142 37.370 1.00 15.56 C ATOM 96 CD1 ILE A 430 -0.830 -23.226 36.975 1.00 26.56 C ATOM 97 H ILE A 430 -0.034 -22.097 40.727 1.00 0.00 H ATOM 98 N LEU A 431 0.425 -18.057 39.186 1.00 16.84 N ATOM 99 CA LEU A 431 -0.176 -16.745 39.346 1.00 13.46 C ATOM 100 C LEU A 431 -1.118 -16.485 38.187 1.00 19.56 C ATOM 101 O LEU A 431 -2.211 -15.960 38.390 1.00 16.80 O ATOM 102 CB LEU A 431 0.913 -15.680 39.441 1.00 14.83 C ATOM 103 CG LEU A 431 0.557 -14.208 39.693 1.00 21.22 C ATOM 104 CD1 LEU A 431 -0.468 -14.082 40.792 1.00 16.91 C ATOM 105 CD2 LEU A 431 1.835 -13.445 40.047 1.00 12.29 C ATOM 106 H LEU A 431 1.301 -18.172 38.638 1.00 0.00 H ATOM 107 N GLY A 432 -0.714 -16.890 36.992 1.00 13.84 N ATOM 108 CA GLY A 432 -1.589 -16.872 35.842 1.00 27.75 C ATOM 109 C GLY A 432 -0.777 -16.953 34.565 1.00 24.75 C ATOM 110 O GLY A 432 0.382 -17.374 34.555 1.00 19.67 O ATOM 111 H GLY A 432 0.262 -17.231 36.878 1.00 0.00 H ATOM 112 N GLU A 433 -1.409 -16.522 33.490 1.00 25.34 N ATOM 113 CA GLU A 433 -0.877 -16.724 32.153 1.00 28.32 C ATOM 114 C GLU A 433 -0.401 -15.404 31.553 1.00 29.31 C ATOM 115 O GLU A 433 -1.205 -14.489 31.338 1.00 31.39 O ATOM 116 CB GLU A 433 -1.951 -17.390 31.297 1.00 41.16 C ATOM 117 CG GLU A 433 -1.585 -17.681 29.862 1.00 38.84 C ATOM 118 CD GLU A 433 -0.099 -17.959 29.648 1.00 55.85 C ATOM 119 OE1 GLU A 433 0.522 -18.722 30.395 1.00 49.88 O ATOM 120 OE2 GLU A 433 0.429 -17.377 28.659 1.00 42.89 O ATOM 121 H GLU A 433 -2.314 -16.023 33.603 1.00 0.00 H ATOM 122 N GLY A 434 0.913 -15.310 31.304 1.00 27.02 N ATOM 123 CA GLY A 434 1.530 -14.110 30.776 1.00 29.36 C ATOM 124 C GLY A 434 1.681 -14.183 29.266 1.00 33.30 C ATOM 125 O GLY A 434 1.262 -15.136 28.621 1.00 28.41 O ATOM 126 H GLY A 434 1.516 -16.135 31.498 1.00 0.00 H ATOM 127 N PHE A 435 2.284 -13.142 28.689 1.00 36.79 N ATOM 128 CA PHE A 435 2.368 -13.100 27.228 1.00 37.96 C ATOM 129 C PHE A 435 3.185 -14.263 26.680 1.00 23.01 C ATOM 130 O PHE A 435 2.807 -14.874 25.677 1.00 30.97 O ATOM 131 CB PHE A 435 2.957 -11.772 26.755 1.00 33.07 C ATOM 132 H PHE A 435 2.686 -12.376 29.266 1.00 0.00 H ATOM 133 N PHE A 436 4.309 -14.586 27.327 1.00 26.03 N ATOM 134 CA PHE A 436 5.279 -15.546 26.812 1.00 25.89 C ATOM 135 C PHE A 436 5.177 -16.924 27.467 1.00 25.73 C ATOM 136 O PHE A 436 5.765 -17.883 26.954 1.00 22.53 O ATOM 137 CB PHE A 436 6.706 -15.013 27.005 1.00 29.75 C ATOM 138 CG PHE A 436 7.029 -13.801 26.182 1.00 33.10 C ATOM 139 CD1 PHE A 436 6.935 -12.526 26.729 1.00 25.69 C ATOM 140 CD2 PHE A 436 7.438 -13.933 24.863 1.00 27.66 C ATOM 141 CE1 PHE A 436 7.244 -11.413 25.960 1.00 40.79 C ATOM 142 CE2 PHE A 436 7.752 -12.821 24.092 1.00 30.71 C ATOM 143 CZ PHE A 436 7.654 -11.562 24.640 1.00 24.50 C ATOM 144 H PHE A 436 4.501 -14.131 28.242 1.00 0.00 H ATOM 145 N GLY A 437 4.452 -17.047 28.571 1.00 17.08 N ATOM 146 CA GLY A 437 4.450 -18.283 29.325 1.00 19.04 C ATOM 147 C GLY A 437 3.810 -18.042 30.672 1.00 23.99 C ATOM 148 O GLY A 437 3.318 -16.939 30.962 1.00 14.62 O ATOM 149 H GLY A 437 3.877 -16.245 28.899 1.00 0.00 H ATOM 150 N GLU A 438 3.844 -19.091 31.498 1.00 13.22 N ATOM 151 CA GLU A 438 3.208 -19.055 32.806 1.00 15.50 C ATOM 152 C GLU A 438 3.927 -18.093 33.747 1.00 11.65 C ATOM 153 O GLU A 438 5.137 -17.907 33.664 1.00 20.13 O ATOM 154 CB GLU A 438 3.209 -20.444 33.441 1.00 24.63 C ATOM 155 CG GLU A 438 2.009 -21.354 33.186 1.00 43.95 C ATOM 156 CD GLU A 438 0.646 -20.667 33.319 1.00 43.69 C ATOM 157 OE1 GLU A 438 0.038 -20.319 32.288 1.00 35.68 O ATOM 158 OE2 GLU A 438 0.175 -20.470 34.463 1.00 41.75 O ATOM 159 H GLU A 438 4.338 -19.956 31.198 1.00 0.00 H ATOM 160 N VAL A 439 3.161 -17.498 34.656 1.00 9.08 N ATOM 161 CA VAL A 439 3.690 -16.721 35.768 1.00 11.99 C ATOM 162 C VAL A 439 3.313 -17.440 37.054 1.00 11.11 C ATOM 163 O VAL A 439 2.146 -17.790 37.248 1.00 12.41 O ATOM 164 CB VAL A 439 3.168 -15.273 35.772 1.00 11.07 C ATOM 165 CG1 VAL A 439 3.924 -14.457 36.787 1.00 11.38 C ATOM 166 CG2 VAL A 439 3.316 -14.643 34.388 1.00 7.92 C ATOM 167 H VAL A 439 2.129 -17.592 34.568 1.00 0.00 H ATOM 168 N TYR A 440 4.310 -17.679 37.915 1.00 15.62 N ATOM 169 CA TYR A 440 4.158 -18.373 39.187 1.00 13.38 C ATOM 170 C TYR A 440 4.461 -17.405 40.324 1.00 14.47 C ATOM 171 O TYR A 440 5.191 -16.428 40.150 1.00 13.85 O ATOM 172 CB TYR A 440 5.097 -19.606 39.274 1.00 13.62 C ATOM 173 CG TYR A 440 4.937 -20.582 38.121 1.00 13.76 C ATOM 174 CD1 TYR A 440 5.680 -20.441 36.951 1.00 15.31 C ATOM 175 CD2 TYR A 440 4.026 -21.629 38.194 1.00 13.25 C ATOM 176 CE1 TYR A 440 5.508 -21.311 35.874 1.00 17.50 C ATOM 177 CE2 TYR A 440 3.840 -22.503 37.118 1.00 21.31 C ATOM 178 CZ TYR A 440 4.592 -22.344 35.961 1.00 20.66 C ATOM 179 OH TYR A 440 4.424 -23.208 34.893 1.00 16.79 O ATOM 180 HH TYR A 440 5.036 -22.948 34.160 1.00 0.00 H ATOM 181 H TYR A 440 5.261 -17.345 37.657 1.00 0.00 H ATOM 182 N GLU A 441 3.892 -17.669 41.495 1.00 11.09 N ATOM 183 CA GLU A 441 4.376 -17.036 42.707 1.00 18.29 C ATOM 184 C GLU A 441 5.240 -18.022 43.483 1.00 25.02 C ATOM 185 O GLU A 441 5.036 -19.240 43.434 1.00 16.06 O ATOM 186 CB GLU A 441 3.237 -16.493 43.587 1.00 15.60 C ATOM 187 CG GLU A 441 2.019 -17.348 43.716 1.00 23.78 C ATOM 188 CD GLU A 441 0.879 -16.630 44.447 1.00 50.20 C ATOM 189 OE1 GLU A 441 1.080 -16.154 45.597 1.00 41.78 O ATOM 190 OE2 GLU A 441 -0.220 -16.534 43.855 1.00 41.33 O ATOM 191 H GLU A 441 3.094 -18.334 41.543 1.00 0.00 H ATOM 192 N GLY A 442 6.238 -17.483 44.165 1.00 20.09 N ATOM 193 CA GLY A 442 7.068 -18.307 45.000 1.00 19.98 C ATOM 194 C GLY A 442 7.874 -17.454 45.943 1.00 20.75 C ATOM 195 O GLY A 442 7.590 -16.272 46.139 1.00 21.16 O ATOM 196 H GLY A 442 6.422 -16.462 44.097 1.00 0.00 H ATOM 197 N VAL A 443 8.899 -18.071 46.522 1.00 21.23 N ATOM 198 CA VAL A 443 9.755 -17.408 47.486 1.00 17.83 C ATOM 199 C VAL A 443 11.178 -17.525 46.987 1.00 23.34 C ATOM 200 O VAL A 443 11.563 -18.539 46.389 1.00 20.47 O ATOM 201 CB VAL A 443 9.623 -17.996 48.904 1.00 23.52 C ATOM 202 CG1 VAL A 443 10.394 -17.134 49.911 1.00 27.98 C ATOM 203 CG2 VAL A 443 8.180 -18.070 49.300 1.00 17.02 C ATOM 204 H VAL A 443 9.093 -19.062 46.275 1.00 0.00 H ATOM 205 N TYR A 444 11.942 -16.467 47.199 1.00 15.51 N ATOM 206 CA TYR A 444 13.358 -16.441 46.888 1.00 21.76 C ATOM 207 C TYR A 444 14.131 -16.161 48.171 1.00 20.36 C ATOM 208 O TYR A 444 13.768 -15.262 48.937 1.00 24.86 O ATOM 209 CB TYR A 444 13.643 -15.393 45.810 1.00 22.04 C ATOM 210 CG TYR A 444 15.069 -14.949 45.757 1.00 35.53 C ATOM 211 CD1 TYR A 444 16.093 -15.861 45.524 1.00 18.30 C ATOM 212 CD2 TYR A 444 15.402 -13.609 45.935 1.00 28.38 C ATOM 213 CE1 TYR A 444 17.430 -15.447 45.472 1.00 25.12 C ATOM 214 CE2 TYR A 444 16.722 -13.189 45.894 1.00 37.90 C ATOM 215 CZ TYR A 444 17.732 -14.112 45.664 1.00 33.01 C ATOM 216 OH TYR A 444 19.037 -13.679 45.614 1.00 43.43 O ATOM 217 HH TYR A 444 19.633 -14.451 45.444 1.00 0.00 H ATOM 218 H TYR A 444 11.508 -15.615 47.607 1.00 0.00 H ATOM 219 N THR A 445 15.171 -16.952 48.411 1.00 26.55 N ATOM 220 CA THR A 445 16.009 -16.843 49.613 1.00 26.12 C ATOM 221 C THR A 445 17.444 -16.468 49.250 1.00 25.45 C ATOM 222 O THR A 445 17.980 -16.963 48.250 1.00 18.42 O ATOM 223 CB THR A 445 16.047 -18.158 50.405 1.00 28.94 C ATOM 224 OG1 THR A 445 14.745 -18.460 50.910 1.00 30.01 O ATOM 225 CG2 THR A 445 17.037 -18.052 51.579 1.00 29.99 C ATOM 226 HG1 THR A 445 14.445 -17.728 51.506 1.00 0.00 H ATOM 227 H THR A 445 15.404 -17.686 47.712 1.00 0.00 H TER 228 THR A 445 ATOM 229 N HIS A 447 20.800 -14.601 49.585 1.00 43.61 N ATOM 230 CA HIS A 447 22.157 -14.911 50.053 1.00 49.23 C ATOM 231 C HIS A 447 22.367 -14.521 51.516 1.00 52.39 C ATOM 232 O HIS A 447 23.437 -14.759 52.080 1.00 48.90 O ATOM 233 CB HIS A 447 23.208 -14.218 49.183 1.00 42.76 C ATOM 234 CG HIS A 447 23.334 -14.803 47.810 1.00 55.15 C ATOM 235 ND1 HIS A 447 23.840 -16.066 47.582 1.00 63.10 N ATOM 236 CD2 HIS A 447 23.017 -14.298 46.593 1.00 55.28 C ATOM 237 CE1 HIS A 447 23.829 -16.314 46.282 1.00 68.27 C ATOM 238 NE2 HIS A 447 23.337 -15.256 45.660 1.00 65.22 N ATOM 239 HN3 HIS A 447 20.628 -13.579 49.675 1.00 0.00 H ATOM 240 HN2 HIS A 447 20.108 -15.122 50.161 1.00 0.00 H ATOM 241 HN1 HIS A 447 20.705 -14.883 48.588 1.00 0.00 H ATOM 242 N LYS A 448 21.343 -13.914 52.118 1.00 55.85 N ATOM 243 CA LYS A 448 21.328 -13.611 53.542 1.00 43.19 C ATOM 244 C LYS A 448 20.236 -14.370 54.286 1.00 53.52 C ATOM 245 O LYS A 448 20.026 -14.118 55.476 1.00 58.04 O ATOM 246 CB LYS A 448 21.163 -12.107 53.765 1.00 32.00 C ATOM 247 H LYS A 448 20.518 -13.645 51.544 1.00 0.00 H ATOM 248 N GLY A 449 19.528 -15.283 53.616 1.00 56.89 N ATOM 249 CA GLY A 449 18.472 -16.053 54.250 1.00 38.11 C ATOM 250 C GLY A 449 17.125 -15.363 54.350 1.00 53.07 C ATOM 251 O GLY A 449 16.216 -15.901 54.999 1.00 40.28 O ATOM 252 H GLY A 449 19.739 -15.447 52.611 1.00 0.00 H ATOM 253 N GLU A 450 16.960 -14.190 53.736 1.00 44.02 N ATOM 254 CA GLU A 450 15.673 -13.502 53.763 1.00 49.89 C ATOM 255 C GLU A 450 14.729 -14.134 52.750 1.00 43.05 C ATOM 256 O GLU A 450 15.081 -14.281 51.576 1.00 41.09 O ATOM 257 CB GLU A 450 15.845 -12.015 53.458 1.00 34.06 C ATOM 258 H GLU A 450 17.760 -13.759 53.231 1.00 0.00 H ATOM 259 N LYS A 451 13.533 -14.508 53.212 1.00 42.43 N ATOM 260 CA LYS A 451 12.494 -15.071 52.354 1.00 42.47 C ATOM 261 C LYS A 451 11.755 -13.943 51.638 1.00 37.98 C ATOM 262 O LYS A 451 11.104 -13.118 52.287 1.00 40.09 O ATOM 263 CB LYS A 451 11.523 -15.908 53.186 1.00 41.91 C ATOM 264 H LYS A 451 13.333 -14.393 54.226 1.00 0.00 H ATOM 265 N ILE A 452 11.839 -13.923 50.308 1.00 33.84 N ATOM 266 CA ILE A 452 11.332 -12.830 49.473 1.00 37.99 C ATOM 267 C ILE A 452 10.256 -13.389 48.550 1.00 20.30 C ATOM 268 O ILE A 452 10.526 -14.305 47.768 1.00 21.72 O ATOM 269 CB ILE A 452 12.462 -12.187 48.647 1.00 30.65 C ATOM 270 CG1 ILE A 452 13.559 -11.638 49.565 1.00 39.44 C ATOM 271 CG2 ILE A 452 11.910 -11.143 47.676 1.00 29.48 C ATOM 272 CD1 ILE A 452 14.926 -11.520 48.890 1.00 46.64 C ATOM 273 H ILE A 452 12.291 -14.731 49.834 1.00 0.00 H ATOM 274 N ASN A 453 9.061 -12.816 48.603 1.00 14.32 N ATOM 275 CA ASN A 453 7.954 -13.286 47.771 1.00 18.65 C ATOM 276 C ASN A 453 8.071 -12.724 46.359 1.00 21.55 C ATOM 277 O ASN A 453 8.108 -11.504 46.166 1.00 18.07 O ATOM 278 CB ASN A 453 6.623 -12.890 48.391 1.00 18.29 C ATOM 279 CG ASN A 453 6.213 -13.809 49.505 1.00 28.14 C ATOM 280 OD1 ASN A 453 6.470 -15.017 49.467 1.00 32.05 O ATOM 281 ND2 ASN A 453 5.576 -13.243 50.516 1.00 28.16 N ATOM 282 HD22 ASN A 453 5.383 -12.221 50.502 1.00 0.00 H ATOM 283 HD21 ASN A 453 5.268 -13.820 51.325 1.00 0.00 H ATOM 284 H ASN A 453 8.908 -12.016 49.250 1.00 0.00 H ATOM 285 N VAL A 454 8.096 -13.612 45.373 1.00 15.36 N ATOM 286 CA VAL A 454 8.433 -13.241 44.009 1.00 14.68 C ATOM 287 C VAL A 454 7.345 -13.755 43.074 1.00 19.51 C ATOM 288 O VAL A 454 6.613 -14.702 43.381 1.00 18.41 O ATOM 289 CB VAL A 454 9.801 -13.805 43.570 1.00 19.98 C ATOM 290 CG1 VAL A 454 10.971 -13.250 44.442 1.00 11.09 C ATOM 291 CG2 VAL A 454 9.762 -15.342 43.626 1.00 17.54 C ATOM 292 H VAL A 454 7.867 -14.605 45.583 1.00 0.00 H ATOM 293 N ALA A 455 7.249 -13.108 41.921 1.00 12.56 N ATOM 294 CA ALA A 455 6.544 -13.647 40.777 1.00 11.95 C ATOM 295 C ALA A 455 7.590 -14.101 39.779 1.00 12.91 C ATOM 296 O ALA A 455 8.534 -13.361 39.473 1.00 12.64 O ATOM 297 CB ALA A 455 5.603 -12.621 40.138 1.00 12.45 C ATOM 298 H ALA A 455 7.699 -12.174 41.835 1.00 0.00 H ATOM 299 N VAL A 456 7.426 -15.320 39.284 1.00 14.10 N ATOM 300 CA VAL A 456 8.389 -15.934 38.388 1.00 10.61 C ATOM 301 C VAL A 456 7.743 -16.005 37.016 1.00 14.63 C ATOM 302 O VAL A 456 6.789 -16.764 36.810 1.00 18.03 O ATOM 303 CB VAL A 456 8.800 -17.322 38.887 1.00 17.84 C ATOM 304 CG1 VAL A 456 9.992 -17.825 38.098 1.00 20.75 C ATOM 305 CG2 VAL A 456 9.077 -17.251 40.371 1.00 13.62 C ATOM 306 H VAL A 456 6.575 -15.857 39.548 1.00 0.00 H ATOM 307 N LYS A 457 8.243 -15.204 36.081 1.00 18.35 N ATOM 308 CA LYS A 457 7.762 -15.246 34.711 1.00 20.95 C ATOM 309 C LYS A 457 8.602 -16.251 33.941 1.00 16.25 C ATOM 310 O LYS A 457 9.822 -16.301 34.105 1.00 24.05 O ATOM 311 CB LYS A 457 7.864 -13.874 34.040 1.00 16.32 C ATOM 312 CG LYS A 457 7.290 -12.744 34.827 1.00 21.90 C ATOM 313 CD LYS A 457 7.761 -11.410 34.254 1.00 34.35 C ATOM 314 CE LYS A 457 7.312 -11.241 32.813 1.00 51.00 C ATOM 315 NZ LYS A 457 5.915 -10.751 32.752 1.00 34.88 N ATOM 316 HZ1 LYS A 457 5.288 -11.435 33.221 1.00 0.00 H ATOM 317 HZ2 LYS A 457 5.850 -9.832 33.234 1.00 0.00 H ATOM 318 HZ3 LYS A 457 5.630 -10.643 31.758 1.00 0.00 H ATOM 319 H LYS A 457 8.995 -14.532 36.336 1.00 0.00 H ATOM 320 N THR A 458 7.951 -17.038 33.094 1.00 16.29 N ATOM 321 CA THR A 458 8.643 -18.039 32.293 1.00 19.11 C ATOM 322 C THR A 458 8.256 -17.875 30.831 1.00 19.32 C ATOM 323 O THR A 458 7.386 -17.069 30.469 1.00 22.16 O ATOM 324 CB THR A 458 8.314 -19.469 32.739 1.00 16.30 C ATOM 325 OG1 THR A 458 7.018 -19.812 32.245 1.00 20.64 O ATOM 326 CG2 THR A 458 8.318 -19.588 34.253 1.00 19.90 C ATOM 327 HG1 THR A 458 6.792 -20.734 32.526 1.00 0.00 H ATOM 328 H THR A 458 6.920 -16.938 32.999 1.00 0.00 H ATOM 329 N CYS A 459 8.882 -18.705 30.006 1.00 22.96 N ATOM 330 CA CYS A 459 8.764 -18.674 28.557 1.00 26.11 C ATOM 331 C CYS A 459 8.687 -20.108 28.063 1.00 26.69 C ATOM 332 O CYS A 459 9.523 -20.933 28.434 1.00 38.45 O ATOM 333 CB CYS A 459 9.964 -17.965 27.935 1.00 33.16 C ATOM 334 SG CYS A 459 9.805 -17.505 26.205 1.00 39.53 S ATOM 335 H CYS A 459 9.500 -19.428 30.425 1.00 0.00 H ATOM 336 N LYS A 460 7.681 -20.405 27.251 1.00 36.59 N ATOM 337 CA LYS A 460 7.521 -21.733 26.653 1.00 39.18 C ATOM 338 C LYS A 460 8.731 -22.165 25.817 1.00 25.33 C ATOM 339 O LYS A 460 9.498 -21.331 25.331 1.00 34.81 O ATOM 340 CB LYS A 460 6.266 -21.757 25.789 1.00 26.26 C ATOM 341 CG LYS A 460 4.997 -21.584 26.563 1.00 22.29 C ATOM 342 CD LYS A 460 3.822 -21.674 25.605 1.00 29.88 C ATOM 343 CE LYS A 460 2.489 -21.856 26.324 1.00 39.42 C ATOM 344 NZ LYS A 460 1.388 -22.154 25.348 1.00 43.61 N ATOM 345 HZ1 LYS A 460 1.300 -21.366 24.675 1.00 0.00 H ATOM 346 HZ2 LYS A 460 1.611 -23.029 24.832 1.00 0.00 H ATOM 347 HZ3 LYS A 460 0.493 -22.273 25.863 1.00 0.00 H ATOM 348 H LYS A 460 6.980 -19.669 27.031 1.00 0.00 H TER 349 LYS A 460 ATOM 350 N ASP A 466 13.090 -15.509 18.444 1.00 29.60 N ATOM 351 CA ASP A 466 12.599 -14.146 18.229 1.00 41.99 C ATOM 352 C ASP A 466 11.682 -13.726 19.367 1.00 51.22 C ATOM 353 O ASP A 466 11.639 -12.557 19.760 1.00 35.99 O ATOM 354 CB ASP A 466 11.859 -14.029 16.894 1.00 30.59 C ATOM 355 HN3 ASP A 466 12.283 -16.164 18.488 1.00 0.00 H ATOM 356 HN2 ASP A 466 13.620 -15.548 19.338 1.00 0.00 H ATOM 357 HN1 ASP A 466 13.715 -15.779 17.658 1.00 0.00 H ATOM 358 N ASN A 467 10.922 -14.683 19.890 1.00 46.52 N ATOM 359 CA ASN A 467 10.134 -14.381 21.072 1.00 37.91 C ATOM 360 C ASN A 467 10.892 -14.691 22.348 1.00 30.44 C ATOM 361 O ASN A 467 10.669 -14.022 23.362 1.00 36.72 O ATOM 362 CB ASN A 467 8.789 -15.112 21.024 1.00 38.11 C ATOM 363 CG ASN A 467 7.733 -14.337 20.228 1.00 49.03 C ATOM 364 OD1 ASN A 467 7.810 -13.106 20.090 1.00 35.36 O ATOM 365 ND2 ASN A 467 6.735 -15.050 19.720 1.00 42.42 N ATOM 366 HD22 ASN A 467 6.709 -16.080 19.859 1.00 0.00 H ATOM 367 HD21 ASN A 467 5.980 -14.578 19.183 1.00 0.00 H ATOM 368 H ASN A 467 10.892 -15.630 19.461 1.00 0.00 H ATOM 369 N LYS A 468 11.808 -15.665 22.313 1.00 32.39 N ATOM 370 CA LYS A 468 12.719 -15.861 23.436 1.00 35.42 C ATOM 371 C LYS A 468 13.632 -14.651 23.612 1.00 42.08 C ATOM 372 O LYS A 468 13.779 -14.123 24.719 1.00 33.76 O ATOM 373 CB LYS A 468 13.547 -17.129 23.232 1.00 34.11 C ATOM 374 H LYS A 468 11.871 -16.286 21.481 1.00 0.00 H ATOM 375 N GLU A 469 14.260 -14.201 22.524 1.00 36.72 N ATOM 376 CA GLU A 469 15.123 -13.031 22.613 1.00 48.82 C ATOM 377 C GLU A 469 14.335 -11.803 23.073 1.00 42.01 C ATOM 378 O GLU A 469 14.781 -11.076 23.967 1.00 26.27 O ATOM 379 CB GLU A 469 15.816 -12.784 21.268 1.00 39.66 C ATOM 380 H GLU A 469 14.133 -14.686 21.613 1.00 0.00 H ATOM 381 N LYS A 470 13.135 -11.590 22.516 1.00 38.02 N ATOM 382 CA LYS A 470 12.292 -10.483 22.971 1.00 30.63 C ATOM 383 C LYS A 470 11.911 -10.630 24.448 1.00 34.38 C ATOM 384 O LYS A 470 11.979 -9.658 25.214 1.00 28.03 O ATOM 385 CB LYS A 470 11.043 -10.388 22.097 1.00 39.75 C ATOM 386 CG LYS A 470 10.270 -9.100 22.255 1.00 31.48 C ATOM 387 CD LYS A 470 9.051 -9.120 21.360 1.00 51.50 C ATOM 388 CE LYS A 470 7.913 -8.258 21.913 1.00 51.93 C ATOM 389 NZ LYS A 470 6.702 -8.356 21.032 1.00 41.21 N ATOM 390 HZ1 LYS A 470 6.943 -8.025 20.076 1.00 0.00 H ATOM 391 HZ2 LYS A 470 6.386 -9.346 20.988 1.00 0.00 H ATOM 392 HZ3 LYS A 470 5.941 -7.765 21.423 1.00 0.00 H ATOM 393 H LYS A 470 12.800 -12.215 21.755 1.00 0.00 H ATOM 394 N PHE A 471 11.513 -11.835 24.868 1.00 22.26 N ATOM 395 CA PHE A 471 11.337 -12.114 26.294 1.00 26.81 C ATOM 396 C PHE A 471 12.533 -11.622 27.101 1.00 27.86 C ATOM 397 O PHE A 471 12.370 -10.955 28.131 1.00 32.25 O ATOM 398 CB PHE A 471 11.134 -13.621 26.512 1.00 20.60 C ATOM 399 CG PHE A 471 10.932 -14.033 27.964 1.00 18.48 C ATOM 400 CD1 PHE A 471 9.773 -13.693 28.643 1.00 29.53 C ATOM 401 CD2 PHE A 471 11.874 -14.814 28.622 1.00 36.54 C ATOM 402 CE1 PHE A 471 9.562 -14.100 29.955 1.00 20.34 C ATOM 403 CE2 PHE A 471 11.677 -15.223 29.943 1.00 35.66 C ATOM 404 CZ PHE A 471 10.510 -14.865 30.607 1.00 22.85 C ATOM 405 H PHE A 471 11.326 -12.585 24.172 1.00 0.00 H ATOM 406 N MET A 472 13.745 -11.931 26.637 1.00 26.73 N ATOM 407 CA MET A 472 14.948 -11.536 27.359 1.00 26.47 C ATOM 408 C MET A 472 15.172 -10.028 27.307 1.00 24.85 C ATOM 409 O MET A 472 15.628 -9.441 28.292 1.00 27.48 O ATOM 410 CB MET A 472 16.153 -12.281 26.787 1.00 34.66 C ATOM 411 CG MET A 472 17.452 -12.054 27.538 1.00 55.04 C ATOM 412 SD MET A 472 17.327 -12.473 29.295 1.00 63.28 S ATOM 413 CE MET A 472 16.763 -14.149 29.187 1.00 36.54 C ATOM 414 H MET A 472 13.833 -12.462 25.747 1.00 0.00 H ATOM 415 N SER A 473 14.845 -9.391 26.180 1.00 31.20 N ATOM 416 CA SER A 473 15.048 -7.955 26.022 1.00 35.13 C ATOM 417 C SER A 473 14.266 -7.161 27.063 1.00 35.98 C ATOM 418 O SER A 473 14.822 -6.283 27.734 1.00 38.11 O ATOM 419 CB SER A 473 14.629 -7.527 24.621 1.00 34.80 C ATOM 420 OG SER A 473 13.216 -7.570 24.490 1.00 41.74 O ATOM 421 HG SER A 473 12.899 -8.493 24.653 1.00 0.00 H ATOM 422 H SER A 473 14.434 -9.933 25.393 1.00 0.00 H ATOM 423 N GLU A 474 12.963 -7.440 27.190 1.00 29.39 N ATOM 424 CA GLU A 474 12.152 -6.760 28.197 1.00 34.46 C ATOM 425 C GLU A 474 12.675 -7.023 29.610 1.00 22.00 C ATOM 426 O GLU A 474 12.648 -6.125 30.459 1.00 24.45 O ATOM 427 CB GLU A 474 10.682 -7.185 28.061 1.00 28.22 C ATOM 428 H GLU A 474 12.524 -8.147 26.566 1.00 0.00 H ATOM 429 N ALA A 475 13.189 -8.224 29.868 1.00 23.00 N ATOM 430 CA ALA A 475 13.772 -8.519 31.176 1.00 28.50 C ATOM 431 C ALA A 475 14.990 -7.652 31.452 1.00 19.37 C ATOM 432 O ALA A 475 15.130 -7.101 32.544 1.00 19.92 O ATOM 433 CB ALA A 475 14.160 -9.991 31.275 1.00 18.87 C ATOM 434 H ALA A 475 13.176 -8.959 29.132 1.00 0.00 H ATOM 435 N VAL A 476 15.896 -7.545 30.476 1.00 18.35 N ATOM 436 CA VAL A 476 17.084 -6.716 30.652 1.00 20.53 C ATOM 437 C VAL A 476 16.683 -5.266 30.861 1.00 18.72 C ATOM 438 O VAL A 476 17.233 -4.573 31.727 1.00 10.80 O ATOM 439 CB VAL A 476 18.032 -6.872 29.449 1.00 24.03 C ATOM 440 CG1 VAL A 476 19.277 -6.009 29.627 1.00 24.89 C ATOM 441 CG2 VAL A 476 18.424 -8.332 29.285 1.00 32.93 C ATOM 442 H VAL A 476 15.753 -8.057 29.582 1.00 0.00 H ATOM 443 N ILE A 477 15.710 -4.789 30.082 1.00 16.21 N ATOM 444 CA ILE A 477 15.209 -3.434 30.291 1.00 18.29 C ATOM 445 C ILE A 477 14.707 -3.275 31.719 1.00 19.44 C ATOM 446 O ILE A 477 15.109 -2.349 32.430 1.00 15.11 O ATOM 447 CB ILE A 477 14.126 -3.086 29.253 1.00 25.93 C ATOM 448 CG1 ILE A 477 14.770 -2.933 27.881 1.00 35.03 C ATOM 449 CG2 ILE A 477 13.394 -1.789 29.627 1.00 22.98 C ATOM 450 CD1 ILE A 477 13.761 -2.743 26.747 1.00 41.19 C ATOM 451 H ILE A 477 15.309 -5.382 29.327 1.00 0.00 H ATOM 452 N MET A 478 13.850 -4.202 32.178 1.00 14.00 N ATOM 453 CA MET A 478 13.317 -4.075 33.528 1.00 18.88 C ATOM 454 C MET A 478 14.430 -4.147 34.569 1.00 18.77 C ATOM 455 O MET A 478 14.325 -3.537 35.636 1.00 10.15 O ATOM 456 CB MET A 478 12.264 -5.157 33.779 1.00 15.35 C ATOM 457 CG MET A 478 11.021 -5.037 32.902 1.00 28.31 C ATOM 458 SD MET A 478 10.073 -3.535 33.247 1.00 37.05 S ATOM 459 CE MET A 478 10.143 -3.600 35.042 1.00 21.68 C ATOM 460 H MET A 478 13.570 -5.002 31.576 1.00 0.00 H ATOM 461 N LYS A 479 15.494 -4.892 34.278 1.00 14.63 N ATOM 462 CA LYS A 479 16.601 -5.005 35.225 1.00 27.41 C ATOM 463 C LYS A 479 17.327 -3.679 35.370 1.00 17.92 C ATOM 464 O LYS A 479 17.863 -3.363 36.437 1.00 20.67 O ATOM 465 CB LYS A 479 17.578 -6.090 34.766 1.00 13.40 C ATOM 466 CG LYS A 479 18.918 -6.061 35.505 1.00 22.08 C ATOM 467 CD LYS A 479 19.878 -7.142 34.996 1.00 42.09 C ATOM 468 CE LYS A 479 21.140 -7.194 35.846 1.00 44.84 C ATOM 469 NZ LYS A 479 21.978 -8.395 35.536 1.00 41.20 N ATOM 470 HZ1 LYS A 479 21.427 -9.258 35.720 1.00 0.00 H ATOM 471 HZ2 LYS A 479 22.261 -8.370 34.536 1.00 0.00 H ATOM 472 HZ3 LYS A 479 22.826 -8.389 36.138 1.00 0.00 H ATOM 473 H LYS A 479 15.538 -5.397 33.370 1.00 0.00 H ATOM 474 N ASN A 480 17.342 -2.895 34.317 1.00 25.41 N ATOM 475 CA ASN A 480 18.005 -1.610 34.354 1.00 30.38 C ATOM 476 C ASN A 480 17.114 -0.501 34.883 1.00 22.16 C ATOM 477 O ASN A 480 17.623 0.464 35.455 1.00 23.24 O ATOM 478 CB ASN A 480 18.538 -1.302 32.960 1.00 15.45 C ATOM 479 CG ASN A 480 19.771 -2.127 32.648 1.00 17.61 C ATOM 480 OD1 ASN A 480 20.867 -1.841 33.149 1.00 19.77 O ATOM 481 ND2 ASN A 480 19.605 -3.151 31.849 1.00 14.07 N ATOM 482 HD22 ASN A 480 18.666 -3.353 31.451 1.00 0.00 H ATOM 483 HD21 ASN A 480 20.413 -3.762 31.612 1.00 0.00 H ATOM 484 H ASN A 480 16.870 -3.203 33.443 1.00 0.00 H ATOM 485 N LEU A 481 15.801 -0.616 34.719 1.00 21.82 N ATOM 486 CA LEU A 481 14.900 0.376 35.283 1.00 17.64 C ATOM 487 C LEU A 481 14.969 0.280 36.796 1.00 34.88 C ATOM 488 O LEU A 481 14.986 -0.822 37.358 1.00 23.32 O ATOM 489 CB LEU A 481 13.471 0.145 34.790 1.00 21.52 C ATOM 490 CG LEU A 481 13.185 0.319 33.291 1.00 17.68 C ATOM 491 CD1 LEU A 481 11.731 -0.039 33.008 1.00 16.45 C ATOM 492 CD2 LEU A 481 13.474 1.744 32.813 1.00 18.59 C ATOM 493 H LEU A 481 15.415 -1.420 34.184 1.00 0.00 H ATOM 494 N ASP A 482 15.060 1.423 37.471 1.00 18.65 N ATOM 495 CA ASP A 482 15.165 1.398 38.925 1.00 28.33 C ATOM 496 C ASP A 482 14.302 2.540 39.454 1.00 20.72 C ATOM 497 O ASP A 482 14.800 3.596 39.844 1.00 31.94 O ATOM 498 CB ASP A 482 16.627 1.513 39.386 1.00 22.01 C ATOM 499 CG ASP A 482 16.803 1.166 40.857 1.00 46.07 C ATOM 500 OD1 ASP A 482 15.783 0.996 41.566 1.00 47.21 O ATOM 501 OD2 ASP A 482 17.963 1.068 41.308 1.00 48.27 O ATOM 502 H ASP A 482 15.056 2.331 36.963 1.00 0.00 H ATOM 503 N HIS A 483 12.985 2.334 39.446 1.00 26.96 N ATOM 504 CA HIS A 483 12.077 3.430 39.737 1.00 13.99 C ATOM 505 C HIS A 483 11.037 3.014 40.772 1.00 17.67 C ATOM 506 O HIS A 483 10.521 1.894 40.711 1.00 21.51 O ATOM 507 CB HIS A 483 11.393 3.907 38.452 1.00 15.00 C ATOM 508 CG HIS A 483 10.695 5.214 38.606 1.00 9.81 C ATOM 509 ND1 HIS A 483 9.401 5.312 39.062 1.00 14.89 N ATOM 510 CD2 HIS A 483 11.133 6.487 38.442 1.00 21.09 C ATOM 511 CE1 HIS A 483 9.055 6.588 39.135 1.00 17.93 C ATOM 512 NE2 HIS A 483 10.098 7.321 38.783 1.00 19.43 N ATOM 513 H HIS A 483 12.608 1.389 39.231 1.00 0.00 H ATOM 514 N PRO A 484 10.705 3.896 41.723 1.00 20.48 N ATOM 515 CA PRO A 484 9.757 3.513 42.783 1.00 20.85 C ATOM 516 C PRO A 484 8.383 3.124 42.274 1.00 16.37 C ATOM 517 O PRO A 484 7.650 2.436 42.991 1.00 17.43 O ATOM 518 CB PRO A 484 9.657 4.779 43.655 1.00 14.33 C ATOM 519 CG PRO A 484 10.753 5.634 43.259 1.00 29.83 C ATOM 520 CD PRO A 484 11.180 5.282 41.884 1.00 26.65 C ATOM 521 N HIS A 485 7.983 3.560 41.087 1.00 9.45 N ATOM 522 CA HIS A 485 6.640 3.267 40.611 1.00 10.80 C ATOM 523 C HIS A 485 6.664 2.398 39.356 1.00 7.69 C ATOM 524 O HIS A 485 5.760 2.448 38.539 1.00 9.09 O ATOM 525 CB HIS A 485 5.879 4.583 40.431 1.00 10.80 C ATOM 526 CG HIS A 485 5.847 5.389 41.696 1.00 10.28 C ATOM 527 ND1 HIS A 485 5.321 4.892 42.872 1.00 8.66 N ATOM 528 CD2 HIS A 485 6.333 6.620 41.991 1.00 16.68 C ATOM 529 CE1 HIS A 485 5.480 5.781 43.836 1.00 11.88 C ATOM 530 NE2 HIS A 485 6.071 6.847 43.322 1.00 17.10 N ATOM 531 H HIS A 485 8.633 4.114 40.494 1.00 0.00 H ATOM 532 N ILE A 486 7.697 1.571 39.209 1.00 12.13 N ATOM 533 CA ILE A 486 7.741 0.513 38.211 1.00 6.00 C ATOM 534 C ILE A 486 8.118 -0.762 38.943 1.00 9.11 C ATOM 535 O ILE A 486 9.005 -0.741 39.806 1.00 8.63 O ATOM 536 CB ILE A 486 8.751 0.815 37.070 1.00 12.81 C ATOM 537 CG1 ILE A 486 8.358 2.070 36.296 1.00 6.86 C ATOM 538 CG2 ILE A 486 8.881 -0.373 36.114 1.00 14.85 C ATOM 539 CD1 ILE A 486 9.383 2.535 35.255 1.00 10.54 C ATOM 540 H ILE A 486 8.515 1.687 39.840 1.00 0.00 H ATOM 541 N VAL A 487 7.439 -1.872 38.600 1.00 12.14 N ATOM 542 CA VAL A 487 7.645 -3.148 39.288 1.00 10.35 C ATOM 543 C VAL A 487 9.123 -3.521 39.299 1.00 8.66 C ATOM 544 O VAL A 487 9.830 -3.354 38.305 1.00 13.11 O ATOM 545 CB VAL A 487 6.800 -4.257 38.634 1.00 10.29 C ATOM 546 CG1 VAL A 487 5.313 -4.004 38.886 1.00 7.71 C ATOM 547 CG2 VAL A 487 7.095 -4.342 37.133 1.00 8.01 C ATOM 548 H VAL A 487 6.748 -1.822 37.824 1.00 0.00 H ATOM 549 N LYS A 488 9.588 -4.043 40.423 1.00 11.70 N ATOM 550 CA LYS A 488 11.020 -4.281 40.623 1.00 21.36 C ATOM 551 C LYS A 488 11.424 -5.691 40.167 1.00 18.31 C ATOM 552 O LYS A 488 10.804 -6.683 40.559 1.00 10.11 O ATOM 553 CB LYS A 488 11.374 -4.068 42.097 1.00 9.57 C ATOM 554 CG LYS A 488 12.792 -4.482 42.509 1.00 26.90 C ATOM 555 CD LYS A 488 12.985 -4.297 44.014 1.00 22.78 C ATOM 556 CE LYS A 488 13.954 -5.319 44.604 1.00 40.26 C ATOM 557 NZ LYS A 488 13.893 -5.357 46.107 1.00 43.17 N ATOM 558 HZ1 LYS A 488 14.139 -4.421 46.487 1.00 0.00 H ATOM 559 HZ2 LYS A 488 12.931 -5.612 46.407 1.00 0.00 H ATOM 560 HZ3 LYS A 488 14.567 -6.065 46.462 1.00 0.00 H ATOM 561 H LYS A 488 8.921 -4.290 41.182 1.00 0.00 H ATOM 562 N LEU A 489 12.453 -5.772 39.328 1.00 11.42 N ATOM 563 CA LEU A 489 13.043 -7.056 38.959 1.00 19.59 C ATOM 564 C LEU A 489 14.123 -7.411 39.975 1.00 15.11 C ATOM 565 O LEU A 489 14.998 -6.594 40.258 1.00 10.74 O ATOM 566 CB LEU A 489 13.635 -7.016 37.548 1.00 18.95 C ATOM 567 CG LEU A 489 14.430 -8.256 37.085 1.00 14.21 C ATOM 568 CD1 LEU A 489 14.220 -8.495 35.605 1.00 10.85 C ATOM 569 CD2 LEU A 489 15.924 -8.047 37.390 1.00 7.58 C ATOM 570 H LEU A 489 12.848 -4.898 38.924 1.00 0.00 H ATOM 571 N ILE A 490 14.032 -8.606 40.554 1.00 15.63 N ATOM 572 CA ILE A 490 15.021 -9.019 41.536 1.00 12.94 C ATOM 573 C ILE A 490 16.203 -9.715 40.878 1.00 20.92 C ATOM 574 O ILE A 490 17.354 -9.512 41.285 1.00 21.79 O ATOM 575 CB ILE A 490 14.347 -9.891 42.603 1.00 23.73 C ATOM 576 CG1 ILE A 490 13.114 -9.143 43.112 1.00 27.65 C ATOM 577 CG2 ILE A 490 15.299 -10.148 43.735 1.00 22.61 C ATOM 578 CD1 ILE A 490 12.408 -9.794 44.252 1.00 30.23 C ATOM 579 H ILE A 490 13.251 -9.246 40.303 1.00 0.00 H ATOM 580 N GLY A 491 15.953 -10.513 39.847 1.00 11.83 N ATOM 581 CA GLY A 491 17.035 -11.162 39.128 1.00 11.66 C ATOM 582 C GLY A 491 16.486 -12.011 38.001 1.00 28.26 C ATOM 583 O GLY A 491 15.270 -12.106 37.796 1.00 19.58 O ATOM 584 H GLY A 491 14.970 -10.675 39.550 1.00 0.00 H ATOM 585 N ILE A 492 17.409 -12.634 37.267 1.00 23.26 N ATOM 586 CA ILE A 492 17.100 -13.366 36.040 1.00 25.56 C ATOM 587 C ILE A 492 17.906 -14.658 36.052 1.00 41.91 C ATOM 588 O ILE A 492 19.111 -14.638 36.324 1.00 42.15 O ATOM 589 CB ILE A 492 17.434 -12.556 34.770 1.00 32.37 C ATOM 590 CG1 ILE A 492 16.737 -11.194 34.778 1.00 38.50 C ATOM 591 CG2 ILE A 492 17.073 -13.361 33.486 1.00 27.54 C ATOM 592 CD1 ILE A 492 16.997 -10.375 33.536 1.00 27.24 C ATOM 593 H ILE A 492 18.399 -12.597 37.584 1.00 0.00 H ATOM 594 N ILE A 493 17.247 -15.778 35.770 1.00 29.89 N ATOM 595 CA ILE A 493 17.894 -17.084 35.722 1.00 23.59 C ATOM 596 C ILE A 493 18.054 -17.429 34.249 1.00 28.07 C ATOM 597 O ILE A 493 17.121 -17.898 33.599 1.00 36.62 O ATOM 598 CB ILE A 493 17.101 -18.140 36.492 1.00 27.04 C ATOM 599 CG1 ILE A 493 17.242 -17.874 37.991 1.00 30.67 C ATOM 600 CG2 ILE A 493 17.580 -19.546 36.167 1.00 34.71 C ATOM 601 CD1 ILE A 493 16.391 -18.761 38.823 1.00 28.58 C ATOM 602 H ILE A 493 16.227 -15.720 35.575 1.00 0.00 H ATOM 603 N GLU A 494 19.236 -17.152 33.711 1.00 27.69 N ATOM 604 CA GLU A 494 19.495 -17.357 32.294 1.00 42.46 C ATOM 605 C GLU A 494 19.486 -18.843 31.964 1.00 20.66 C ATOM 606 O GLU A 494 18.855 -19.260 30.999 1.00 36.55 O ATOM 607 CB GLU A 494 20.836 -16.720 31.900 1.00 47.69 C ATOM 608 H GLU A 494 19.995 -16.780 34.317 1.00 0.00 H TER 609 GLU A 494 ATOM 610 N PRO A 497 15.493 -23.396 31.122 1.00 45.97 N ATOM 611 CA PRO A 497 14.185 -22.792 31.403 1.00 42.52 C ATOM 612 C PRO A 497 14.334 -21.414 32.047 1.00 47.98 C ATOM 613 O PRO A 497 14.452 -21.309 33.279 1.00 28.73 O ATOM 614 CB PRO A 497 13.534 -23.794 32.367 1.00 39.51 C ATOM 615 CG PRO A 497 14.702 -24.507 33.005 1.00 40.40 C ATOM 616 CD PRO A 497 15.710 -24.627 31.901 1.00 49.06 C ATOM 617 HN2 PRO A 497 16.238 -22.711 31.361 1.00 0.00 H ATOM 618 HN1 PRO A 497 15.547 -23.625 30.109 1.00 0.00 H ATOM 619 N THR A 498 14.335 -20.371 31.216 1.00 27.21 N ATOM 620 CA THR A 498 14.681 -19.030 31.678 1.00 37.54 C ATOM 621 C THR A 498 13.523 -18.443 32.481 1.00 27.09 C ATOM 622 O THR A 498 12.392 -18.354 31.987 1.00 26.97 O ATOM 623 CB THR A 498 15.037 -18.125 30.497 1.00 47.50 C ATOM 624 OG1 THR A 498 16.299 -18.536 29.933 1.00 37.73 O ATOM 625 CG2 THR A 498 15.141 -16.681 30.961 1.00 29.14 C ATOM 626 HG1 THR A 498 17.005 -18.469 30.623 1.00 0.00 H ATOM 627 H THR A 498 14.084 -20.516 30.217 1.00 0.00 H ATOM 628 N TRP A 499 13.816 -18.058 33.715 1.00 20.94 N ATOM 629 CA TRP A 499 12.875 -17.451 34.640 1.00 23.82 C ATOM 630 C TRP A 499 13.252 -15.993 34.877 1.00 26.57 C ATOM 631 O TRP A 499 14.435 -15.671 35.034 1.00 25.05 O ATOM 632 CB TRP A 499 12.897 -18.178 35.982 1.00 16.92 C ATOM 633 CG TRP A 499 12.431 -19.589 35.946 1.00 22.07 C ATOM 634 CD1 TRP A 499 11.897 -20.262 34.873 1.00 28.01 C ATOM 635 CD2 TRP A 499 12.434 -20.512 37.038 1.00 33.88 C ATOM 636 NE1 TRP A 499 11.564 -21.544 35.238 1.00 21.73 N ATOM 637 CE2 TRP A 499 11.889 -21.728 36.559 1.00 33.53 C ATOM 638 CE3 TRP A 499 12.840 -20.430 38.378 1.00 21.20 C ATOM 639 CZ2 TRP A 499 11.739 -22.850 37.375 1.00 26.68 C ATOM 640 CZ3 TRP A 499 12.697 -21.543 39.186 1.00 25.33 C ATOM 641 CH2 TRP A 499 12.160 -22.744 38.676 1.00 40.84 C ATOM 642 HE1 TRP A 499 11.136 -22.258 34.615 1.00 0.00 H ATOM 643 H TRP A 499 14.792 -18.201 34.045 1.00 0.00 H ATOM 644 N ILE A 500 12.249 -15.123 34.955 1.00 19.93 N ATOM 645 CA ILE A 500 12.454 -13.746 35.391 1.00 14.94 C ATOM 646 C ILE A 500 11.897 -13.631 36.793 1.00 13.71 C ATOM 647 O ILE A 500 10.695 -13.839 37.007 1.00 16.08 O ATOM 648 CB ILE A 500 11.792 -12.721 34.460 1.00 14.33 C ATOM 649 CG1 ILE A 500 12.118 -13.021 33.003 1.00 18.63 C ATOM 650 CG2 ILE A 500 12.263 -11.293 34.823 1.00 13.31 C ATOM 651 CD1 ILE A 500 13.589 -13.136 32.718 1.00 26.27 C ATOM 652 H ILE A 500 11.290 -15.433 34.698 1.00 0.00 H ATOM 653 N ILE A 501 12.762 -13.291 37.747 1.00 15.21 N ATOM 654 CA ILE A 501 12.363 -13.160 39.140 1.00 10.69 C ATOM 655 C ILE A 501 11.983 -11.697 39.398 1.00 17.64 C ATOM 656 O ILE A 501 12.846 -10.820 39.475 1.00 10.86 O ATOM 657 CB ILE A 501 13.467 -13.625 40.095 1.00 20.71 C ATOM 658 CG1 ILE A 501 13.987 -15.045 39.736 1.00 24.18 C ATOM 659 CG2 ILE A 501 12.974 -13.557 41.521 1.00 22.65 C ATOM 660 CD1 ILE A 501 12.880 -16.079 39.430 1.00 20.46 C ATOM 661 H ILE A 501 13.754 -13.114 37.488 1.00 0.00 H ATOM 662 N MET A 502 10.688 -11.439 39.567 1.00 14.29 N ATOM 663 CA MET A 502 10.170 -10.123 39.898 1.00 14.30 C ATOM 664 C MET A 502 9.708 -10.073 41.347 1.00 17.73 C ATOM 665 O MET A 502 9.245 -11.069 41.911 1.00 13.90 O ATOM 666 CB MET A 502 8.991 -9.752 38.991 1.00 12.75 C ATOM 667 CG MET A 502 9.251 -9.979 37.522 1.00 14.20 C ATOM 668 SD MET A 502 10.335 -8.759 36.775 1.00 14.46 S ATOM 669 CE MET A 502 9.416 -7.258 37.093 1.00 13.66 C ATOM 670 H MET A 502 10.011 -12.221 39.456 1.00 0.00 H ATOM 671 N GLU A 503 9.825 -8.898 41.949 1.00 12.03 N ATOM 672 CA GLU A 503 9.150 -8.656 43.216 1.00 8.39 C ATOM 673 C GLU A 503 7.661 -8.958 43.085 1.00 14.80 C ATOM 674 O GLU A 503 7.025 -8.639 42.072 1.00 9.20 O ATOM 675 CB GLU A 503 9.363 -7.195 43.635 1.00 25.56 C ATOM 676 CG GLU A 503 8.797 -6.826 44.974 1.00 23.89 C ATOM 677 CD GLU A 503 9.554 -5.674 45.618 1.00 24.50 C ATOM 678 OE1 GLU A 503 10.064 -5.863 46.721 1.00 24.95 O ATOM 679 OE2 GLU A 503 9.606 -4.577 45.008 1.00 30.43 O ATOM 680 H GLU A 503 10.400 -8.148 41.516 1.00 0.00 H ATOM 681 N LEU A 504 7.096 -9.585 44.113 1.00 14.35 N ATOM 682 CA LEU A 504 5.678 -9.907 44.128 1.00 18.42 C ATOM 683 C LEU A 504 4.907 -8.893 44.957 1.00 12.52 C ATOM 684 O LEU A 504 5.243 -8.643 46.117 1.00 13.75 O ATOM 685 CB LEU A 504 5.411 -11.309 44.681 1.00 18.08 C ATOM 686 CG LEU A 504 3.924 -11.676 44.720 1.00 19.27 C ATOM 687 CD1 LEU A 504 3.371 -11.837 43.286 1.00 17.44 C ATOM 688 CD2 LEU A 504 3.700 -12.941 45.559 1.00 23.67 C ATOM 689 H LEU A 504 7.684 -9.852 44.928 1.00 0.00 H ATOM 690 N TYR A 505 3.849 -8.356 44.373 1.00 13.38 N ATOM 691 CA TYR A 505 2.942 -7.434 45.053 1.00 13.44 C ATOM 692 C TYR A 505 1.617 -8.149 45.316 1.00 28.26 C ATOM 693 O TYR A 505 0.795 -8.304 44.396 1.00 16.78 O ATOM 694 CB TYR A 505 2.745 -6.178 44.202 1.00 14.03 C ATOM 695 CG TYR A 505 4.101 -5.608 43.838 1.00 17.58 C ATOM 696 CD1 TYR A 505 4.589 -5.683 42.538 1.00 10.47 C ATOM 697 CD2 TYR A 505 4.930 -5.087 44.827 1.00 12.97 C ATOM 698 CE1 TYR A 505 5.836 -5.198 42.221 1.00 18.48 C ATOM 699 CE2 TYR A 505 6.185 -4.614 44.528 1.00 18.70 C ATOM 700 CZ TYR A 505 6.636 -4.661 43.219 1.00 17.15 C ATOM 701 OH TYR A 505 7.900 -4.194 42.929 1.00 13.95 O ATOM 702 HH TYR A 505 8.568 -4.715 43.441 1.00 0.00 H ATOM 703 H TYR A 505 3.653 -8.602 43.382 1.00 0.00 H ATOM 704 N PRO A 506 1.380 -8.631 46.544 1.00 30.34 N ATOM 705 CA PRO A 506 0.214 -9.491 46.790 1.00 15.72 C ATOM 706 C PRO A 506 -1.129 -8.778 46.700 1.00 18.30 C ATOM 707 O PRO A 506 -2.140 -9.453 46.471 1.00 16.48 O ATOM 708 CB PRO A 506 0.467 -10.026 48.207 1.00 31.89 C ATOM 709 CG PRO A 506 1.392 -9.039 48.834 1.00 32.55 C ATOM 710 CD PRO A 506 2.267 -8.546 47.717 1.00 29.75 C ATOM 711 N TYR A 507 -1.182 -7.449 46.835 1.00 17.27 N ATOM 712 CA TYR A 507 -2.450 -6.739 46.665 1.00 14.69 C ATOM 713 C TYR A 507 -3.050 -6.953 45.281 1.00 9.60 C ATOM 714 O TYR A 507 -4.272 -6.849 45.110 1.00 19.35 O ATOM 715 CB TYR A 507 -2.263 -5.242 46.930 1.00 12.60 C ATOM 716 CG TYR A 507 -2.214 -4.890 48.390 1.00 17.66 C ATOM 717 CD1 TYR A 507 -0.989 -4.633 49.031 1.00 25.95 C ATOM 718 CD2 TYR A 507 -3.380 -4.814 49.141 1.00 15.79 C ATOM 719 CE1 TYR A 507 -0.939 -4.306 50.372 1.00 20.24 C ATOM 720 CE2 TYR A 507 -3.342 -4.486 50.484 1.00 26.84 C ATOM 721 CZ TYR A 507 -2.123 -4.237 51.096 1.00 25.85 C ATOM 722 OH TYR A 507 -2.093 -3.914 52.431 1.00 31.33 O ATOM 723 HH TYR A 507 -1.155 -3.768 52.713 1.00 0.00 H ATOM 724 H TYR A 507 -0.318 -6.917 47.062 1.00 0.00 H ATOM 725 N GLY A 508 -2.224 -7.245 44.287 1.00 14.66 N ATOM 726 CA GLY A 508 -2.728 -7.575 42.968 1.00 17.14 C ATOM 727 C GLY A 508 -2.882 -6.365 42.062 1.00 14.70 C ATOM 728 O GLY A 508 -2.360 -5.284 42.325 1.00 17.03 O ATOM 729 H GLY A 508 -1.198 -7.237 44.455 1.00 0.00 H ATOM 730 N GLU A 509 -3.621 -6.562 40.970 1.00 20.38 N ATOM 731 CA GLU A 509 -3.782 -5.513 39.970 1.00 19.53 C ATOM 732 C GLU A 509 -4.598 -4.346 40.529 1.00 16.13 C ATOM 733 O GLU A 509 -5.439 -4.513 41.418 1.00 13.73 O ATOM 734 CB GLU A 509 -4.472 -6.072 38.723 1.00 28.73 C ATOM 735 CG GLU A 509 -4.023 -7.473 38.271 1.00 26.00 C ATOM 736 CD GLU A 509 -5.049 -8.157 37.328 1.00 49.56 C ATOM 737 OE1 GLU A 509 -6.175 -7.634 37.156 1.00 32.92 O ATOM 738 OE2 GLU A 509 -4.739 -9.235 36.770 1.00 42.01 O ATOM 739 H GLU A 509 -4.091 -7.479 40.829 1.00 0.00 H ATOM 740 N LEU A 510 -4.360 -3.147 39.980 1.00 16.69 N ATOM 741 CA LEU A 510 -5.040 -1.967 40.507 1.00 13.20 C ATOM 742 C LEU A 510 -6.541 -1.992 40.192 1.00 13.17 C ATOM 743 O LEU A 510 -7.365 -1.599 41.033 1.00 13.01 O ATOM 744 CB LEU A 510 -4.377 -0.699 39.957 1.00 11.13 C ATOM 745 CG LEU A 510 -5.020 0.667 40.236 1.00 10.47 C ATOM 746 CD1 LEU A 510 -5.203 0.906 41.736 1.00 6.29 C ATOM 747 CD2 LEU A 510 -4.186 1.800 39.587 1.00 5.17 C ATOM 748 H LEU A 510 -3.696 -3.057 39.185 1.00 0.00 H ATOM 749 N GLY A 511 -6.908 -2.397 38.977 1.00 6.47 N ATOM 750 CA GLY A 511 -8.319 -2.506 38.638 1.00 8.61 C ATOM 751 C GLY A 511 -9.121 -3.240 39.696 1.00 12.30 C ATOM 752 O GLY A 511 -10.107 -2.721 40.218 1.00 18.33 O ATOM 753 H GLY A 511 -6.184 -2.636 38.269 1.00 0.00 H ATOM 754 N HIS A 512 -8.691 -4.443 40.059 1.00 12.66 N ATOM 755 CA HIS A 512 -9.436 -5.193 41.066 1.00 18.67 C ATOM 756 C HIS A 512 -9.355 -4.542 42.439 1.00 13.08 C ATOM 757 O HIS A 512 -10.318 -4.608 43.211 1.00 16.63 O ATOM 758 CB HIS A 512 -8.931 -6.631 41.101 1.00 23.48 C ATOM 759 CG HIS A 512 -9.173 -7.364 39.821 1.00 34.00 C ATOM 760 ND1 HIS A 512 -8.274 -8.264 39.292 1.00 35.99 N ATOM 761 CD2 HIS A 512 -10.209 -7.305 38.947 1.00 39.02 C ATOM 762 CE1 HIS A 512 -8.756 -8.744 38.156 1.00 39.21 C ATOM 763 NE2 HIS A 512 -9.925 -8.174 37.921 1.00 39.84 N ATOM 764 H HIS A 512 -7.833 -4.846 39.631 1.00 0.00 H ATOM 765 N TYR A 513 -8.234 -3.897 42.756 1.00 15.88 N ATOM 766 CA TYR A 513 -8.124 -3.198 44.034 1.00 17.96 C ATOM 767 C TYR A 513 -9.147 -2.076 44.132 1.00 13.44 C ATOM 768 O TYR A 513 -9.819 -1.938 45.158 1.00 15.48 O ATOM 769 CB TYR A 513 -6.687 -2.673 44.232 1.00 14.71 C ATOM 770 CG TYR A 513 -6.439 -2.053 45.575 1.00 10.72 C ATOM 771 CD1 TYR A 513 -6.092 -2.830 46.674 1.00 14.51 C ATOM 772 CD2 TYR A 513 -6.568 -0.677 45.753 1.00 18.77 C ATOM 773 CE1 TYR A 513 -5.867 -2.256 47.903 1.00 9.79 C ATOM 774 CE2 TYR A 513 -6.367 -0.101 46.963 1.00 14.60 C ATOM 775 CZ TYR A 513 -6.015 -0.892 48.046 1.00 24.69 C ATOM 776 OH TYR A 513 -5.808 -0.286 49.261 1.00 34.12 O ATOM 777 HH TYR A 513 -5.073 0.373 49.179 1.00 0.00 H ATOM 778 H TYR A 513 -7.434 -3.891 42.091 1.00 0.00 H ATOM 779 N LEU A 514 -9.281 -1.276 43.063 1.00 13.87 N ATOM 780 CA LEU A 514 -10.254 -0.184 43.000 1.00 14.15 C ATOM 781 C LEU A 514 -11.683 -0.674 43.231 1.00 11.79 C ATOM 782 O LEU A 514 -12.422 -0.119 44.048 1.00 13.99 O ATOM 783 CB LEU A 514 -10.148 0.512 41.633 1.00 16.88 C ATOM 784 CG LEU A 514 -8.855 1.275 41.300 1.00 22.53 C ATOM 785 CD1 LEU A 514 -8.655 1.588 39.778 1.00 7.68 C ATOM 786 CD2 LEU A 514 -8.771 2.527 42.154 1.00 17.67 C ATOM 787 H LEU A 514 -8.665 -1.439 42.241 1.00 0.00 H ATOM 788 N GLU A 515 -12.098 -1.706 42.511 1.00 19.92 N ATOM 789 CA GLU A 515 -13.466 -2.190 42.663 1.00 21.34 C ATOM 790 C GLU A 515 -13.743 -2.734 44.062 1.00 21.49 C ATOM 791 O GLU A 515 -14.846 -2.549 44.577 1.00 18.56 O ATOM 792 CB GLU A 515 -13.760 -3.225 41.594 1.00 23.85 C ATOM 793 CG GLU A 515 -13.743 -2.605 40.197 1.00 27.65 C ATOM 794 CD GLU A 515 -13.127 -3.498 39.148 1.00 50.38 C ATOM 795 OE1 GLU A 515 -12.138 -3.053 38.518 1.00 57.43 O ATOM 796 OE2 GLU A 515 -13.629 -4.626 38.961 1.00 45.47 O ATOM 797 H GLU A 515 -11.452 -2.169 41.841 1.00 0.00 H ATOM 798 N ARG A 516 -12.758 -3.359 44.710 1.00 19.60 N ATOM 799 CA ARG A 516 -12.976 -3.861 46.067 1.00 23.04 C ATOM 800 C ARG A 516 -13.129 -2.716 47.068 1.00 28.95 C ATOM 801 O ARG A 516 -13.936 -2.798 47.999 1.00 23.58 O ATOM 802 CB ARG A 516 -11.827 -4.795 46.494 1.00 20.66 C ATOM 803 CG ARG A 516 -11.707 -6.117 45.690 1.00 25.75 C ATOM 804 CD ARG A 516 -10.837 -7.218 46.363 1.00 22.90 C ATOM 805 NE ARG A 516 -9.432 -6.853 46.648 1.00 47.03 N ATOM 806 CZ ARG A 516 -8.406 -6.983 45.796 1.00 27.48 C ATOM 807 NH1 ARG A 516 -8.594 -7.449 44.572 1.00 28.84 N ATOM 808 NH2 ARG A 516 -7.182 -6.637 46.166 1.00 31.02 N ATOM 809 HE ARG A 516 -9.223 -6.463 47.589 1.00 0.00 H ATOM 810 HH12 ARG A 516 -7.788 -7.544 43.922 1.00 0.00 H ATOM 811 HH11 ARG A 516 -9.548 -7.720 44.260 1.00 0.00 H ATOM 812 HH22 ARG A 516 -6.389 -6.740 45.501 1.00 0.00 H ATOM 813 HH21 ARG A 516 -7.014 -6.262 47.122 1.00 0.00 H ATOM 814 H ARG A 516 -11.834 -3.489 44.250 1.00 0.00 H ATOM 815 N ASN A 517 -12.367 -1.636 46.904 1.00 29.62 N ATOM 816 CA ASN A 517 -12.335 -0.582 47.909 1.00 18.92 C ATOM 817 C ASN A 517 -13.001 0.709 47.449 1.00 21.58 C ATOM 818 O ASN A 517 -12.683 1.784 47.981 1.00 21.51 O ATOM 819 CB ASN A 517 -10.894 -0.317 48.314 1.00 18.53 C ATOM 820 CG ASN A 517 -10.263 -1.517 48.912 1.00 23.48 C ATOM 821 OD1 ASN A 517 -10.434 -1.774 50.097 1.00 25.30 O ATOM 822 ND2 ASN A 517 -9.545 -2.291 48.095 1.00 18.33 N ATOM 823 HD22 ASN A 517 -9.431 -2.027 47.096 1.00 0.00 H ATOM 824 HD21 ASN A 517 -9.100 -3.158 48.458 1.00 0.00 H ATOM 825 H ASN A 517 -11.786 -1.544 46.046 1.00 0.00 H ATOM 826 N LYS A 518 -13.919 0.625 46.478 1.00 20.33 N ATOM 827 CA LYS A 518 -14.506 1.837 45.911 1.00 29.72 C ATOM 828 C LYS A 518 -15.285 2.632 46.952 1.00 33.56 C ATOM 829 O LYS A 518 -15.363 3.862 46.865 1.00 28.12 O ATOM 830 CB LYS A 518 -15.401 1.483 44.720 1.00 19.73 C ATOM 831 CG LYS A 518 -16.434 0.408 44.997 1.00 39.27 C ATOM 832 CD LYS A 518 -16.983 -0.178 43.692 1.00 27.68 C ATOM 833 CE LYS A 518 -18.325 -0.906 43.906 1.00 46.58 C ATOM 834 NZ LYS A 518 -18.236 -2.108 44.806 1.00 41.15 N ATOM 835 HZ1 LYS A 518 -17.575 -2.798 44.396 1.00 0.00 H ATOM 836 HZ2 LYS A 518 -17.894 -1.813 45.743 1.00 0.00 H ATOM 837 HZ3 LYS A 518 -19.177 -2.540 44.899 1.00 0.00 H ATOM 838 H LYS A 518 -14.216 -0.307 46.126 1.00 0.00 H ATOM 839 N ASN A 519 -15.850 1.962 47.955 1.00 23.52 N ATOM 840 CA ASN A 519 -16.589 2.701 48.966 1.00 28.49 C ATOM 841 C ASN A 519 -15.680 3.407 49.970 1.00 37.28 C ATOM 842 O ASN A 519 -16.106 4.409 50.561 1.00 28.00 O ATOM 843 CB ASN A 519 -17.565 1.756 49.666 1.00 24.62 C ATOM 844 CG ASN A 519 -18.611 1.217 48.710 1.00 40.93 C ATOM 845 OD1 ASN A 519 -19.437 1.974 48.176 1.00 38.66 O ATOM 846 ND2 ASN A 519 -18.557 -0.084 48.451 1.00 36.41 N ATOM 847 HD22 ASN A 519 -17.847 -0.679 48.923 1.00 0.00 H ATOM 848 HD21 ASN A 519 -19.225 -0.508 47.776 1.00 0.00 H ATOM 849 H ASN A 519 -15.764 0.927 48.014 1.00 0.00 H ATOM 850 N SER A 520 -14.434 2.937 50.158 1.00 25.94 N ATOM 851 CA SER A 520 -13.530 3.600 51.095 1.00 18.42 C ATOM 852 C SER A 520 -12.536 4.545 50.427 1.00 25.07 C ATOM 853 O SER A 520 -12.010 5.435 51.105 1.00 29.50 O ATOM 854 CB SER A 520 -12.754 2.570 51.930 1.00 23.07 C ATOM 855 OG SER A 520 -11.805 1.837 51.157 1.00 27.83 O ATOM 856 HG SER A 520 -12.275 1.350 50.434 1.00 0.00 H ATOM 857 H SER A 520 -14.113 2.098 49.634 1.00 0.00 H ATOM 858 N LEU A 521 -12.283 4.393 49.127 1.00 25.15 N ATOM 859 CA LEU A 521 -11.257 5.178 48.451 1.00 27.64 C ATOM 860 C LEU A 521 -11.708 6.615 48.234 1.00 29.25 C ATOM 861 O LEU A 521 -12.821 6.860 47.756 1.00 27.38 O ATOM 862 CB LEU A 521 -10.928 4.554 47.102 1.00 28.08 C ATOM 863 CG LEU A 521 -10.039 3.332 46.988 1.00 29.94 C ATOM 864 CD1 LEU A 521 -10.233 2.771 45.588 1.00 22.44 C ATOM 865 CD2 LEU A 521 -8.556 3.662 47.266 1.00 25.38 C ATOM 866 H LEU A 521 -12.831 3.697 48.582 1.00 0.00 H ATOM 867 N LYS A 522 -10.821 7.563 48.557 1.00 18.61 N ATOM 868 CA LYS A 522 -11.020 8.999 48.378 1.00 26.51 C ATOM 869 C LYS A 522 -10.369 9.494 47.087 1.00 19.69 C ATOM 870 O LYS A 522 -9.426 8.896 46.565 1.00 22.39 O ATOM 871 CB LYS A 522 -10.423 9.792 49.553 1.00 32.52 C ATOM 872 CG LYS A 522 -10.912 9.386 50.931 1.00 42.67 C ATOM 873 CD LYS A 522 -9.887 9.770 51.997 1.00 44.69 C ATOM 874 CE LYS A 522 -9.694 11.269 52.086 1.00 43.89 C ATOM 875 NZ LYS A 522 -10.897 11.955 52.628 1.00 48.41 N ATOM 876 HZ1 LYS A 522 -11.710 11.768 52.007 1.00 0.00 H ATOM 877 HZ2 LYS A 522 -11.099 11.596 53.583 1.00 0.00 H ATOM 878 HZ3 LYS A 522 -10.721 12.979 52.671 1.00 0.00 H ATOM 879 H LYS A 522 -9.918 7.253 48.968 1.00 0.00 H ATOM 880 N VAL A 523 -10.848 10.649 46.620 1.00 18.67 N ATOM 881 CA VAL A 523 -10.357 11.231 45.370 1.00 20.43 C ATOM 882 C VAL A 523 -8.863 11.511 45.466 1.00 23.66 C ATOM 883 O VAL A 523 -8.102 11.279 44.517 1.00 19.75 O ATOM 884 CB VAL A 523 -11.154 12.511 45.046 1.00 22.66 C ATOM 885 CG1 VAL A 523 -10.531 13.266 43.888 1.00 22.13 C ATOM 886 CG2 VAL A 523 -12.582 12.168 44.725 1.00 25.70 C ATOM 887 H VAL A 523 -11.587 11.147 47.157 1.00 0.00 H ATOM 888 N LEU A 524 -8.434 12.043 46.615 1.00 21.12 N ATOM 889 CA LEU A 524 -7.020 12.241 46.919 1.00 18.14 C ATOM 890 C LEU A 524 -6.145 11.052 46.509 1.00 10.79 C ATOM 891 O LEU A 524 -5.170 11.203 45.772 1.00 16.66 O ATOM 892 CB LEU A 524 -6.899 12.515 48.410 1.00 23.87 C ATOM 893 CG LEU A 524 -5.487 12.946 48.651 1.00 21.49 C ATOM 894 CD1 LEU A 524 -5.372 14.258 47.929 1.00 34.05 C ATOM 895 CD2 LEU A 524 -5.312 13.156 50.118 1.00 29.00 C ATOM 896 H LEU A 524 -9.139 12.329 47.324 1.00 0.00 H ATOM 897 N THR A 525 -6.479 9.867 46.985 1.00 14.45 N ATOM 898 CA THR A 525 -5.695 8.680 46.677 1.00 16.44 C ATOM 899 C THR A 525 -5.719 8.332 45.199 1.00 11.85 C ATOM 900 O THR A 525 -4.709 7.882 44.664 1.00 18.15 O ATOM 901 CB THR A 525 -6.234 7.523 47.502 1.00 18.75 C ATOM 902 OG1 THR A 525 -6.469 8.013 48.822 1.00 23.81 O ATOM 903 CG2 THR A 525 -5.246 6.388 47.541 1.00 16.03 C ATOM 904 HG1 THR A 525 -6.822 7.280 49.387 1.00 0.00 H ATOM 905 H THR A 525 -7.319 9.780 47.592 1.00 0.00 H ATOM 906 N LEU A 526 -6.854 8.525 44.530 1.00 16.96 N ATOM 907 CA LEU A 526 -6.950 8.241 43.103 1.00 13.93 C ATOM 908 C LEU A 526 -6.079 9.194 42.289 1.00 17.80 C ATOM 909 O LEU A 526 -5.502 8.797 41.273 1.00 13.09 O ATOM 910 CB LEU A 526 -8.413 8.345 42.653 1.00 15.35 C ATOM 911 CG LEU A 526 -9.480 7.520 43.390 1.00 17.88 C ATOM 912 CD1 LEU A 526 -10.865 7.877 42.888 1.00 19.86 C ATOM 913 CD2 LEU A 526 -9.244 6.025 43.276 1.00 15.10 C ATOM 914 H LEU A 526 -7.689 8.885 45.035 1.00 0.00 H ATOM 915 N VAL A 527 -6.004 10.468 42.695 1.00 13.61 N ATOM 916 CA VAL A 527 -5.057 11.385 42.066 1.00 12.86 C ATOM 917 C VAL A 527 -3.615 10.996 42.410 1.00 7.37 C ATOM 918 O VAL A 527 -2.719 11.081 41.568 1.00 13.69 O ATOM 919 CB VAL A 527 -5.366 12.843 42.468 1.00 15.47 C ATOM 920 CG1 VAL A 527 -4.299 13.776 41.929 1.00 12.75 C ATOM 921 CG2 VAL A 527 -6.754 13.249 41.972 1.00 9.75 C ATOM 922 H VAL A 527 -6.622 10.805 43.460 1.00 0.00 H ATOM 923 N LEU A 528 -3.369 10.562 43.642 1.00 12.71 N ATOM 924 CA LEU A 528 -2.042 10.042 44.003 1.00 14.11 C ATOM 925 C LEU A 528 -1.587 8.913 43.062 1.00 11.62 C ATOM 926 O LEU A 528 -0.483 8.964 42.504 1.00 12.77 O ATOM 927 CB LEU A 528 -2.053 9.551 45.454 1.00 12.02 C ATOM 928 CG LEU A 528 -0.755 8.947 45.997 1.00 14.66 C ATOM 929 CD1 LEU A 528 0.364 9.980 45.993 1.00 16.43 C ATOM 930 CD2 LEU A 528 -0.984 8.439 47.402 1.00 22.97 C ATOM 931 H LEU A 528 -4.123 10.591 44.358 1.00 0.00 H ATOM 932 N TYR A 529 -2.423 7.883 42.877 1.00 11.55 N ATOM 933 CA TYR A 529 -2.078 6.786 41.962 1.00 9.99 C ATOM 934 C TYR A 529 -1.754 7.293 40.558 1.00 10.12 C ATOM 935 O TYR A 529 -0.787 6.849 39.931 1.00 6.23 O ATOM 936 CB TYR A 529 -3.233 5.788 41.886 1.00 11.58 C ATOM 937 CG TYR A 529 -3.543 5.123 43.195 1.00 14.73 C ATOM 938 CD1 TYR A 529 -2.605 5.097 44.227 1.00 11.62 C ATOM 939 CD2 TYR A 529 -4.785 4.547 43.412 1.00 10.23 C ATOM 940 CE1 TYR A 529 -2.907 4.470 45.435 1.00 21.17 C ATOM 941 CE2 TYR A 529 -5.084 3.922 44.593 1.00 22.60 C ATOM 942 CZ TYR A 529 -4.147 3.883 45.604 1.00 19.20 C ATOM 943 OH TYR A 529 -4.475 3.273 46.786 1.00 18.38 O ATOM 944 HH TYR A 529 -3.706 3.325 47.408 1.00 0.00 H ATOM 945 H TYR A 529 -3.329 7.859 43.388 1.00 0.00 H ATOM 946 N SER A 530 -2.559 8.230 40.037 1.00 12.19 N ATOM 947 CA SER A 530 -2.292 8.754 38.693 1.00 12.62 C ATOM 948 C SER A 530 -0.959 9.470 38.648 1.00 4.86 C ATOM 949 O SER A 530 -0.186 9.322 37.698 1.00 4.23 O ATOM 950 CB SER A 530 -3.390 9.725 38.260 1.00 12.34 C ATOM 951 OG SER A 530 -4.683 9.194 38.379 1.00 8.14 O ATOM 952 HG SER A 530 -4.854 8.954 39.324 1.00 0.00 H ATOM 953 H SER A 530 -3.370 8.584 40.584 1.00 0.00 H ATOM 954 N LEU A 531 -0.698 10.292 39.654 1.00 12.37 N ATOM 955 CA LEU A 531 0.584 10.993 39.729 1.00 15.64 C ATOM 956 C LEU A 531 1.761 10.013 39.771 1.00 8.79 C ATOM 957 O LEU A 531 2.756 10.196 39.064 1.00 12.37 O ATOM 958 CB LEU A 531 0.586 11.906 40.955 1.00 12.78 C ATOM 959 CG LEU A 531 1.884 12.655 41.196 1.00 12.87 C ATOM 960 CD1 LEU A 531 2.122 13.613 40.024 1.00 17.74 C ATOM 961 CD2 LEU A 531 1.842 13.394 42.517 1.00 14.72 C ATOM 962 H LEU A 531 -1.411 10.440 40.397 1.00 0.00 H ATOM 963 N GLN A 532 1.651 8.945 40.572 1.00 8.17 N ATOM 964 CA GLN A 532 2.728 7.956 40.666 1.00 9.96 C ATOM 965 C GLN A 532 3.012 7.259 39.330 1.00 5.90 C ATOM 966 O GLN A 532 4.176 7.038 38.974 1.00 5.92 O ATOM 967 CB GLN A 532 2.395 6.922 41.752 1.00 7.79 C ATOM 968 CG GLN A 532 2.432 7.560 43.140 1.00 14.35 C ATOM 969 CD GLN A 532 2.125 6.592 44.272 1.00 17.59 C ATOM 970 OE1 GLN A 532 1.555 5.518 44.050 1.00 9.10 O ATOM 971 NE2 GLN A 532 2.515 6.976 45.507 1.00 11.13 N ATOM 972 HE22 GLN A 532 2.992 7.891 45.641 1.00 0.00 H ATOM 973 HE21 GLN A 532 2.339 6.357 46.324 1.00 0.00 H ATOM 974 H GLN A 532 0.787 8.816 41.136 1.00 0.00 H ATOM 975 N ILE A 533 1.974 6.896 38.582 1.00 8.57 N ATOM 976 CA ILE A 533 2.193 6.322 37.256 1.00 5.99 C ATOM 977 C ILE A 533 2.759 7.368 36.302 1.00 8.78 C ATOM 978 O ILE A 533 3.597 7.066 35.438 1.00 11.70 O ATOM 979 CB ILE A 533 0.879 5.732 36.714 1.00 12.25 C ATOM 980 CG1 ILE A 533 0.374 4.617 37.641 1.00 10.93 C ATOM 981 CG2 ILE A 533 1.104 5.187 35.320 1.00 12.87 C ATOM 982 CD1 ILE A 533 1.379 3.469 37.760 1.00 12.00 C ATOM 983 H ILE A 533 1.006 7.021 38.941 1.00 0.00 H ATOM 984 N CYS A 534 2.333 8.621 36.452 1.00 12.21 N ATOM 985 CA CYS A 534 2.846 9.668 35.573 1.00 13.43 C ATOM 986 C CYS A 534 4.337 9.913 35.837 1.00 11.86 C ATOM 987 O CYS A 534 5.111 10.152 34.904 1.00 12.83 O ATOM 988 CB CYS A 534 2.012 10.940 35.760 1.00 19.93 C ATOM 989 SG CYS A 534 2.243 12.181 34.482 1.00 17.63 S ATOM 990 H CYS A 534 1.639 8.852 37.191 1.00 0.00 H ATOM 991 N LYS A 535 4.777 9.775 37.088 1.00 9.44 N ATOM 992 CA LYS A 535 6.220 9.886 37.358 1.00 23.35 C ATOM 993 C LYS A 535 6.999 8.756 36.689 1.00 14.65 C ATOM 994 O LYS A 535 8.069 8.990 36.108 1.00 16.36 O ATOM 995 CB LYS A 535 6.491 9.911 38.863 1.00 6.69 C ATOM 996 CG LYS A 535 5.841 11.123 39.513 1.00 20.68 C ATOM 997 CD LYS A 535 6.158 11.253 40.988 1.00 28.41 C ATOM 998 CE LYS A 535 5.943 12.710 41.426 1.00 21.56 C ATOM 999 NZ LYS A 535 6.372 12.929 42.832 1.00 31.80 N ATOM 1000 HZ1 LYS A 535 5.820 12.312 43.462 1.00 0.00 H ATOM 1001 HZ2 LYS A 535 7.383 12.704 42.924 1.00 0.00 H ATOM 1002 HZ3 LYS A 535 6.212 13.923 43.091 1.00 0.00 H ATOM 1003 H LYS A 535 4.109 9.591 37.864 1.00 0.00 H ATOM 1004 N ALA A 536 6.449 7.530 36.737 1.00 12.32 N ATOM 1005 CA ALA A 536 6.989 6.400 35.989 1.00 12.78 C ATOM 1006 C ALA A 536 7.112 6.726 34.508 1.00 10.97 C ATOM 1007 O ALA A 536 8.204 6.660 33.932 1.00 16.97 O ATOM 1008 CB ALA A 536 6.092 5.169 36.186 1.00 11.28 C ATOM 1009 H ALA A 536 5.607 7.382 37.329 1.00 0.00 H ATOM 1010 N MET A 537 5.993 7.099 33.882 1.00 14.40 N ATOM 1011 CA MET A 537 5.996 7.480 32.475 1.00 10.27 C ATOM 1012 C MET A 537 6.991 8.601 32.190 1.00 12.19 C ATOM 1013 O MET A 537 7.657 8.586 31.153 1.00 11.99 O ATOM 1014 CB MET A 537 4.579 7.901 32.060 1.00 5.75 C ATOM 1015 CG MET A 537 3.631 6.746 31.940 1.00 13.31 C ATOM 1016 SD MET A 537 4.492 5.275 31.330 1.00 19.82 S ATOM 1017 CE MET A 537 4.696 5.708 29.599 1.00 18.04 C ATOM 1018 H MET A 537 5.098 7.118 34.411 1.00 0.00 H ATOM 1019 N ALA A 538 7.072 9.615 33.066 1.00 11.63 N ATOM 1020 CA ALA A 538 7.988 10.728 32.781 1.00 13.12 C ATOM 1021 C ALA A 538 9.420 10.222 32.661 1.00 15.30 C ATOM 1022 O ALA A 538 10.166 10.624 31.756 1.00 14.55 O ATOM 1023 CB ALA A 538 7.891 11.831 33.855 1.00 6.93 C ATOM 1024 H ALA A 538 6.496 9.613 33.932 1.00 0.00 H ATOM 1025 N TYR A 539 9.809 9.310 33.551 1.00 11.48 N ATOM 1026 CA TYR A 539 11.116 8.681 33.438 1.00 15.51 C ATOM 1027 C TYR A 539 11.250 7.906 32.126 1.00 16.16 C ATOM 1028 O TYR A 539 12.246 8.034 31.409 1.00 14.83 O ATOM 1029 CB TYR A 539 11.338 7.768 34.639 1.00 18.82 C ATOM 1030 CG TYR A 539 12.562 6.919 34.520 1.00 25.44 C ATOM 1031 CD1 TYR A 539 13.817 7.488 34.315 1.00 34.10 C ATOM 1032 CD2 TYR A 539 12.471 5.544 34.616 1.00 40.43 C ATOM 1033 CE1 TYR A 539 14.953 6.696 34.210 1.00 36.64 C ATOM 1034 CE2 TYR A 539 13.595 4.748 34.510 1.00 49.25 C ATOM 1035 CZ TYR A 539 14.832 5.322 34.303 1.00 55.17 C ATOM 1036 OH TYR A 539 15.942 4.498 34.203 1.00 56.07 O ATOM 1037 HH TYR A 539 16.043 3.979 35.040 1.00 0.00 H ATOM 1038 H TYR A 539 9.174 9.046 34.331 1.00 0.00 H ATOM 1039 N LEU A 540 10.250 7.097 31.792 1.00 13.85 N ATOM 1040 CA LEU A 540 10.330 6.329 30.555 1.00 21.81 C ATOM 1041 C LEU A 540 10.429 7.251 29.337 1.00 24.35 C ATOM 1042 O LEU A 540 11.225 7.002 28.420 1.00 18.67 O ATOM 1043 CB LEU A 540 9.132 5.383 30.451 1.00 13.75 C ATOM 1044 CG LEU A 540 9.132 4.136 31.362 1.00 14.06 C ATOM 1045 CD1 LEU A 540 7.944 3.180 31.079 1.00 8.37 C ATOM 1046 CD2 LEU A 540 10.427 3.362 31.249 1.00 15.71 C ATOM 1047 H LEU A 540 9.417 7.012 32.408 1.00 0.00 H ATOM 1048 N GLU A 541 9.644 8.333 29.327 1.00 17.18 N ATOM 1049 CA GLU A 541 9.703 9.305 28.236 1.00 18.62 C ATOM 1050 C GLU A 541 11.114 9.860 28.049 1.00 16.96 C ATOM 1051 O GLU A 541 11.567 10.066 26.916 1.00 22.80 O ATOM 1052 CB GLU A 541 8.710 10.437 28.515 1.00 14.23 C ATOM 1053 CG GLU A 541 8.865 11.694 27.652 1.00 28.71 C ATOM 1054 CD GLU A 541 7.793 12.739 27.960 1.00 25.08 C ATOM 1055 OE1 GLU A 541 7.994 13.623 28.846 1.00 20.27 O ATOM 1056 OE2 GLU A 541 6.721 12.629 27.331 1.00 24.55 O ATOM 1057 H GLU A 541 8.978 8.487 30.111 1.00 0.00 H ATOM 1058 N SER A 542 11.832 10.097 29.142 1.00 12.75 N ATOM 1059 CA SER A 542 13.147 10.717 29.014 1.00 15.86 C ATOM 1060 C SER A 542 14.166 9.830 28.291 1.00 31.30 C ATOM 1061 O SER A 542 15.262 10.305 27.974 1.00 24.94 O ATOM 1062 CB SER A 542 13.662 11.108 30.399 1.00 15.82 C ATOM 1063 OG SER A 542 14.327 10.038 31.011 1.00 21.09 O ATOM 1064 HG SER A 542 13.703 9.276 31.108 1.00 0.00 H ATOM 1065 H SER A 542 11.460 9.843 30.080 1.00 0.00 H ATOM 1066 N ILE A 543 13.847 8.561 28.031 1.00 26.30 N ATOM 1067 CA ILE A 543 14.681 7.735 27.165 1.00 24.76 C ATOM 1068 C ILE A 543 13.911 7.243 25.939 1.00 23.20 C ATOM 1069 O ILE A 543 14.279 6.225 25.337 1.00 20.19 O ATOM 1070 CB ILE A 543 15.292 6.553 27.938 1.00 19.29 C ATOM 1071 CG1 ILE A 543 14.248 5.854 28.794 1.00 16.70 C ATOM 1072 CG2 ILE A 543 16.424 7.033 28.816 1.00 23.12 C ATOM 1073 CD1 ILE A 543 14.667 4.456 29.242 1.00 15.60 C ATOM 1074 H ILE A 543 12.988 8.153 28.453 1.00 0.00 H ATOM 1075 N ASN A 544 12.852 7.969 25.553 1.00 29.42 N ATOM 1076 CA ASN A 544 12.046 7.647 24.361 1.00 21.80 C ATOM 1077 C ASN A 544 11.571 6.191 24.385 1.00 25.48 C ATOM 1078 O ASN A 544 11.541 5.497 23.369 1.00 42.89 O ATOM 1079 CB ASN A 544 12.820 7.967 23.076 1.00 26.14 C ATOM 1080 CG ASN A 544 11.972 7.808 21.818 1.00 43.78 C ATOM 1081 OD1 ASN A 544 12.482 7.460 20.752 1.00 55.61 O ATOM 1082 ND2 ASN A 544 10.669 8.053 21.943 1.00 46.97 N ATOM 1083 HD22 ASN A 544 10.281 8.345 22.863 1.00 0.00 H ATOM 1084 HD21 ASN A 544 10.040 7.953 21.121 1.00 0.00 H ATOM 1085 H ASN A 544 12.586 8.799 26.121 1.00 0.00 H ATOM 1086 N CYS A 545 11.187 5.715 25.566 1.00 34.50 N ATOM 1087 CA CYS A 545 10.819 4.319 25.758 1.00 23.83 C ATOM 1088 C CYS A 545 9.299 4.248 25.823 1.00 20.93 C ATOM 1089 O CYS A 545 8.694 4.732 26.781 1.00 24.51 O ATOM 1090 CB CYS A 545 11.457 3.770 27.034 1.00 28.35 C ATOM 1091 SG CYS A 545 11.987 2.053 26.977 1.00 45.59 S ATOM 1092 H CYS A 545 11.148 6.361 26.380 1.00 0.00 H ATOM 1093 N VAL A 546 8.682 3.666 24.802 1.00 25.54 N ATOM 1094 CA VAL A 546 7.226 3.582 24.714 1.00 17.71 C ATOM 1095 C VAL A 546 6.769 2.326 25.445 1.00 25.12 C ATOM 1096 O VAL A 546 7.288 1.227 25.194 1.00 17.49 O ATOM 1097 CB VAL A 546 6.767 3.567 23.245 1.00 24.52 C ATOM 1098 CG1 VAL A 546 5.265 3.589 23.151 1.00 22.24 C ATOM 1099 CG2 VAL A 546 7.356 4.742 22.478 1.00 16.68 C ATOM 1100 H VAL A 546 9.255 3.255 24.038 1.00 0.00 H ATOM 1101 N HIS A 547 5.788 2.478 26.342 1.00 16.33 N ATOM 1102 CA HIS A 547 5.380 1.359 27.186 1.00 13.88 C ATOM 1103 C HIS A 547 4.243 0.514 26.590 1.00 18.54 C ATOM 1104 O HIS A 547 4.324 -0.721 26.615 1.00 21.17 O ATOM 1105 CB HIS A 547 4.990 1.861 28.579 1.00 24.64 C ATOM 1106 CG HIS A 547 4.636 0.760 29.529 1.00 13.84 C ATOM 1107 ND1 HIS A 547 3.350 0.300 29.680 1.00 11.40 N ATOM 1108 CD2 HIS A 547 5.402 0.012 30.359 1.00 15.85 C ATOM 1109 CE1 HIS A 547 3.333 -0.677 30.568 1.00 14.41 C ATOM 1110 NE2 HIS A 547 4.565 -0.870 30.999 1.00 12.16 N ATOM 1111 H HIS A 547 5.314 3.398 26.438 1.00 0.00 H ATOM 1112 N ARG A 548 3.179 1.136 26.076 1.00 19.47 N ATOM 1113 CA ARG A 548 2.092 0.504 25.316 1.00 23.69 C ATOM 1114 C ARG A 548 1.038 -0.239 26.172 1.00 17.22 C ATOM 1115 O ARG A 548 0.025 -0.670 25.616 1.00 23.31 O ATOM 1116 CB ARG A 548 2.591 -0.479 24.235 1.00 14.59 C ATOM 1117 CG ARG A 548 3.388 0.138 23.096 1.00 25.48 C ATOM 1118 CD ARG A 548 4.080 -0.953 22.290 1.00 14.09 C ATOM 1119 NE ARG A 548 4.462 -0.514 20.953 1.00 40.61 N ATOM 1120 CZ ARG A 548 5.708 -0.216 20.572 1.00 59.65 C ATOM 1121 NH1 ARG A 548 6.729 -0.299 21.428 1.00 42.18 N ATOM 1122 NH2 ARG A 548 5.937 0.168 19.320 1.00 56.51 N ATOM 1123 HE ARG A 548 3.708 -0.426 20.242 1.00 0.00 H ATOM 1124 HH12 ARG A 548 7.692 -0.063 21.113 1.00 0.00 H ATOM 1125 HH11 ARG A 548 6.562 -0.600 22.409 1.00 0.00 H ATOM 1126 HH22 ARG A 548 6.904 0.401 19.016 1.00 0.00 H ATOM 1127 HH21 ARG A 548 5.149 0.235 18.644 1.00 0.00 H ATOM 1128 H ARG A 548 3.114 2.163 26.228 1.00 0.00 H ATOM 1129 N ASP A 549 1.220 -0.424 27.479 1.00 21.82 N ATOM 1130 CA ASP A 549 0.131 -0.995 28.283 1.00 21.09 C ATOM 1131 C ASP A 549 0.075 -0.307 29.646 1.00 18.53 C ATOM 1132 O ASP A 549 0.445 -0.873 30.686 1.00 16.26 O ATOM 1133 CB ASP A 549 0.235 -2.509 28.448 1.00 22.29 C ATOM 1134 CG ASP A 549 -1.105 -3.126 28.850 1.00 24.82 C ATOM 1135 OD1 ASP A 549 -1.117 -4.253 29.377 1.00 44.88 O ATOM 1136 OD2 ASP A 549 -2.147 -2.477 28.623 1.00 34.70 O ATOM 1137 H ASP A 549 2.124 -0.167 27.925 1.00 0.00 H ATOM 1138 N ILE A 550 -0.412 0.924 29.611 1.00 6.77 N ATOM 1139 CA ILE A 550 -0.680 1.721 30.801 1.00 19.07 C ATOM 1140 C ILE A 550 -2.179 1.611 31.036 1.00 19.20 C ATOM 1141 O ILE A 550 -2.983 2.366 30.475 1.00 19.08 O ATOM 1142 CB ILE A 550 -0.237 3.169 30.625 1.00 16.14 C ATOM 1143 CG1 ILE A 550 1.254 3.184 30.318 1.00 19.30 C ATOM 1144 CG2 ILE A 550 -0.595 3.999 31.856 1.00 12.90 C ATOM 1145 CD1 ILE A 550 1.525 3.497 28.896 1.00 31.37 C ATOM 1146 H ILE A 550 -0.615 1.346 28.682 1.00 0.00 H ATOM 1147 N ALA A 551 -2.552 0.683 31.903 1.00 12.59 N ATOM 1148 CA ALA A 551 -3.944 0.305 32.091 1.00 17.60 C ATOM 1149 C ALA A 551 -4.055 -0.211 33.511 1.00 14.18 C ATOM 1150 O ALA A 551 -3.074 -0.732 34.047 1.00 13.73 O ATOM 1151 CB ALA A 551 -4.351 -0.759 31.057 1.00 16.46 C ATOM 1152 H ALA A 551 -1.823 0.206 32.471 1.00 0.00 H ATOM 1153 N VAL A 552 -5.226 -0.054 34.143 1.00 13.51 N ATOM 1154 CA VAL A 552 -5.268 -0.422 35.564 1.00 9.07 C ATOM 1155 C VAL A 552 -5.029 -1.920 35.750 1.00 13.21 C ATOM 1156 O VAL A 552 -4.447 -2.339 36.755 1.00 18.51 O ATOM 1157 CB VAL A 552 -6.572 0.021 36.253 1.00 12.29 C ATOM 1158 CG1 VAL A 552 -6.664 1.535 36.267 1.00 11.22 C ATOM 1159 CG2 VAL A 552 -7.832 -0.650 35.623 1.00 4.69 C ATOM 1160 H VAL A 552 -6.066 0.311 33.650 1.00 0.00 H ATOM 1161 N ARG A 553 -5.424 -2.739 34.781 1.00 13.55 N ATOM 1162 CA ARG A 553 -5.143 -4.163 34.881 1.00 26.68 C ATOM 1163 C ARG A 553 -3.641 -4.443 34.863 1.00 23.89 C ATOM 1164 O ARG A 553 -3.213 -5.478 35.374 1.00 14.64 O ATOM 1165 CB ARG A 553 -5.863 -4.926 33.759 1.00 21.79 C ATOM 1166 H ARG A 553 -5.932 -2.364 33.955 1.00 0.00 H ATOM 1167 N ASN A 554 -2.821 -3.525 34.354 1.00 12.29 N ATOM 1168 CA ASN A 554 -1.379 -3.747 34.318 1.00 12.97 C ATOM 1169 C ASN A 554 -0.636 -2.830 35.280 1.00 9.91 C ATOM 1170 O ASN A 554 0.512 -2.460 35.042 1.00 14.89 O ATOM 1171 CB ASN A 554 -0.837 -3.586 32.897 1.00 19.27 C ATOM 1172 CG ASN A 554 0.587 -4.078 32.767 1.00 17.00 C ATOM 1173 OD1 ASN A 554 0.964 -5.074 33.385 1.00 18.55 O ATOM 1174 ND2 ASN A 554 1.396 -3.364 32.009 1.00 12.46 N ATOM 1175 HD22 ASN A 554 1.034 -2.529 31.505 1.00 0.00 H ATOM 1176 HD21 ASN A 554 2.396 -3.635 31.916 1.00 0.00 H ATOM 1177 H ASN A 554 -3.213 -2.639 33.977 1.00 0.00 H ATOM 1178 N ILE A 555 -1.283 -2.436 36.367 1.00 13.22 N ATOM 1179 CA ILE A 555 -0.642 -1.660 37.418 1.00 14.05 C ATOM 1180 C ILE A 555 -0.783 -2.438 38.710 1.00 10.29 C ATOM 1181 O ILE A 555 -1.873 -2.929 39.022 1.00 12.74 O ATOM 1182 CB ILE A 555 -1.260 -0.260 37.546 1.00 7.56 C ATOM 1183 CG1 ILE A 555 -0.991 0.492 36.250 1.00 12.87 C ATOM 1184 CG2 ILE A 555 -0.677 0.491 38.767 1.00 10.37 C ATOM 1185 CD1 ILE A 555 -1.916 1.628 36.055 1.00 13.04 C ATOM 1186 H ILE A 555 -2.286 -2.691 36.473 1.00 0.00 H ATOM 1187 N LEU A 556 0.306 -2.535 39.463 1.00 8.89 N ATOM 1188 CA LEU A 556 0.341 -3.362 40.658 1.00 8.37 C ATOM 1189 C LEU A 556 0.231 -2.461 41.879 1.00 13.78 C ATOM 1190 O LEU A 556 0.751 -1.341 41.878 1.00 10.42 O ATOM 1191 CB LEU A 556 1.630 -4.191 40.710 1.00 7.10 C ATOM 1192 CG LEU A 556 1.782 -5.334 39.686 1.00 17.35 C ATOM 1193 CD1 LEU A 556 0.691 -6.413 39.849 1.00 13.93 C ATOM 1194 CD2 LEU A 556 1.827 -4.840 38.248 1.00 4.62 C ATOM 1195 H LEU A 556 1.158 -2.004 39.190 1.00 0.00 H ATOM 1196 N VAL A 557 -0.476 -2.937 42.902 1.00 11.52 N ATOM 1197 CA VAL A 557 -0.593 -2.218 44.166 1.00 12.92 C ATOM 1198 C VAL A 557 0.500 -2.748 45.097 1.00 20.25 C ATOM 1199 O VAL A 557 0.436 -3.890 45.560 1.00 27.00 O ATOM 1200 CB VAL A 557 -1.997 -2.380 44.769 1.00 12.20 C ATOM 1201 CG1 VAL A 557 -2.073 -1.765 46.169 1.00 6.20 C ATOM 1202 CG2 VAL A 557 -3.043 -1.724 43.840 1.00 17.36 C ATOM 1203 H VAL A 557 -0.961 -3.851 42.797 1.00 0.00 H ATOM 1204 N ALA A 558 1.544 -1.948 45.314 1.00 10.41 N ATOM 1205 CA ALA A 558 2.611 -2.343 46.223 1.00 13.79 C ATOM 1206 C ALA A 558 2.189 -2.159 47.666 1.00 9.64 C ATOM 1207 O ALA A 558 2.517 -2.972 48.526 1.00 27.93 O ATOM 1208 CB ALA A 558 3.873 -1.541 45.941 1.00 13.12 C ATOM 1209 H ALA A 558 1.597 -1.030 44.828 1.00 0.00 H ATOM 1210 N SER A 559 1.469 -1.089 47.934 1.00 22.60 N ATOM 1211 CA SER A 559 0.874 -0.816 49.223 1.00 18.31 C ATOM 1212 C SER A 559 -0.307 0.094 48.949 1.00 12.79 C ATOM 1213 O SER A 559 -0.444 0.603 47.825 1.00 13.65 O ATOM 1214 CB SER A 559 1.880 -0.148 50.176 1.00 15.99 C ATOM 1215 OG SER A 559 1.948 1.233 49.895 1.00 20.18 O ATOM 1216 HG SER A 559 2.596 1.662 50.509 1.00 0.00 H ATOM 1217 H SER A 559 1.319 -0.398 47.171 1.00 0.00 H ATOM 1218 N PRO A 560 -1.184 0.310 49.923 1.00 13.86 N ATOM 1219 CA PRO A 560 -2.318 1.208 49.691 1.00 8.39 C ATOM 1220 C PRO A 560 -1.916 2.610 49.234 1.00 15.87 C ATOM 1221 O PRO A 560 -2.740 3.314 48.641 1.00 23.61 O ATOM 1222 CB PRO A 560 -3.023 1.241 51.051 1.00 17.32 C ATOM 1223 CG PRO A 560 -2.646 -0.055 51.691 1.00 20.20 C ATOM 1224 CD PRO A 560 -1.264 -0.345 51.245 1.00 14.10 C ATOM 1225 N GLU A 561 -0.684 3.041 49.466 1.00 11.12 N ATOM 1226 CA GLU A 561 -0.260 4.355 49.002 1.00 23.42 C ATOM 1227 C GLU A 561 0.875 4.277 47.987 1.00 13.24 C ATOM 1228 O GLU A 561 1.632 5.234 47.819 1.00 12.31 O ATOM 1229 CB GLU A 561 0.119 5.234 50.189 1.00 29.20 C ATOM 1230 CG GLU A 561 -1.092 5.630 51.003 1.00 31.55 C ATOM 1231 CD GLU A 561 -0.783 6.661 52.074 1.00 50.47 C ATOM 1232 OE1 GLU A 561 -1.473 7.709 52.092 1.00 53.39 O ATOM 1233 OE2 GLU A 561 0.153 6.428 52.884 1.00 51.26 O ATOM 1234 H GLU A 561 -0.015 2.436 49.983 1.00 0.00 H ATOM 1235 N CYS A 562 1.003 3.156 47.281 1.00 12.63 N ATOM 1236 CA CYS A 562 2.066 3.029 46.287 1.00 11.34 C ATOM 1237 C CYS A 562 1.627 2.043 45.215 1.00 10.87 C ATOM 1238 O CYS A 562 1.405 0.864 45.509 1.00 7.31 O ATOM 1239 CB CYS A 562 3.384 2.573 46.937 1.00 15.48 C ATOM 1240 SG CYS A 562 4.817 2.464 45.769 1.00 23.14 S ATOM 1241 H CYS A 562 0.344 2.367 47.438 1.00 0.00 H ATOM 1242 N VAL A 563 1.503 2.529 43.985 1.00 11.67 N ATOM 1243 CA VAL A 563 1.236 1.690 42.825 1.00 10.43 C ATOM 1244 C VAL A 563 2.495 1.670 41.967 1.00 13.45 C ATOM 1245 O VAL A 563 3.347 2.560 42.057 1.00 12.75 O ATOM 1246 CB VAL A 563 0.009 2.173 42.024 1.00 7.42 C ATOM 1247 CG1 VAL A 563 -1.207 2.211 42.927 1.00 12.07 C ATOM 1248 CG2 VAL A 563 0.251 3.550 41.445 1.00 15.05 C ATOM 1249 H VAL A 563 1.601 3.555 43.844 1.00 0.00 H ATOM 1250 N LYS A 564 2.619 0.624 41.141 1.00 9.21 N ATOM 1251 CA LYS A 564 3.797 0.398 40.306 1.00 13.37 C ATOM 1252 C LYS A 564 3.385 -0.021 38.909 1.00 6.22 C ATOM 1253 O LYS A 564 2.578 -0.928 38.753 1.00 13.03 O ATOM 1254 CB LYS A 564 4.719 -0.683 40.898 1.00 11.49 C ATOM 1255 CG LYS A 564 5.328 -0.335 42.284 1.00 11.53 C ATOM 1256 CD LYS A 564 6.372 -1.321 42.652 1.00 14.72 C ATOM 1257 CE LYS A 564 6.935 -1.065 44.035 1.00 29.88 C ATOM 1258 NZ LYS A 564 7.723 0.199 44.066 1.00 23.69 N ATOM 1259 HZ1 LYS A 564 8.512 0.131 43.392 1.00 0.00 H ATOM 1260 HZ2 LYS A 564 7.108 0.996 43.803 1.00 0.00 H ATOM 1261 HZ3 LYS A 564 8.097 0.350 45.025 1.00 0.00 H ATOM 1262 H LYS A 564 1.839 -0.062 41.091 1.00 0.00 H ATOM 1263 N LEU A 565 3.973 0.602 37.902 1.00 7.58 N ATOM 1264 CA LEU A 565 3.649 0.266 36.518 1.00 11.13 C ATOM 1265 C LEU A 565 4.205 -1.118 36.148 1.00 7.94 C ATOM 1266 O LEU A 565 5.357 -1.440 36.455 1.00 8.88 O ATOM 1267 CB LEU A 565 4.223 1.363 35.609 1.00 10.78 C ATOM 1268 CG LEU A 565 4.050 1.331 34.092 1.00 13.36 C ATOM 1269 CD1 LEU A 565 2.611 1.283 33.712 1.00 13.91 C ATOM 1270 CD2 LEU A 565 4.702 2.535 33.490 1.00 15.56 C ATOM 1271 H LEU A 565 4.677 1.342 38.098 1.00 0.00 H ATOM 1272 N GLY A 566 3.380 -1.948 35.519 1.00 9.05 N ATOM 1273 CA GLY A 566 3.777 -3.288 35.147 1.00 9.55 C ATOM 1274 C GLY A 566 4.614 -3.354 33.872 1.00 12.69 C ATOM 1275 O GLY A 566 5.040 -2.349 33.301 1.00 10.81 O ATOM 1276 H GLY A 566 2.419 -1.624 35.287 1.00 0.00 H ATOM 1277 N ASP A 567 4.800 -4.587 33.398 1.00 14.97 N ATOM 1278 CA ASP A 567 5.642 -4.878 32.239 1.00 18.50 C ATOM 1279 C ASP A 567 5.132 -4.233 30.953 1.00 17.53 C ATOM 1280 O ASP A 567 3.965 -3.838 30.823 1.00 20.41 O ATOM 1281 CB ASP A 567 5.738 -6.392 32.028 1.00 31.72 C ATOM 1282 CG ASP A 567 6.658 -7.042 33.037 1.00 34.93 C ATOM 1283 OD1 ASP A 567 7.774 -6.516 33.193 1.00 33.29 O ATOM 1284 OD2 ASP A 567 6.256 -8.024 33.702 1.00 43.25 O ATOM 1285 H ASP A 567 4.324 -5.379 33.876 1.00 0.00 H ATOM 1286 N PHE A 568 6.024 -4.174 29.970 1.00 19.17 N ATOM 1287 CA PHE A 568 5.719 -3.517 28.712 1.00 20.22 C ATOM 1288 C PHE A 568 4.674 -4.307 27.935 1.00 24.49 C ATOM 1289 O PHE A 568 4.490 -5.509 28.137 1.00 22.23 O ATOM 1290 CB PHE A 568 6.996 -3.339 27.882 1.00 31.73 C ATOM 1291 CG PHE A 568 7.930 -2.302 28.434 1.00 32.11 C ATOM 1292 CD1 PHE A 568 8.061 -1.071 27.817 1.00 32.47 C ATOM 1293 CD2 PHE A 568 8.660 -2.547 29.588 1.00 42.64 C ATOM 1294 CE1 PHE A 568 8.897 -0.105 28.329 1.00 25.94 C ATOM 1295 CE2 PHE A 568 9.501 -1.578 30.111 1.00 36.43 C ATOM 1296 CZ PHE A 568 9.621 -0.354 29.482 1.00 26.96 C ATOM 1297 H PHE A 568 6.960 -4.607 30.105 1.00 0.00 H ATOM 1298 N GLY A 569 3.968 -3.607 27.054 1.00 27.93 N ATOM 1299 CA GLY A 569 2.970 -4.242 26.210 1.00 36.27 C ATOM 1300 C GLY A 569 3.576 -4.733 24.906 1.00 36.53 C ATOM 1301 O GLY A 569 4.536 -4.131 24.413 1.00 24.27 O ATOM 1302 H GLY A 569 4.133 -2.584 26.967 1.00 0.00 H TER 1303 GLY A 569 ATOM 1304 N PRO A 588 -5.697 -3.870 23.037 1.00 40.56 N ATOM 1305 CA PRO A 588 -6.367 -2.838 23.847 1.00 28.62 C ATOM 1306 C PRO A 588 -6.931 -1.673 23.027 1.00 11.90 C ATOM 1307 O PRO A 588 -6.548 -0.542 23.304 1.00 21.80 O ATOM 1308 CB PRO A 588 -5.242 -2.355 24.781 1.00 26.45 C ATOM 1309 CG PRO A 588 -3.981 -2.576 23.969 1.00 21.26 C ATOM 1310 CD PRO A 588 -4.235 -3.867 23.237 1.00 40.44 C ATOM 1311 HN2 PRO A 588 -5.899 -3.692 22.032 1.00 0.00 H ATOM 1312 HN1 PRO A 588 -6.071 -4.803 23.305 1.00 0.00 H ATOM 1313 N ILE A 589 -7.839 -1.943 22.078 1.00 15.51 N ATOM 1314 CA ILE A 589 -8.355 -0.904 21.181 1.00 15.05 C ATOM 1315 C ILE A 589 -8.932 0.279 21.964 1.00 17.88 C ATOM 1316 O ILE A 589 -8.798 1.439 21.546 1.00 13.87 O ATOM 1317 CB ILE A 589 -9.405 -1.503 20.217 1.00 20.84 C ATOM 1318 CG1 ILE A 589 -8.809 -2.648 19.375 1.00 31.50 C ATOM 1319 CG2 ILE A 589 -10.006 -0.423 19.302 1.00 18.94 C ATOM 1320 CD1 ILE A 589 -7.686 -2.262 18.396 1.00 18.50 C ATOM 1321 H ILE A 589 -8.187 -2.917 21.975 1.00 0.00 H ATOM 1322 N LYS A 590 -9.603 0.019 23.097 1.00 16.38 N ATOM 1323 CA LYS A 590 -10.302 1.113 23.767 1.00 16.82 C ATOM 1324 C LYS A 590 -9.389 1.985 24.623 1.00 18.28 C ATOM 1325 O LYS A 590 -9.850 3.006 25.141 1.00 11.04 O ATOM 1326 CB LYS A 590 -11.466 0.571 24.599 1.00 14.00 C ATOM 1327 CG LYS A 590 -12.616 0.124 23.733 1.00 16.57 C ATOM 1328 CD LYS A 590 -13.395 -1.005 24.380 1.00 18.69 C ATOM 1329 CE LYS A 590 -14.459 -1.518 23.433 1.00 23.53 C ATOM 1330 NZ LYS A 590 -15.515 -2.270 24.165 1.00 17.21 N ATOM 1331 HZ1 LYS A 590 -15.086 -3.082 24.653 1.00 0.00 H ATOM 1332 HZ2 LYS A 590 -15.965 -1.643 24.862 1.00 0.00 H ATOM 1333 HZ3 LYS A 590 -16.229 -2.609 23.489 1.00 0.00 H ATOM 1334 H LYS A 590 -9.625 -0.943 23.491 1.00 0.00 H ATOM 1335 N TRP A 591 -8.109 1.633 24.737 1.00 14.11 N ATOM 1336 CA TRP A 591 -7.083 2.413 25.416 1.00 17.92 C ATOM 1337 C TRP A 591 -6.158 3.154 24.456 1.00 14.94 C ATOM 1338 O TRP A 591 -5.325 3.943 24.908 1.00 18.83 O ATOM 1339 CB TRP A 591 -6.213 1.493 26.315 1.00 22.20 C ATOM 1340 CG TRP A 591 -6.943 0.846 27.477 1.00 13.51 C ATOM 1341 CD1 TRP A 591 -6.887 1.229 28.804 1.00 15.92 C ATOM 1342 CD2 TRP A 591 -7.863 -0.265 27.425 1.00 13.13 C ATOM 1343 NE1 TRP A 591 -7.696 0.422 29.563 1.00 12.39 N ATOM 1344 CE2 TRP A 591 -8.304 -0.504 28.751 1.00 16.26 C ATOM 1345 CE3 TRP A 591 -8.323 -1.097 26.401 1.00 11.79 C ATOM 1346 CZ2 TRP A 591 -9.192 -1.541 29.074 1.00 16.09 C ATOM 1347 CZ3 TRP A 591 -9.232 -2.111 26.718 1.00 13.64 C ATOM 1348 CH2 TRP A 591 -9.644 -2.330 28.046 1.00 17.40 C ATOM 1349 HE1 TRP A 591 -7.828 0.499 30.592 1.00 0.00 H ATOM 1350 H TRP A 591 -7.820 0.731 24.308 1.00 0.00 H ATOM 1351 N MET A 592 -6.263 2.912 23.157 1.00 13.61 N ATOM 1352 CA MET A 592 -5.244 3.337 22.210 1.00 13.37 C ATOM 1353 C MET A 592 -5.630 4.640 21.527 1.00 14.96 C ATOM 1354 O MET A 592 -6.805 4.903 21.264 1.00 17.17 O ATOM 1355 CB MET A 592 -5.008 2.254 21.149 1.00 15.12 C ATOM 1356 CG MET A 592 -4.423 0.991 21.702 1.00 20.37 C ATOM 1357 SD MET A 592 -4.645 -0.377 20.566 1.00 30.63 S ATOM 1358 CE MET A 592 -3.906 0.353 19.098 1.00 15.71 C ATOM 1359 H MET A 592 -7.099 2.403 22.804 1.00 0.00 H ATOM 1360 N SER A 593 -4.619 5.427 21.200 1.00 16.01 N ATOM 1361 CA SER A 593 -4.778 6.661 20.441 1.00 16.49 C ATOM 1362 C SER A 593 -5.264 6.354 19.028 1.00 17.44 C ATOM 1363 O SER A 593 -5.199 5.194 18.585 1.00 13.73 O ATOM 1364 CB SER A 593 -3.449 7.409 20.380 1.00 16.16 C ATOM 1365 OG SER A 593 -2.516 6.661 19.624 1.00 24.21 O ATOM 1366 HG SER A 593 -2.378 5.779 20.052 1.00 0.00 H ATOM 1367 H SER A 593 -3.662 5.151 21.500 1.00 0.00 H ATOM 1368 N PRO A 594 -5.745 7.362 18.293 1.00 17.52 N ATOM 1369 CA PRO A 594 -6.206 7.102 16.919 1.00 28.36 C ATOM 1370 C PRO A 594 -5.094 6.654 15.998 1.00 21.04 C ATOM 1371 O PRO A 594 -5.326 5.822 15.112 1.00 12.28 O ATOM 1372 CB PRO A 594 -6.767 8.459 16.474 1.00 17.61 C ATOM 1373 CG PRO A 594 -7.018 9.202 17.720 1.00 19.67 C ATOM 1374 CD PRO A 594 -5.984 8.759 18.689 1.00 15.21 C ATOM 1375 N GLU A 595 -3.900 7.226 16.162 1.00 18.70 N ATOM 1376 CA GLU A 595 -2.786 6.913 15.283 1.00 21.08 C ATOM 1377 C GLU A 595 -2.209 5.542 15.570 1.00 29.41 C ATOM 1378 O GLU A 595 -1.518 4.993 14.710 1.00 25.62 O ATOM 1379 CB GLU A 595 -1.691 7.982 15.396 1.00 18.95 C ATOM 1380 CG GLU A 595 -0.833 7.878 16.638 1.00 27.06 C ATOM 1381 CD GLU A 595 -1.349 8.696 17.816 1.00 24.81 C ATOM 1382 OE1 GLU A 595 -2.520 9.118 17.794 1.00 18.04 O ATOM 1383 OE2 GLU A 595 -0.573 8.891 18.786 1.00 21.99 O ATOM 1384 H GLU A 595 -3.764 7.909 16.934 1.00 0.00 H ATOM 1385 N SER A 596 -2.477 4.978 16.757 1.00 23.26 N ATOM 1386 CA SER A 596 -2.138 3.583 17.018 1.00 21.62 C ATOM 1387 C SER A 596 -3.189 2.637 16.438 1.00 17.72 C ATOM 1388 O SER A 596 -2.847 1.586 15.883 1.00 18.56 O ATOM 1389 CB SER A 596 -1.987 3.344 18.528 1.00 28.46 C ATOM 1390 OG SER A 596 -1.108 4.276 19.149 1.00 24.96 O ATOM 1391 HG SER A 596 -0.210 4.204 18.740 1.00 0.00 H ATOM 1392 H SER A 596 -2.933 5.543 17.502 1.00 0.00 H ATOM 1393 N ILE A 597 -4.472 2.991 16.554 1.00 20.08 N ATOM 1394 CA ILE A 597 -5.530 2.136 16.019 1.00 17.51 C ATOM 1395 C ILE A 597 -5.456 2.077 14.497 1.00 23.37 C ATOM 1396 O ILE A 597 -5.647 1.014 13.891 1.00 14.36 O ATOM 1397 CB ILE A 597 -6.906 2.630 16.493 1.00 13.74 C ATOM 1398 CG1 ILE A 597 -7.050 2.472 18.014 1.00 17.57 C ATOM 1399 CG2 ILE A 597 -8.024 1.876 15.749 1.00 28.33 C ATOM 1400 CD1 ILE A 597 -8.404 2.984 18.599 1.00 10.95 C ATOM 1401 H ILE A 597 -4.720 3.882 17.029 1.00 0.00 H ATOM 1402 N ASN A 598 -5.175 3.211 13.857 1.00 21.26 N ATOM 1403 CA ASN A 598 -5.180 3.299 12.401 1.00 25.80 C ATOM 1404 C ASN A 598 -3.855 2.898 11.777 1.00 26.45 C ATOM 1405 O ASN A 598 -3.833 2.278 10.715 1.00 22.51 O ATOM 1406 CB ASN A 598 -5.525 4.726 11.958 1.00 24.46 C ATOM 1407 CG ASN A 598 -6.977 5.045 12.145 1.00 24.68 C ATOM 1408 OD1 ASN A 598 -7.834 4.166 12.009 1.00 23.35 O ATOM 1409 ND2 ASN A 598 -7.275 6.299 12.450 1.00 26.05 N ATOM 1410 HD22 ASN A 598 -6.517 7.003 12.554 1.00 0.00 H ATOM 1411 HD21 ASN A 598 -8.267 6.579 12.586 1.00 0.00 H ATOM 1412 H ASN A 598 -4.945 4.060 14.412 1.00 0.00 H ATOM 1413 N PHE A 599 -2.736 3.266 12.387 1.00 26.17 N ATOM 1414 CA PHE A 599 -1.453 3.102 11.726 1.00 22.75 C ATOM 1415 C PHE A 599 -0.476 2.245 12.508 1.00 27.92 C ATOM 1416 O PHE A 599 0.674 2.107 12.081 1.00 28.61 O ATOM 1417 CB PHE A 599 -0.869 4.479 11.434 1.00 36.48 C ATOM 1418 CG PHE A 599 -1.840 5.383 10.730 1.00 35.12 C ATOM 1419 CD1 PHE A 599 -2.262 6.563 11.311 1.00 28.63 C ATOM 1420 CD2 PHE A 599 -2.379 5.014 9.500 1.00 37.88 C ATOM 1421 CE1 PHE A 599 -3.172 7.384 10.656 1.00 37.53 C ATOM 1422 CE2 PHE A 599 -3.278 5.837 8.842 1.00 30.99 C ATOM 1423 CZ PHE A 599 -3.681 7.012 9.420 1.00 22.70 C ATOM 1424 H PHE A 599 -2.777 3.674 13.343 1.00 0.00 H ATOM 1425 N ARG A 600 -0.917 1.630 13.612 1.00 24.86 N ATOM 1426 CA ARG A 600 -0.051 0.825 14.482 1.00 34.14 C ATOM 1427 C ARG A 600 1.200 1.596 14.871 1.00 18.11 C ATOM 1428 O ARG A 600 2.286 1.036 14.973 1.00 27.86 O ATOM 1429 CB ARG A 600 0.313 -0.519 13.837 1.00 23.09 C ATOM 1430 H ARG A 600 -1.921 1.727 13.866 1.00 0.00 H ATOM 1431 N ARG A 601 1.041 2.895 15.080 1.00 28.31 N ATOM 1432 CA ARG A 601 2.126 3.785 15.460 1.00 27.47 C ATOM 1433 C ARG A 601 2.039 4.057 16.958 1.00 25.43 C ATOM 1434 O ARG A 601 1.000 4.504 17.452 1.00 30.67 O ATOM 1435 CB ARG A 601 2.051 5.092 14.671 1.00 16.22 C ATOM 1436 CG ARG A 601 3.056 6.123 15.131 1.00 20.19 C ATOM 1437 CD ARG A 601 3.275 7.185 14.067 1.00 36.89 C ATOM 1438 NE ARG A 601 2.017 7.782 13.635 1.00 37.65 N ATOM 1439 CZ ARG A 601 1.885 8.565 12.568 1.00 48.51 C ATOM 1440 NH1 ARG A 601 2.935 8.846 11.803 1.00 59.00 N ATOM 1441 NH2 ARG A 601 0.697 9.063 12.258 1.00 50.27 N ATOM 1442 HE ARG A 601 1.166 7.582 14.199 1.00 0.00 H ATOM 1443 HH12 ARG A 601 2.823 9.459 10.971 1.00 0.00 H ATOM 1444 HH11 ARG A 601 3.869 8.453 12.037 1.00 0.00 H ATOM 1445 HH22 ARG A 601 0.591 9.675 11.424 1.00 0.00 H ATOM 1446 HH21 ARG A 601 -0.130 8.841 12.849 1.00 0.00 H ATOM 1447 H ARG A 601 0.090 3.299 14.966 1.00 0.00 H ATOM 1448 N PHE A 602 3.125 3.795 17.670 1.00 32.00 N ATOM 1449 CA PHE A 602 3.196 3.994 19.112 1.00 25.34 C ATOM 1450 C PHE A 602 4.400 4.874 19.405 1.00 21.56 C ATOM 1451 O PHE A 602 5.533 4.508 19.075 1.00 26.93 O ATOM 1452 CB PHE A 602 3.316 2.659 19.859 1.00 19.55 C ATOM 1453 CG PHE A 602 2.163 1.709 19.628 1.00 32.62 C ATOM 1454 CD1 PHE A 602 1.066 1.702 20.475 1.00 29.56 C ATOM 1455 CD2 PHE A 602 2.186 0.808 18.573 1.00 31.21 C ATOM 1456 CE1 PHE A 602 0.013 0.822 20.268 1.00 30.90 C ATOM 1457 CE2 PHE A 602 1.128 -0.072 18.362 1.00 23.28 C ATOM 1458 CZ PHE A 602 0.051 -0.065 19.205 1.00 20.52 C ATOM 1459 H PHE A 602 3.965 3.431 17.177 1.00 0.00 H ATOM 1460 N THR A 603 4.154 6.023 20.023 1.00 20.50 N ATOM 1461 CA THR A 603 5.165 7.000 20.397 1.00 14.01 C ATOM 1462 C THR A 603 4.949 7.393 21.861 1.00 21.85 C ATOM 1463 O THR A 603 4.015 6.931 22.511 1.00 15.00 O ATOM 1464 CB THR A 603 5.066 8.246 19.515 1.00 30.08 C ATOM 1465 OG1 THR A 603 3.799 8.851 19.755 1.00 20.97 O ATOM 1466 CG2 THR A 603 5.172 7.902 18.033 1.00 28.05 C ATOM 1467 HG1 THR A 603 3.080 8.210 19.526 1.00 0.00 H ATOM 1468 H THR A 603 3.164 6.241 20.257 1.00 0.00 H ATOM 1469 N THR A 604 5.783 8.294 22.392 1.00 17.63 N ATOM 1470 CA THR A 604 5.498 8.781 23.738 1.00 17.58 C ATOM 1471 C THR A 604 4.173 9.536 23.784 1.00 15.39 C ATOM 1472 O THR A 604 3.450 9.451 24.783 1.00 13.36 O ATOM 1473 CB THR A 604 6.636 9.669 24.249 1.00 19.70 C ATOM 1474 OG1 THR A 604 6.920 10.671 23.273 1.00 33.20 O ATOM 1475 CG2 THR A 604 7.888 8.869 24.494 1.00 18.12 C ATOM 1476 HG1 THR A 604 6.111 11.220 23.121 1.00 0.00 H ATOM 1477 H THR A 604 6.609 8.637 21.862 1.00 0.00 H ATOM 1478 N ALA A 605 3.825 10.250 22.705 1.00 12.13 N ATOM 1479 CA ALA A 605 2.543 10.946 22.638 1.00 14.98 C ATOM 1480 C ALA A 605 1.365 9.986 22.674 1.00 17.49 C ATOM 1481 O ALA A 605 0.290 10.329 23.198 1.00 12.18 O ATOM 1482 CB ALA A 605 2.458 11.801 21.360 1.00 16.60 C ATOM 1483 H ALA A 605 4.480 10.310 21.900 1.00 0.00 H ATOM 1484 N SER A 606 1.504 8.818 22.056 1.00 14.71 N ATOM 1485 CA SER A 606 0.399 7.877 22.124 1.00 17.75 C ATOM 1486 C SER A 606 0.330 7.225 23.502 1.00 14.49 C ATOM 1487 O SER A 606 -0.763 6.888 23.965 1.00 15.48 O ATOM 1488 CB SER A 606 0.514 6.836 21.005 1.00 19.20 C ATOM 1489 OG SER A 606 1.312 5.746 21.401 1.00 26.56 O ATOM 1490 HG SER A 606 0.907 5.313 22.194 1.00 0.00 H ATOM 1491 H SER A 606 2.376 8.585 21.540 1.00 0.00 H ATOM 1492 N ASP A 607 1.472 7.073 24.182 1.00 10.74 N ATOM 1493 CA ASP A 607 1.444 6.690 25.592 1.00 11.19 C ATOM 1494 C ASP A 607 0.738 7.742 26.449 1.00 10.63 C ATOM 1495 O ASP A 607 0.037 7.382 27.400 1.00 13.93 O ATOM 1496 CB ASP A 607 2.871 6.431 26.102 1.00 20.06 C ATOM 1497 CG ASP A 607 3.313 4.939 25.971 1.00 23.44 C ATOM 1498 OD1 ASP A 607 2.556 4.097 25.444 1.00 33.72 O ATOM 1499 OD2 ASP A 607 4.442 4.602 26.408 1.00 19.93 O ATOM 1500 H ASP A 607 2.383 7.228 23.705 1.00 0.00 H ATOM 1501 N VAL A 608 0.883 9.042 26.131 1.00 14.39 N ATOM 1502 CA VAL A 608 0.182 10.079 26.902 1.00 17.44 C ATOM 1503 C VAL A 608 -1.340 9.919 26.779 1.00 17.02 C ATOM 1504 O VAL A 608 -2.083 10.022 27.772 1.00 11.73 O ATOM 1505 CB VAL A 608 0.627 11.491 26.464 1.00 15.19 C ATOM 1506 CG1 VAL A 608 -0.410 12.503 26.862 1.00 14.03 C ATOM 1507 CG2 VAL A 608 1.984 11.880 27.094 1.00 10.74 C ATOM 1508 H VAL A 608 1.495 9.314 25.335 1.00 0.00 H ATOM 1509 N TRP A 609 -1.833 9.716 25.555 1.00 9.39 N ATOM 1510 CA TRP A 609 -3.253 9.400 25.376 1.00 10.32 C ATOM 1511 C TRP A 609 -3.653 8.220 26.264 1.00 11.51 C ATOM 1512 O TRP A 609 -4.631 8.284 27.011 1.00 7.80 O ATOM 1513 CB TRP A 609 -3.542 9.074 23.909 1.00 10.11 C ATOM 1514 CG TRP A 609 -4.979 8.596 23.614 1.00 13.31 C ATOM 1515 CD1 TRP A 609 -5.579 7.443 24.038 1.00 16.65 C ATOM 1516 CD2 TRP A 609 -5.947 9.275 22.809 1.00 9.64 C ATOM 1517 NE1 TRP A 609 -6.881 7.376 23.559 1.00 18.62 N ATOM 1518 CE2 TRP A 609 -7.123 8.492 22.803 1.00 18.16 C ATOM 1519 CE3 TRP A 609 -5.940 10.483 22.108 1.00 12.11 C ATOM 1520 CZ2 TRP A 609 -8.280 8.880 22.116 1.00 18.07 C ATOM 1521 CZ3 TRP A 609 -7.084 10.864 21.417 1.00 12.87 C ATOM 1522 CH2 TRP A 609 -8.237 10.066 21.430 1.00 18.70 C ATOM 1523 HE1 TRP A 609 -7.558 6.608 23.743 1.00 0.00 H ATOM 1524 H TRP A 609 -1.208 9.782 24.726 1.00 0.00 H ATOM 1525 N MET A 610 -2.898 7.127 26.184 1.00 9.19 N ATOM 1526 CA MET A 610 -3.293 5.935 26.922 1.00 12.66 C ATOM 1527 C MET A 610 -3.242 6.195 28.417 1.00 6.98 C ATOM 1528 O MET A 610 -4.085 5.696 29.177 1.00 8.68 O ATOM 1529 CB MET A 610 -2.390 4.770 26.538 1.00 9.62 C ATOM 1530 CG MET A 610 -2.816 3.448 27.110 1.00 16.29 C ATOM 1531 SD MET A 610 -1.705 2.119 26.606 1.00 19.94 S ATOM 1532 CE MET A 610 -2.717 0.698 27.030 1.00 20.96 C ATOM 1533 H MET A 610 -2.036 7.124 25.602 1.00 0.00 H ATOM 1534 N PHE A 611 -2.256 6.987 28.847 1.00 10.58 N ATOM 1535 CA PHE A 611 -2.161 7.390 30.244 1.00 13.14 C ATOM 1536 C PHE A 611 -3.431 8.074 30.716 1.00 5.84 C ATOM 1537 O PHE A 611 -3.917 7.798 31.818 1.00 7.93 O ATOM 1538 CB PHE A 611 -0.980 8.330 30.476 1.00 12.03 C ATOM 1539 CG PHE A 611 -0.987 8.900 31.841 1.00 17.37 C ATOM 1540 CD1 PHE A 611 -0.754 8.076 32.933 1.00 15.89 C ATOM 1541 CD2 PHE A 611 -1.270 10.238 32.050 1.00 8.94 C ATOM 1542 CE1 PHE A 611 -0.782 8.580 34.205 1.00 12.66 C ATOM 1543 CE2 PHE A 611 -1.289 10.743 33.326 1.00 15.18 C ATOM 1544 CZ PHE A 611 -1.055 9.907 34.400 1.00 9.14 C ATOM 1545 H PHE A 611 -1.541 7.323 28.170 1.00 0.00 H ATOM 1546 N ALA A 612 -3.969 8.983 29.908 1.00 8.19 N ATOM 1547 CA ALA A 612 -5.224 9.634 30.269 1.00 13.73 C ATOM 1548 C ALA A 612 -6.368 8.624 30.309 1.00 11.10 C ATOM 1549 O ALA A 612 -7.249 8.711 31.171 1.00 9.05 O ATOM 1550 CB ALA A 612 -5.556 10.768 29.292 1.00 4.87 C ATOM 1551 H ALA A 612 -3.494 9.231 29.017 1.00 0.00 H ATOM 1552 N VAL A 613 -6.385 7.662 29.381 1.00 8.13 N ATOM 1553 CA VAL A 613 -7.376 6.582 29.506 1.00 5.42 C ATOM 1554 C VAL A 613 -7.246 5.882 30.863 1.00 11.49 C ATOM 1555 O VAL A 613 -8.247 5.637 31.555 1.00 7.45 O ATOM 1556 CB VAL A 613 -7.244 5.588 28.348 1.00 11.70 C ATOM 1557 CG1 VAL A 613 -8.231 4.441 28.548 1.00 14.96 C ATOM 1558 CG2 VAL A 613 -7.455 6.279 27.010 1.00 8.04 C ATOM 1559 H VAL A 613 -5.712 7.677 28.588 1.00 0.00 H ATOM 1560 N CYS A 614 -6.005 5.575 31.275 1.00 8.36 N ATOM 1561 CA CYS A 614 -5.765 4.943 32.567 1.00 3.27 C ATOM 1562 C CYS A 614 -6.262 5.800 33.744 1.00 10.62 C ATOM 1563 O CYS A 614 -6.832 5.274 34.711 1.00 10.04 O ATOM 1564 CB CYS A 614 -4.273 4.666 32.714 1.00 18.10 C ATOM 1565 SG CYS A 614 -3.898 3.619 34.105 1.00 23.20 S ATOM 1566 H CYS A 614 -5.197 5.793 30.658 1.00 0.00 H ATOM 1567 N MET A 615 -6.044 7.110 33.695 1.00 9.28 N ATOM 1568 CA MET A 615 -6.600 7.984 34.733 1.00 11.73 C ATOM 1569 C MET A 615 -8.112 7.923 34.749 1.00 7.05 C ATOM 1570 O MET A 615 -8.744 7.927 35.818 1.00 7.28 O ATOM 1571 CB MET A 615 -6.198 9.424 34.513 1.00 3.27 C ATOM 1572 CG MET A 615 -4.776 9.731 34.544 1.00 14.33 C ATOM 1573 SD MET A 615 -4.700 11.534 34.636 1.00 29.27 S ATOM 1574 CE MET A 615 -3.440 11.658 35.759 1.00 28.60 C ATOM 1575 H MET A 615 -5.480 7.515 32.921 1.00 0.00 H ATOM 1576 N TRP A 616 -8.717 7.961 33.568 1.00 8.90 N ATOM 1577 CA TRP A 616 -10.159 7.778 33.515 1.00 8.08 C ATOM 1578 C TRP A 616 -10.549 6.483 34.228 1.00 6.70 C ATOM 1579 O TRP A 616 -11.476 6.472 35.041 1.00 8.84 O ATOM 1580 CB TRP A 616 -10.635 7.810 32.060 1.00 5.44 C ATOM 1581 CG TRP A 616 -12.148 7.792 31.916 1.00 9.23 C ATOM 1582 CD1 TRP A 616 -12.993 8.871 31.828 1.00 14.39 C ATOM 1583 CD2 TRP A 616 -12.979 6.631 31.826 1.00 11.41 C ATOM 1584 NE1 TRP A 616 -14.312 8.441 31.693 1.00 9.45 N ATOM 1585 CE2 TRP A 616 -14.326 7.075 31.697 1.00 9.71 C ATOM 1586 CE3 TRP A 616 -12.721 5.262 31.851 1.00 10.94 C ATOM 1587 CZ2 TRP A 616 -15.395 6.191 31.590 1.00 8.12 C ATOM 1588 CZ3 TRP A 616 -13.787 4.383 31.758 1.00 8.64 C ATOM 1589 CH2 TRP A 616 -15.105 4.851 31.628 1.00 11.19 C ATOM 1590 HE1 TRP A 616 -15.145 9.057 31.604 1.00 0.00 H ATOM 1591 H TRP A 616 -8.170 8.119 32.697 1.00 0.00 H ATOM 1592 N GLU A 617 -9.831 5.386 33.964 1.00 10.17 N ATOM 1593 CA GLU A 617 -10.147 4.117 34.639 1.00 10.97 C ATOM 1594 C GLU A 617 -10.018 4.240 36.156 1.00 8.10 C ATOM 1595 O GLU A 617 -10.783 3.624 36.914 1.00 12.53 O ATOM 1596 CB GLU A 617 -9.220 2.995 34.162 1.00 7.35 C ATOM 1597 CG GLU A 617 -9.366 2.530 32.736 1.00 11.46 C ATOM 1598 CD GLU A 617 -8.728 1.144 32.535 1.00 26.85 C ATOM 1599 OE1 GLU A 617 -7.489 1.007 32.651 1.00 32.03 O ATOM 1600 OE2 GLU A 617 -9.484 0.175 32.337 1.00 31.16 O ATOM 1601 H GLU A 617 -9.048 5.430 33.281 1.00 0.00 H ATOM 1602 N ILE A 618 -9.010 4.971 36.622 1.00 10.33 N ATOM 1603 CA ILE A 618 -8.791 5.084 38.056 1.00 9.81 C ATOM 1604 C ILE A 618 -9.904 5.909 38.692 1.00 11.63 C ATOM 1605 O ILE A 618 -10.503 5.515 39.702 1.00 10.62 O ATOM 1606 CB ILE A 618 -7.398 5.680 38.322 1.00 13.62 C ATOM 1607 CG1 ILE A 618 -6.305 4.698 37.883 1.00 15.23 C ATOM 1608 CG2 ILE A 618 -7.236 6.054 39.767 1.00 16.66 C ATOM 1609 CD1 ILE A 618 -4.878 5.314 37.855 1.00 9.15 C ATOM 1610 H ILE A 618 -8.377 5.463 35.960 1.00 0.00 H ATOM 1611 N LEU A 619 -10.215 7.053 38.097 1.00 6.55 N ATOM 1612 CA LEU A 619 -11.276 7.900 38.637 1.00 12.41 C ATOM 1613 C LEU A 619 -12.655 7.256 38.523 1.00 19.13 C ATOM 1614 O LEU A 619 -13.572 7.667 39.236 1.00 12.11 O ATOM 1615 CB LEU A 619 -11.274 9.249 37.932 1.00 7.90 C ATOM 1616 CG LEU A 619 -10.346 10.277 38.587 1.00 14.66 C ATOM 1617 CD1 LEU A 619 -10.846 10.618 39.974 1.00 22.59 C ATOM 1618 CD2 LEU A 619 -8.915 9.759 38.678 1.00 13.72 C ATOM 1619 H LEU A 619 -9.701 7.348 37.242 1.00 0.00 H ATOM 1620 N SER A 620 -12.797 6.241 37.667 1.00 9.41 N ATOM 1621 CA SER A 620 -14.013 5.472 37.496 1.00 13.88 C ATOM 1622 C SER A 620 -13.999 4.197 38.332 1.00 13.52 C ATOM 1623 O SER A 620 -14.841 3.334 38.126 1.00 11.36 O ATOM 1624 CB SER A 620 -14.210 5.105 36.015 1.00 9.63 C ATOM 1625 OG SER A 620 -14.202 6.247 35.159 1.00 20.64 O ATOM 1626 HG SER A 620 -13.334 6.715 35.243 1.00 0.00 H ATOM 1627 H SER A 620 -11.977 5.984 37.082 1.00 0.00 H ATOM 1628 N PHE A 621 -13.015 4.034 39.213 1.00 14.94 N ATOM 1629 CA PHE A 621 -12.903 2.863 40.082 1.00 18.57 C ATOM 1630 C PHE A 621 -12.794 1.555 39.303 1.00 13.47 C ATOM 1631 O PHE A 621 -13.253 0.509 39.761 1.00 14.86 O ATOM 1632 CB PHE A 621 -14.075 2.801 41.062 1.00 24.91 C ATOM 1633 CG PHE A 621 -14.092 3.930 42.043 1.00 11.97 C ATOM 1634 CD1 PHE A 621 -14.954 4.992 41.883 1.00 16.83 C ATOM 1635 CD2 PHE A 621 -13.242 3.915 43.135 1.00 19.39 C ATOM 1636 CE1 PHE A 621 -14.970 6.025 42.788 1.00 23.15 C ATOM 1637 CE2 PHE A 621 -13.255 4.933 44.052 1.00 10.98 C ATOM 1638 CZ PHE A 621 -14.109 5.991 43.885 1.00 24.57 C ATOM 1639 H PHE A 621 -12.290 4.776 39.287 1.00 0.00 H ATOM 1640 N GLY A 622 -12.196 1.600 38.122 1.00 17.85 N ATOM 1641 CA GLY A 622 -11.901 0.414 37.357 1.00 11.38 C ATOM 1642 C GLY A 622 -12.830 0.073 36.202 1.00 24.16 C ATOM 1643 O GLY A 622 -12.660 -0.995 35.611 1.00 18.25 O ATOM 1644 H GLY A 622 -11.929 2.526 37.732 1.00 0.00 H ATOM 1645 N LYS A 623 -13.808 0.923 35.864 1.00 11.46 N ATOM 1646 CA LYS A 623 -14.635 0.648 34.690 1.00 11.33 C ATOM 1647 C LYS A 623 -13.771 0.551 33.427 1.00 10.52 C ATOM 1648 O LYS A 623 -12.690 1.135 33.328 1.00 13.13 O ATOM 1649 CB LYS A 623 -15.713 1.733 34.504 1.00 15.93 C ATOM 1650 CG LYS A 623 -16.763 1.818 35.644 1.00 24.42 C ATOM 1651 CD LYS A 623 -17.649 3.083 35.513 1.00 31.57 C ATOM 1652 CE LYS A 623 -18.656 3.222 36.673 1.00 23.82 C ATOM 1653 NZ LYS A 623 -18.041 3.466 38.028 1.00 23.35 N ATOM 1654 HZ1 LYS A 623 -17.415 2.672 38.271 1.00 0.00 H ATOM 1655 HZ2 LYS A 623 -17.491 4.348 38.004 1.00 0.00 H ATOM 1656 HZ3 LYS A 623 -18.795 3.545 38.740 1.00 0.00 H ATOM 1657 H LYS A 623 -13.979 1.776 36.434 1.00 0.00 H ATOM 1658 N GLN A 624 -14.256 -0.190 32.459 1.00 15.35 N ATOM 1659 CA GLN A 624 -13.521 -0.295 31.208 1.00 13.06 C ATOM 1660 C GLN A 624 -13.858 0.882 30.290 1.00 14.35 C ATOM 1661 O GLN A 624 -15.028 1.270 30.165 1.00 7.64 O ATOM 1662 CB GLN A 624 -13.836 -1.625 30.518 1.00 23.25 C ATOM 1663 CG GLN A 624 -13.423 -1.726 29.046 1.00 24.98 C ATOM 1664 CD GLN A 624 -14.047 -2.943 28.370 1.00 40.58 C ATOM 1665 OE1 GLN A 624 -15.000 -2.819 27.598 1.00 33.11 O ATOM 1666 NE2 GLN A 624 -13.511 -4.125 28.661 1.00 57.83 N ATOM 1667 HE22 GLN A 624 -12.707 -4.184 29.318 1.00 0.00 H ATOM 1668 HE21 GLN A 624 -13.896 -4.990 28.231 1.00 0.00 H ATOM 1669 H GLN A 624 -15.156 -0.697 32.585 1.00 0.00 H ATOM 1670 N PRO A 625 -12.853 1.478 29.655 1.00 11.52 N ATOM 1671 CA PRO A 625 -13.129 2.615 28.761 1.00 15.74 C ATOM 1672 C PRO A 625 -13.996 2.145 27.613 1.00 13.07 C ATOM 1673 O PRO A 625 -13.764 1.071 27.053 1.00 12.17 O ATOM 1674 CB PRO A 625 -11.736 3.050 28.282 1.00 8.86 C ATOM 1675 CG PRO A 625 -10.832 1.795 28.569 1.00 12.67 C ATOM 1676 CD PRO A 625 -11.408 1.180 29.780 1.00 3.27 C ATOM 1677 N PHE A 626 -15.017 2.947 27.288 1.00 8.97 N ATOM 1678 CA PHE A 626 -15.924 2.660 26.167 1.00 14.01 C ATOM 1679 C PHE A 626 -16.587 1.291 26.304 1.00 11.18 C ATOM 1680 O PHE A 626 -16.723 0.551 25.325 1.00 23.44 O ATOM 1681 CB PHE A 626 -15.199 2.762 24.817 1.00 8.81 C ATOM 1682 CG PHE A 626 -14.655 4.134 24.508 1.00 13.78 C ATOM 1683 CD1 PHE A 626 -15.509 5.217 24.337 1.00 7.98 C ATOM 1684 CD2 PHE A 626 -13.282 4.334 24.370 1.00 15.34 C ATOM 1685 CE1 PHE A 626 -14.998 6.482 24.045 1.00 15.20 C ATOM 1686 CE2 PHE A 626 -12.774 5.579 24.076 1.00 8.74 C ATOM 1687 CZ PHE A 626 -13.633 6.659 23.912 1.00 13.49 C ATOM 1688 H PHE A 626 -15.175 3.807 27.851 1.00 0.00 H ATOM 1689 N PHE A 627 -17.027 0.947 27.516 1.00 10.26 N ATOM 1690 CA PHE A 627 -17.645 -0.366 27.729 1.00 14.06 C ATOM 1691 C PHE A 627 -19.015 -0.458 27.070 1.00 19.04 C ATOM 1692 O PHE A 627 -19.584 -1.549 26.996 1.00 20.84 O ATOM 1693 CB PHE A 627 -17.800 -0.676 29.220 1.00 6.08 C ATOM 1694 CG PHE A 627 -18.740 0.271 29.932 1.00 11.84 C ATOM 1695 CD1 PHE A 627 -20.124 0.106 29.853 1.00 19.13 C ATOM 1696 CD2 PHE A 627 -18.242 1.336 30.644 1.00 11.89 C ATOM 1697 CE1 PHE A 627 -20.976 0.985 30.488 1.00 21.98 C ATOM 1698 CE2 PHE A 627 -19.077 2.219 31.292 1.00 15.19 C ATOM 1699 CZ PHE A 627 -20.450 2.050 31.221 1.00 24.63 C ATOM 1700 H PHE A 627 -16.932 1.611 28.311 1.00 0.00 H ATOM 1701 N TRP A 628 -19.576 0.671 26.656 1.00 19.34 N ATOM 1702 CA TRP A 628 -20.830 0.699 25.925 1.00 27.48 C ATOM 1703 C TRP A 628 -20.613 0.622 24.426 1.00 23.70 C ATOM 1704 O TRP A 628 -21.587 0.698 23.666 1.00 23.87 O ATOM 1705 CB TRP A 628 -21.595 1.967 26.249 1.00 13.81 C ATOM 1706 CG TRP A 628 -20.784 3.174 25.940 1.00 16.20 C ATOM 1707 CD1 TRP A 628 -20.788 3.893 24.784 1.00 16.25 C ATOM 1708 CD2 TRP A 628 -19.817 3.800 26.809 1.00 11.99 C ATOM 1709 NE1 TRP A 628 -19.900 4.957 24.883 1.00 17.19 N ATOM 1710 CE2 TRP A 628 -19.295 4.921 26.116 1.00 10.32 C ATOM 1711 CE3 TRP A 628 -19.364 3.531 28.109 1.00 4.37 C ATOM 1712 CZ2 TRP A 628 -18.317 5.769 26.674 1.00 9.94 C ATOM 1713 CZ3 TRP A 628 -18.406 4.381 28.674 1.00 10.13 C ATOM 1714 CH2 TRP A 628 -17.905 5.503 27.951 1.00 14.07 C ATOM 1715 HE1 TRP A 628 -19.722 5.666 24.143 1.00 0.00 H ATOM 1716 H TRP A 628 -19.099 1.571 26.863 1.00 0.00 H ATOM 1717 N LEU A 629 -19.361 0.531 23.991 1.00 17.64 N ATOM 1718 CA LEU A 629 -19.028 0.448 22.580 1.00 20.09 C ATOM 1719 C LEU A 629 -18.385 -0.895 22.307 1.00 21.70 C ATOM 1720 O LEU A 629 -17.697 -1.452 23.164 1.00 21.75 O ATOM 1721 CB LEU A 629 -18.082 1.571 22.144 1.00 17.16 C ATOM 1722 CG LEU A 629 -18.706 2.968 22.150 1.00 16.22 C ATOM 1723 CD1 LEU A 629 -17.709 4.045 21.712 1.00 25.84 C ATOM 1724 CD2 LEU A 629 -19.926 2.979 21.267 1.00 21.98 C ATOM 1725 H LEU A 629 -18.589 0.519 24.688 1.00 0.00 H ATOM 1726 N GLU A 630 -18.633 -1.424 21.123 1.00 26.90 N ATOM 1727 CA GLU A 630 -17.840 -2.549 20.668 1.00 36.83 C ATOM 1728 C GLU A 630 -16.587 -1.997 19.992 1.00 28.24 C ATOM 1729 O GLU A 630 -16.526 -0.817 19.633 1.00 23.66 O ATOM 1730 CB GLU A 630 -18.670 -3.443 19.745 1.00 27.28 C ATOM 1731 CG GLU A 630 -18.714 -3.016 18.317 1.00 36.05 C ATOM 1732 CD GLU A 630 -19.079 -1.565 18.132 1.00 53.37 C ATOM 1733 OE1 GLU A 630 -18.738 -1.077 17.045 1.00 49.57 O ATOM 1734 OE2 GLU A 630 -19.649 -0.909 19.045 1.00 54.26 O ATOM 1735 H GLU A 630 -19.389 -1.038 20.523 1.00 0.00 H ATOM 1736 N ASN A 631 -15.571 -2.852 19.848 1.00 24.01 N ATOM 1737 CA ASN A 631 -14.279 -2.351 19.381 1.00 36.89 C ATOM 1738 C ASN A 631 -14.420 -1.605 18.058 1.00 36.77 C ATOM 1739 O ASN A 631 -13.790 -0.558 17.860 1.00 31.23 O ATOM 1740 CB ASN A 631 -13.271 -3.497 19.234 1.00 41.29 C ATOM 1741 CG ASN A 631 -12.532 -3.833 20.539 1.00 41.54 C ATOM 1742 OD1 ASN A 631 -12.356 -2.990 21.421 1.00 36.54 O ATOM 1743 ND2 ASN A 631 -12.095 -5.083 20.653 1.00 32.15 N ATOM 1744 HD22 ASN A 631 -12.264 -5.765 19.886 1.00 0.00 H ATOM 1745 HD21 ASN A 631 -11.584 -5.379 21.509 1.00 0.00 H ATOM 1746 H ASN A 631 -15.697 -3.861 20.065 1.00 0.00 H ATOM 1747 N LYS A 632 -15.271 -2.110 17.158 1.00 38.81 N ATOM 1748 CA LYS A 632 -15.269 -1.644 15.769 1.00 35.07 C ATOM 1749 C LYS A 632 -15.575 -0.154 15.664 1.00 25.86 C ATOM 1750 O LYS A 632 -14.994 0.542 14.823 1.00 28.56 O ATOM 1751 CB LYS A 632 -16.268 -2.450 14.936 1.00 20.50 C ATOM 1752 H LYS A 632 -15.946 -2.846 17.449 1.00 0.00 H ATOM 1753 N ASP A 633 -16.477 0.359 16.500 1.00 27.74 N ATOM 1754 CA ASP A 633 -16.889 1.756 16.394 1.00 36.90 C ATOM 1755 C ASP A 633 -16.103 2.694 17.312 1.00 25.53 C ATOM 1756 O ASP A 633 -16.515 3.844 17.477 1.00 32.86 O ATOM 1757 CB ASP A 633 -18.394 1.909 16.682 1.00 46.55 C ATOM 1758 CG ASP A 633 -19.270 0.987 15.819 1.00 48.07 C ATOM 1759 OD1 ASP A 633 -18.918 0.711 14.643 1.00 44.70 O ATOM 1760 OD2 ASP A 633 -20.287 0.483 16.354 1.00 35.67 O ATOM 1761 H ASP A 633 -16.893 -0.244 17.238 1.00 0.00 H ATOM 1762 N VAL A 634 -14.997 2.240 17.913 1.00 23.32 N ATOM 1763 CA VAL A 634 -14.188 3.133 18.743 1.00 19.86 C ATOM 1764 C VAL A 634 -13.578 4.246 17.898 1.00 16.13 C ATOM 1765 O VAL A 634 -13.716 5.431 18.217 1.00 18.62 O ATOM 1766 CB VAL A 634 -13.109 2.345 19.501 1.00 17.62 C ATOM 1767 CG1 VAL A 634 -12.098 3.303 20.127 1.00 16.55 C ATOM 1768 CG2 VAL A 634 -13.743 1.489 20.582 1.00 11.63 C ATOM 1769 H VAL A 634 -14.711 1.248 17.790 1.00 0.00 H ATOM 1770 N ILE A 635 -12.918 3.889 16.792 1.00 22.85 N ATOM 1771 CA ILE A 635 -12.209 4.902 16.007 1.00 18.81 C ATOM 1772 C ILE A 635 -13.191 5.871 15.373 1.00 19.31 C ATOM 1773 O ILE A 635 -12.948 7.084 15.337 1.00 28.75 O ATOM 1774 CB ILE A 635 -11.296 4.242 14.954 1.00 39.02 C ATOM 1775 CG1 ILE A 635 -10.411 5.291 14.274 1.00 19.19 C ATOM 1776 CG2 ILE A 635 -12.121 3.464 13.918 1.00 27.66 C ATOM 1777 CD1 ILE A 635 -9.415 5.985 15.211 1.00 15.62 C ATOM 1778 H ILE A 635 -12.908 2.894 16.489 1.00 0.00 H ATOM 1779 N GLY A 636 -14.320 5.359 14.879 1.00 18.65 N ATOM 1780 CA GLY A 636 -15.374 6.232 14.398 1.00 22.28 C ATOM 1781 C GLY A 636 -15.786 7.251 15.436 1.00 22.70 C ATOM 1782 O GLY A 636 -15.803 8.453 15.165 1.00 23.50 O ATOM 1783 H GLY A 636 -14.445 4.327 14.839 1.00 0.00 H ATOM 1784 N VAL A 637 -16.076 6.782 16.658 1.00 18.31 N ATOM 1785 CA VAL A 637 -16.406 7.681 17.767 1.00 27.05 C ATOM 1786 C VAL A 637 -15.302 8.721 17.982 1.00 25.86 C ATOM 1787 O VAL A 637 -15.588 9.906 18.170 1.00 27.99 O ATOM 1788 CB VAL A 637 -16.681 6.871 19.051 1.00 25.85 C ATOM 1789 H VAL A 637 -16.067 5.755 16.823 1.00 0.00 H ATOM 1790 N LEU A 638 -14.029 8.301 17.927 1.00 18.23 N ATOM 1791 CA LEU A 638 -12.918 9.218 18.187 1.00 21.81 C ATOM 1792 C LEU A 638 -12.738 10.215 17.047 1.00 25.80 C ATOM 1793 O LEU A 638 -12.542 11.417 17.284 1.00 22.54 O ATOM 1794 CB LEU A 638 -11.625 8.425 18.400 1.00 17.09 C ATOM 1795 CG LEU A 638 -11.613 7.461 19.588 1.00 12.52 C ATOM 1796 CD1 LEU A 638 -10.294 6.691 19.660 1.00 11.13 C ATOM 1797 CD2 LEU A 638 -11.863 8.233 20.860 1.00 18.22 C ATOM 1798 H LEU A 638 -13.828 7.307 17.696 1.00 0.00 H ATOM 1799 N GLU A 639 -12.813 9.735 15.802 1.00 27.09 N ATOM 1800 CA GLU A 639 -12.749 10.629 14.649 1.00 31.37 C ATOM 1801 C GLU A 639 -13.756 11.761 14.771 1.00 25.09 C ATOM 1802 O GLU A 639 -13.427 12.919 14.494 1.00 25.79 O ATOM 1803 CB GLU A 639 -12.983 9.847 13.362 1.00 29.95 C ATOM 1804 CG GLU A 639 -11.890 8.838 13.060 1.00 33.40 C ATOM 1805 CD GLU A 639 -10.572 9.487 12.660 1.00 54.74 C ATOM 1806 OE1 GLU A 639 -9.497 8.871 12.884 1.00 47.16 O ATOM 1807 OE2 GLU A 639 -10.615 10.612 12.117 1.00 48.11 O ATOM 1808 H GLU A 639 -12.918 8.711 15.652 1.00 0.00 H ATOM 1809 N LYS A 640 -14.972 11.460 15.239 1.00 28.52 N ATOM 1810 CA LYS A 640 -15.973 12.518 15.406 1.00 27.78 C ATOM 1811 C LYS A 640 -15.607 13.554 16.468 1.00 26.85 C ATOM 1812 O LYS A 640 -16.318 14.553 16.591 1.00 28.12 O ATOM 1813 CB LYS A 640 -17.332 11.941 15.800 1.00 32.79 C ATOM 1814 CG LYS A 640 -17.860 10.827 14.955 1.00 33.30 C ATOM 1815 CD LYS A 640 -18.983 10.109 15.699 1.00 38.60 C ATOM 1816 CE LYS A 640 -20.100 11.083 16.085 1.00 55.65 C ATOM 1817 NZ LYS A 640 -20.902 10.642 17.278 1.00 53.51 N ATOM 1818 HZ1 LYS A 640 -21.347 9.724 17.075 1.00 0.00 H ATOM 1819 HZ2 LYS A 640 -20.274 10.549 18.101 1.00 0.00 H ATOM 1820 HZ3 LYS A 640 -21.638 11.349 17.480 1.00 0.00 H ATOM 1821 H LYS A 640 -15.207 10.477 15.484 1.00 0.00 H ATOM 1822 N GLY A 641 -14.570 13.330 17.272 1.00 26.41 N ATOM 1823 CA GLY A 641 -14.314 14.201 18.400 1.00 14.85 C ATOM 1824 C GLY A 641 -15.009 13.832 19.693 1.00 13.51 C ATOM 1825 O GLY A 641 -14.951 14.615 20.650 1.00 19.92 O ATOM 1826 H GLY A 641 -13.939 12.524 17.089 1.00 0.00 H ATOM 1827 N ASP A 642 -15.680 12.685 19.764 1.00 12.96 N ATOM 1828 CA ASP A 642 -16.271 12.268 21.025 1.00 18.27 C ATOM 1829 C ASP A 642 -15.205 11.563 21.869 1.00 29.17 C ATOM 1830 O ASP A 642 -14.330 10.881 21.332 1.00 21.63 O ATOM 1831 CB ASP A 642 -17.486 11.367 20.779 1.00 14.09 C ATOM 1832 CG ASP A 642 -18.756 12.165 20.325 1.00 44.89 C ATOM 1833 OD1 ASP A 642 -18.653 13.291 19.777 1.00 36.34 O ATOM 1834 OD2 ASP A 642 -19.877 11.665 20.530 1.00 27.61 O ATOM 1835 H ASP A 642 -15.781 12.088 18.919 1.00 0.00 H ATOM 1836 N ARG A 643 -15.256 11.767 23.190 1.00 24.62 N ATOM 1837 CA ARG A 643 -14.259 11.240 24.117 1.00 22.27 C ATOM 1838 C ARG A 643 -14.947 10.433 25.214 1.00 14.11 C ATOM 1839 O ARG A 643 -16.159 10.283 25.232 1.00 24.70 O ATOM 1840 CB ARG A 643 -13.423 12.371 24.734 1.00 14.40 C ATOM 1841 CG ARG A 643 -12.557 13.114 23.725 1.00 18.61 C ATOM 1842 CD ARG A 643 -11.577 12.168 23.066 1.00 15.67 C ATOM 1843 NE ARG A 643 -10.751 12.853 22.072 1.00 25.09 N ATOM 1844 CZ ARG A 643 -10.990 12.854 20.758 1.00 32.08 C ATOM 1845 NH1 ARG A 643 -12.032 12.197 20.254 1.00 14.93 N ATOM 1846 NH2 ARG A 643 -10.174 13.513 19.942 1.00 23.91 N ATOM 1847 HE ARG A 643 -9.919 13.376 22.412 1.00 0.00 H ATOM 1848 HH12 ARG A 643 -12.206 12.206 19.229 1.00 0.00 H ATOM 1849 HH11 ARG A 643 -12.672 11.674 20.885 1.00 0.00 H ATOM 1850 HH22 ARG A 643 -10.355 13.517 18.918 1.00 0.00 H ATOM 1851 HH21 ARG A 643 -9.355 14.024 20.328 1.00 0.00 H ATOM 1852 H ARG A 643 -16.043 12.327 23.575 1.00 0.00 H ATOM 1853 N LEU A 644 -14.167 9.910 26.148 1.00 10.60 N ATOM 1854 CA LEU A 644 -14.760 9.388 27.372 1.00 12.67 C ATOM 1855 C LEU A 644 -15.391 10.530 28.180 1.00 19.76 C ATOM 1856 O LEU A 644 -14.833 11.637 28.245 1.00 14.90 O ATOM 1857 CB LEU A 644 -13.698 8.667 28.206 1.00 18.41 C ATOM 1858 CG LEU A 644 -13.121 7.441 27.476 1.00 13.56 C ATOM 1859 CD1 LEU A 644 -11.771 7.028 28.068 1.00 13.58 C ATOM 1860 CD2 LEU A 644 -14.120 6.276 27.507 1.00 3.87 C ATOM 1861 H LEU A 644 -13.137 9.872 26.008 1.00 0.00 H ATOM 1862 N PRO A 645 -16.550 10.294 28.795 1.00 10.83 N ATOM 1863 CA PRO A 645 -17.158 11.327 29.635 1.00 15.04 C ATOM 1864 C PRO A 645 -16.457 11.459 30.978 1.00 13.45 C ATOM 1865 O PRO A 645 -15.804 10.539 31.465 1.00 10.57 O ATOM 1866 CB PRO A 645 -18.587 10.820 29.820 1.00 12.63 C ATOM 1867 CG PRO A 645 -18.417 9.357 29.813 1.00 16.52 C ATOM 1868 CD PRO A 645 -17.341 9.064 28.808 1.00 14.16 C ATOM 1869 N LYS A 646 -16.665 12.617 31.607 1.00 13.57 N ATOM 1870 CA LYS A 646 -16.057 12.885 32.907 1.00 10.60 C ATOM 1871 C LYS A 646 -16.580 11.933 33.975 1.00 10.80 C ATOM 1872 O LYS A 646 -17.794 11.849 34.188 1.00 10.69 O ATOM 1873 CB LYS A 646 -16.325 14.323 33.350 1.00 16.80 C ATOM 1874 CG LYS A 646 -15.566 14.667 34.634 1.00 14.20 C ATOM 1875 CD LYS A 646 -15.799 16.116 35.021 1.00 16.01 C ATOM 1876 CE LYS A 646 -16.974 16.241 35.966 1.00 17.06 C ATOM 1877 NZ LYS A 646 -16.722 15.572 37.279 1.00 22.62 N ATOM 1878 HZ1 LYS A 646 -16.541 14.560 37.122 1.00 0.00 H ATOM 1879 HZ2 LYS A 646 -15.894 16.007 37.735 1.00 0.00 H ATOM 1880 HZ3 LYS A 646 -17.556 15.686 37.890 1.00 0.00 H ATOM 1881 H LYS A 646 -17.269 13.339 31.165 1.00 0.00 H ATOM 1882 N PRO A 647 -15.708 11.215 34.679 1.00 14.11 N ATOM 1883 CA PRO A 647 -16.175 10.350 35.760 1.00 23.21 C ATOM 1884 C PRO A 647 -16.775 11.185 36.883 1.00 17.82 C ATOM 1885 O PRO A 647 -16.386 12.333 37.110 1.00 17.84 O ATOM 1886 CB PRO A 647 -14.904 9.616 36.214 1.00 18.59 C ATOM 1887 CG PRO A 647 -13.985 9.687 35.012 1.00 15.63 C ATOM 1888 CD PRO A 647 -14.260 11.087 34.451 1.00 14.08 C ATOM 1889 N ASP A 648 -17.743 10.589 37.578 1.00 15.32 N ATOM 1890 CA ASP A 648 -18.462 11.318 38.621 1.00 19.74 C ATOM 1891 C ASP A 648 -17.526 11.911 39.674 1.00 19.77 C ATOM 1892 O ASP A 648 -17.691 13.069 40.056 1.00 16.99 O ATOM 1893 CB ASP A 648 -19.493 10.409 39.279 1.00 12.86 C ATOM 1894 CG ASP A 648 -20.496 11.178 40.121 1.00 17.43 C ATOM 1895 OD1 ASP A 648 -21.020 12.206 39.641 1.00 42.86 O ATOM 1896 OD2 ASP A 648 -20.759 10.764 41.268 1.00 40.59 O ATOM 1897 H ASP A 648 -17.989 9.599 37.377 1.00 0.00 H ATOM 1898 N LEU A 649 -16.534 11.142 40.154 1.00 19.50 N ATOM 1899 CA LEU A 649 -15.636 11.630 41.209 1.00 21.95 C ATOM 1900 C LEU A 649 -14.468 12.467 40.690 1.00 25.87 C ATOM 1901 O LEU A 649 -13.705 13.004 41.502 1.00 27.92 O ATOM 1902 CB LEU A 649 -15.076 10.462 42.037 1.00 26.19 C ATOM 1903 H LEU A 649 -16.400 10.184 39.772 1.00 0.00 H ATOM 1904 N CYS A 650 -14.299 12.598 39.371 1.00 20.33 N ATOM 1905 CA CYS A 650 -13.112 13.265 38.843 1.00 18.06 C ATOM 1906 C CYS A 650 -13.292 14.785 38.902 1.00 31.25 C ATOM 1907 O CYS A 650 -14.305 15.300 38.409 1.00 15.44 O ATOM 1908 CB CYS A 650 -12.865 12.804 37.408 1.00 14.13 C ATOM 1909 SG CYS A 650 -11.667 13.745 36.441 1.00 16.27 S ATOM 1910 H CYS A 650 -15.016 12.223 38.717 1.00 0.00 H ATOM 1911 N PRO A 651 -12.358 15.525 39.504 1.00 23.26 N ATOM 1912 CA PRO A 651 -12.449 17.006 39.511 1.00 13.40 C ATOM 1913 C PRO A 651 -12.408 17.544 38.096 1.00 23.80 C ATOM 1914 O PRO A 651 -11.664 17.022 37.247 1.00 16.65 O ATOM 1915 CB PRO A 651 -11.198 17.444 40.296 1.00 22.80 C ATOM 1916 CG PRO A 651 -10.746 16.234 41.042 1.00 19.97 C ATOM 1917 CD PRO A 651 -11.153 15.046 40.201 1.00 20.63 C ATOM 1918 N PRO A 652 -13.197 18.580 37.797 1.00 16.33 N ATOM 1919 CA PRO A 652 -13.152 19.151 36.448 1.00 13.68 C ATOM 1920 C PRO A 652 -11.762 19.542 35.987 1.00 11.51 C ATOM 1921 O PRO A 652 -11.463 19.364 34.798 1.00 14.20 O ATOM 1922 CB PRO A 652 -14.077 20.366 36.559 1.00 15.96 C ATOM 1923 CG PRO A 652 -15.068 19.960 37.587 1.00 21.73 C ATOM 1924 CD PRO A 652 -14.275 19.171 38.606 1.00 27.49 C ATOM 1925 N VAL A 653 -10.902 20.077 36.869 1.00 13.12 N ATOM 1926 CA VAL A 653 -9.555 20.444 36.419 1.00 17.01 C ATOM 1927 C VAL A 653 -8.820 19.209 35.914 1.00 10.88 C ATOM 1928 O VAL A 653 -8.044 19.263 34.947 1.00 8.76 O ATOM 1929 CB VAL A 653 -8.756 21.164 37.535 1.00 16.16 C ATOM 1930 CG1 VAL A 653 -8.608 20.305 38.801 1.00 16.17 C ATOM 1931 CG2 VAL A 653 -7.370 21.521 37.029 1.00 15.20 C ATOM 1932 H VAL A 653 -11.187 20.229 37.858 1.00 0.00 H ATOM 1933 N LEU A 654 -9.063 18.073 36.552 1.00 12.81 N ATOM 1934 CA LEU A 654 -8.406 16.848 36.118 1.00 11.45 C ATOM 1935 C LEU A 654 -8.990 16.363 34.790 1.00 14.07 C ATOM 1936 O LEU A 654 -8.253 15.875 33.922 1.00 10.41 O ATOM 1937 CB LEU A 654 -8.514 15.796 37.230 1.00 9.90 C ATOM 1938 CG LEU A 654 -7.841 14.459 36.917 1.00 18.46 C ATOM 1939 CD1 LEU A 654 -6.419 14.728 36.551 1.00 15.14 C ATOM 1940 CD2 LEU A 654 -7.936 13.502 38.106 1.00 22.89 C ATOM 1941 H LEU A 654 -9.720 18.057 37.358 1.00 0.00 H ATOM 1942 N TYR A 655 -10.298 16.572 34.570 1.00 14.48 N ATOM 1943 CA TYR A 655 -10.890 16.146 33.301 1.00 9.50 C ATOM 1944 C TYR A 655 -10.448 17.047 32.148 1.00 16.34 C ATOM 1945 O TYR A 655 -10.289 16.583 31.010 1.00 11.42 O ATOM 1946 CB TYR A 655 -12.415 16.099 33.421 1.00 9.56 C ATOM 1947 CG TYR A 655 -13.086 15.551 32.151 1.00 20.48 C ATOM 1948 CD1 TYR A 655 -12.873 14.230 31.739 1.00 10.94 C ATOM 1949 CD2 TYR A 655 -13.921 16.354 31.372 1.00 7.27 C ATOM 1950 CE1 TYR A 655 -13.463 13.732 30.590 1.00 10.04 C ATOM 1951 CE2 TYR A 655 -14.515 15.858 30.216 1.00 12.45 C ATOM 1952 CZ TYR A 655 -14.287 14.551 29.825 1.00 10.20 C ATOM 1953 OH TYR A 655 -14.880 14.052 28.677 1.00 9.37 O ATOM 1954 HH TYR A 655 -14.609 13.108 28.551 1.00 0.00 H ATOM 1955 H TYR A 655 -10.885 17.032 35.295 1.00 0.00 H ATOM 1956 N THR A 656 -10.218 18.327 32.425 1.00 10.87 N ATOM 1957 CA THR A 656 -9.640 19.193 31.407 1.00 15.42 C ATOM 1958 C THR A 656 -8.268 18.686 30.995 1.00 17.26 C ATOM 1959 O THR A 656 -7.952 18.612 29.800 1.00 17.33 O ATOM 1960 CB THR A 656 -9.560 20.623 31.939 1.00 19.46 C ATOM 1961 OG1 THR A 656 -10.879 21.046 32.324 1.00 23.14 O ATOM 1962 CG2 THR A 656 -8.982 21.579 30.886 1.00 16.70 C ATOM 1963 HG1 THR A 656 -11.225 20.443 33.029 1.00 0.00 H ATOM 1964 H THR A 656 -10.450 18.708 33.365 1.00 0.00 H ATOM 1965 N LEU A 657 -7.448 18.302 31.976 1.00 11.13 N ATOM 1966 CA LEU A 657 -6.144 17.742 31.663 1.00 10.52 C ATOM 1967 C LEU A 657 -6.276 16.481 30.812 1.00 11.40 C ATOM 1968 O LEU A 657 -5.539 16.292 29.833 1.00 17.17 O ATOM 1969 CB LEU A 657 -5.397 17.458 32.968 1.00 18.70 C ATOM 1970 CG LEU A 657 -3.909 17.131 32.886 1.00 24.44 C ATOM 1971 CD1 LEU A 657 -3.173 18.323 32.296 1.00 18.83 C ATOM 1972 CD2 LEU A 657 -3.317 16.734 34.262 1.00 18.53 C ATOM 1973 H LEU A 657 -7.743 18.404 32.968 1.00 0.00 H ATOM 1974 N MET A 658 -7.241 15.631 31.145 1.00 11.17 N ATOM 1975 CA MET A 658 -7.487 14.416 30.379 1.00 11.95 C ATOM 1976 C MET A 658 -7.831 14.710 28.927 1.00 15.41 C ATOM 1977 O MET A 658 -7.331 14.026 28.026 1.00 10.68 O ATOM 1978 CB MET A 658 -8.618 13.644 31.035 1.00 10.33 C ATOM 1979 CG MET A 658 -8.154 12.704 32.119 1.00 7.69 C ATOM 1980 SD MET A 658 -9.590 11.837 32.793 1.00 27.51 S ATOM 1981 CE MET A 658 -9.568 12.393 34.438 1.00 17.75 C ATOM 1982 H MET A 658 -7.836 15.838 31.973 1.00 0.00 H ATOM 1983 N THR A 659 -8.701 15.716 28.684 1.00 14.21 N ATOM 1984 CA THR A 659 -9.111 16.079 27.324 1.00 12.13 C ATOM 1985 C THR A 659 -7.944 16.595 26.496 1.00 15.76 C ATOM 1986 O THR A 659 -7.944 16.449 25.266 1.00 16.99 O ATOM 1987 CB THR A 659 -10.217 17.151 27.362 1.00 14.19 C ATOM 1988 OG1 THR A 659 -11.398 16.608 27.950 1.00 20.59 O ATOM 1989 CG2 THR A 659 -10.579 17.635 25.965 1.00 22.49 C ATOM 1990 HG1 THR A 659 -11.199 16.310 28.873 1.00 0.00 H ATOM 1991 H THR A 659 -9.092 16.249 29.487 1.00 0.00 H ATOM 1992 N ARG A 660 -6.964 17.232 27.141 1.00 8.66 N ATOM 1993 CA ARG A 660 -5.785 17.698 26.422 1.00 12.08 C ATOM 1994 C ARG A 660 -4.933 16.520 25.960 1.00 18.37 C ATOM 1995 O ARG A 660 -4.344 16.555 24.869 1.00 9.85 O ATOM 1996 CB ARG A 660 -4.962 18.642 27.309 1.00 15.08 C ATOM 1997 CG ARG A 660 -5.576 20.029 27.491 1.00 28.55 C ATOM 1998 CD ARG A 660 -4.911 20.833 28.631 1.00 33.27 C ATOM 1999 NE ARG A 660 -5.666 22.051 28.955 1.00 46.29 N ATOM 2000 CZ ARG A 660 -5.669 22.655 30.148 1.00 48.21 C ATOM 2001 NH1 ARG A 660 -4.968 22.154 31.164 1.00 31.31 N ATOM 2002 NH2 ARG A 660 -6.389 23.757 30.335 1.00 18.17 N ATOM 2003 HE ARG A 660 -6.241 22.475 28.200 1.00 0.00 H ATOM 2004 HH12 ARG A 660 -4.977 22.632 32.088 1.00 0.00 H ATOM 2005 HH11 ARG A 660 -4.411 21.285 31.033 1.00 0.00 H ATOM 2006 HH22 ARG A 660 -6.391 24.226 31.263 1.00 0.00 H ATOM 2007 HH21 ARG A 660 -6.951 24.150 29.553 1.00 0.00 H ATOM 2008 H ARG A 660 -7.042 17.397 28.165 1.00 0.00 H ATOM 2009 N CYS A 661 -4.856 15.474 26.787 1.00 14.67 N ATOM 2010 CA CYS A 661 -4.181 14.249 26.395 1.00 16.02 C ATOM 2011 C CYS A 661 -4.924 13.513 25.293 1.00 15.68 C ATOM 2012 O CYS A 661 -4.306 12.715 24.585 1.00 13.01 O ATOM 2013 CB CYS A 661 -4.011 13.307 27.594 1.00 10.60 C ATOM 2014 SG CYS A 661 -3.155 13.995 29.025 1.00 12.95 S ATOM 2015 H CYS A 661 -5.288 15.538 27.731 1.00 0.00 H ATOM 2016 N TRP A 662 -6.229 13.748 25.135 1.00 14.97 N ATOM 2017 CA TRP A 662 -6.998 13.124 24.066 1.00 14.74 C ATOM 2018 C TRP A 662 -7.120 14.008 22.836 1.00 19.61 C ATOM 2019 O TRP A 662 -8.073 13.858 22.060 1.00 17.38 O ATOM 2020 CB TRP A 662 -8.379 12.736 24.572 1.00 11.68 C ATOM 2021 CG TRP A 662 -8.308 11.692 25.618 1.00 10.99 C ATOM 2022 CD1 TRP A 662 -7.378 10.674 25.712 1.00 10.88 C ATOM 2023 CD2 TRP A 662 -9.161 11.571 26.749 1.00 8.74 C ATOM 2024 NE1 TRP A 662 -7.638 9.908 26.826 1.00 17.40 N ATOM 2025 CE2 TRP A 662 -8.723 10.446 27.483 1.00 20.25 C ATOM 2026 CE3 TRP A 662 -10.261 12.297 27.212 1.00 10.14 C ATOM 2027 CZ2 TRP A 662 -9.350 10.037 28.652 1.00 9.75 C ATOM 2028 CZ3 TRP A 662 -10.883 11.888 28.354 1.00 10.64 C ATOM 2029 CH2 TRP A 662 -10.424 10.757 29.071 1.00 5.45 C ATOM 2030 HE1 TRP A 662 -7.105 9.065 27.122 1.00 0.00 H ATOM 2031 H TRP A 662 -6.710 14.394 25.793 1.00 0.00 H ATOM 2032 N ASP A 663 -6.198 14.942 22.661 1.00 19.30 N ATOM 2033 CA ASP A 663 -6.149 15.708 21.425 1.00 14.63 C ATOM 2034 C ASP A 663 -5.868 14.772 20.261 1.00 21.37 C ATOM 2035 O ASP A 663 -4.948 13.944 20.316 1.00 15.80 O ATOM 2036 CB ASP A 663 -5.065 16.778 21.525 1.00 16.32 C ATOM 2037 CG ASP A 663 -5.192 17.829 20.440 1.00 32.08 C ATOM 2038 OD1 ASP A 663 -5.157 19.018 20.793 1.00 12.86 O ATOM 2039 OD2 ASP A 663 -5.326 17.458 19.249 1.00 21.24 O ATOM 2040 H ASP A 663 -5.504 15.129 23.412 1.00 0.00 H ATOM 2041 N TYR A 664 -6.670 14.888 19.203 1.00 15.20 N ATOM 2042 CA TYR A 664 -6.448 14.016 18.058 1.00 19.15 C ATOM 2043 C TYR A 664 -5.032 14.181 17.504 1.00 21.72 C ATOM 2044 O TYR A 664 -4.433 13.206 17.035 1.00 19.78 O ATOM 2045 CB TYR A 664 -7.505 14.277 16.985 1.00 20.20 C ATOM 2046 CG TYR A 664 -7.621 13.169 15.971 1.00 18.15 C ATOM 2047 CD1 TYR A 664 -8.587 12.182 16.091 1.00 20.15 C ATOM 2048 CD2 TYR A 664 -6.745 13.104 14.891 1.00 42.39 C ATOM 2049 CE1 TYR A 664 -8.681 11.165 15.159 1.00 26.90 C ATOM 2050 CE2 TYR A 664 -6.828 12.093 13.958 1.00 31.77 C ATOM 2051 CZ TYR A 664 -7.796 11.131 14.094 1.00 45.96 C ATOM 2052 OH TYR A 664 -7.860 10.132 13.149 1.00 47.00 O ATOM 2053 HH TYR A 664 -8.600 9.514 13.373 1.00 0.00 H ATOM 2054 H TYR A 664 -7.439 15.588 19.195 1.00 0.00 H ATOM 2055 N ASP A 665 -4.466 15.387 17.607 1.00 23.75 N ATOM 2056 CA ASP A 665 -3.137 15.738 17.120 1.00 25.14 C ATOM 2057 C ASP A 665 -2.103 15.335 18.160 1.00 14.66 C ATOM 2058 O ASP A 665 -2.070 15.919 19.249 1.00 18.30 O ATOM 2059 CB ASP A 665 -3.069 17.248 16.835 1.00 35.23 C ATOM 2060 CG ASP A 665 -1.742 17.691 16.210 1.00 33.84 C ATOM 2061 OD1 ASP A 665 -1.686 18.844 15.728 1.00 32.77 O ATOM 2062 OD2 ASP A 665 -0.766 16.904 16.186 1.00 28.77 O ATOM 2063 H ASP A 665 -5.018 16.136 18.072 1.00 0.00 H ATOM 2064 N PRO A 666 -1.250 14.346 17.871 1.00 23.66 N ATOM 2065 CA PRO A 666 -0.243 13.925 18.872 1.00 19.44 C ATOM 2066 C PRO A 666 0.693 15.045 19.311 1.00 23.59 C ATOM 2067 O PRO A 666 1.035 15.109 20.498 1.00 22.37 O ATOM 2068 CB PRO A 666 0.515 12.798 18.155 1.00 21.69 C ATOM 2069 CG PRO A 666 -0.431 12.325 17.048 1.00 17.35 C ATOM 2070 CD PRO A 666 -1.261 13.501 16.665 1.00 10.72 C ATOM 2071 N SER A 667 1.085 15.951 18.395 1.00 26.07 N ATOM 2072 CA SER A 667 1.953 17.090 18.717 1.00 21.14 C ATOM 2073 C SER A 667 1.356 18.034 19.748 1.00 23.90 C ATOM 2074 O SER A 667 2.109 18.769 20.403 1.00 21.54 O ATOM 2075 CB SER A 667 2.258 17.923 17.463 1.00 28.67 C ATOM 2076 OG SER A 667 3.000 17.190 16.513 1.00 32.13 O ATOM 2077 HG SER A 667 3.176 17.759 15.722 1.00 0.00 H ATOM 2078 H SER A 667 0.758 15.838 17.414 1.00 0.00 H ATOM 2079 N ASP A 668 0.025 18.091 19.863 1.00 20.64 N ATOM 2080 CA ASP A 668 -0.632 19.015 20.793 1.00 15.84 C ATOM 2081 C ASP A 668 -0.793 18.448 22.198 1.00 24.61 C ATOM 2082 O ASP A 668 -1.220 19.173 23.105 1.00 17.92 O ATOM 2083 CB ASP A 668 -2.022 19.396 20.282 1.00 19.21 C ATOM 2084 CG ASP A 668 -1.984 20.449 19.184 1.00 38.62 C ATOM 2085 OD1 ASP A 668 -0.885 20.723 18.654 1.00 29.27 O ATOM 2086 OD2 ASP A 668 -3.065 21.004 18.860 1.00 38.99 O ATOM 2087 H ASP A 668 -0.560 17.463 19.277 1.00 0.00 H ATOM 2088 N ARG A 669 -0.508 17.166 22.393 1.00 15.62 N ATOM 2089 CA ARG A 669 -0.708 16.557 23.696 1.00 17.30 C ATOM 2090 C ARG A 669 0.397 16.991 24.658 1.00 12.22 C ATOM 2091 O ARG A 669 1.547 17.187 24.254 1.00 22.37 O ATOM 2092 CB ARG A 669 -0.733 15.033 23.563 1.00 19.71 C ATOM 2093 CG ARG A 669 -1.895 14.532 22.698 1.00 10.39 C ATOM 2094 CD ARG A 669 -1.827 13.014 22.462 1.00 12.08 C ATOM 2095 NE ARG A 669 -2.642 12.665 21.306 1.00 13.66 N ATOM 2096 CZ ARG A 669 -2.486 11.586 20.548 1.00 14.43 C ATOM 2097 NH1 ARG A 669 -1.538 10.694 20.824 1.00 13.14 N ATOM 2098 NH2 ARG A 669 -3.276 11.414 19.501 1.00 13.88 N ATOM 2099 HE ARG A 669 -3.412 13.317 21.053 1.00 0.00 H ATOM 2100 HH12 ARG A 669 -1.425 9.853 20.223 1.00 0.00 H ATOM 2101 HH11 ARG A 669 -0.910 10.838 21.640 1.00 0.00 H ATOM 2102 HH22 ARG A 669 -3.165 10.574 18.898 1.00 0.00 H ATOM 2103 HH21 ARG A 669 -4.008 12.119 19.280 1.00 0.00 H ATOM 2104 H ARG A 669 -0.139 16.594 21.607 1.00 0.00 H ATOM 2105 N PRO A 670 0.075 17.154 25.933 1.00 16.03 N ATOM 2106 CA PRO A 670 1.117 17.491 26.904 1.00 12.14 C ATOM 2107 C PRO A 670 2.196 16.432 26.934 1.00 18.05 C ATOM 2108 O PRO A 670 1.983 15.273 26.569 1.00 15.90 O ATOM 2109 CB PRO A 670 0.358 17.554 28.234 1.00 14.03 C ATOM 2110 CG PRO A 670 -1.069 17.798 27.840 1.00 13.90 C ATOM 2111 CD PRO A 670 -1.248 17.026 26.573 1.00 18.12 C ATOM 2112 N ARG A 671 3.379 16.854 27.339 1.00 21.47 N ATOM 2113 CA ARG A 671 4.413 15.891 27.629 1.00 16.26 C ATOM 2114 C ARG A 671 4.216 15.352 29.050 1.00 19.49 C ATOM 2115 O ARG A 671 3.587 15.992 29.904 1.00 14.07 O ATOM 2116 CB ARG A 671 5.780 16.550 27.450 1.00 21.75 C ATOM 2117 H ARG A 671 3.564 17.872 27.448 1.00 0.00 H ATOM 2118 N PHE A 672 4.757 14.163 29.306 1.00 8.59 N ATOM 2119 CA PHE A 672 4.678 13.634 30.666 1.00 13.09 C ATOM 2120 C PHE A 672 5.349 14.553 31.696 1.00 17.13 C ATOM 2121 O PHE A 672 4.877 14.624 32.833 1.00 16.85 O ATOM 2122 CB PHE A 672 5.271 12.230 30.735 1.00 9.55 C ATOM 2123 CG PHE A 672 4.355 11.144 30.192 1.00 6.28 C ATOM 2124 CD1 PHE A 672 3.206 10.771 30.880 1.00 5.83 C ATOM 2125 CD2 PHE A 672 4.658 10.499 29.012 1.00 6.49 C ATOM 2126 CE1 PHE A 672 2.381 9.787 30.393 1.00 7.53 C ATOM 2127 CE2 PHE A 672 3.848 9.491 28.520 1.00 11.44 C ATOM 2128 CZ PHE A 672 2.704 9.133 29.217 1.00 11.98 C ATOM 2129 H PHE A 672 5.227 13.621 28.553 1.00 0.00 H ATOM 2130 N THR A 673 6.401 15.304 31.330 1.00 21.46 N ATOM 2131 CA THR A 673 7.005 16.209 32.320 1.00 20.00 C ATOM 2132 C THR A 673 6.048 17.307 32.727 1.00 17.69 C ATOM 2133 O THR A 673 6.072 17.757 33.876 1.00 24.77 O ATOM 2134 CB THR A 673 8.296 16.866 31.821 1.00 23.71 C ATOM 2135 OG1 THR A 673 8.199 17.170 30.428 1.00 30.65 O ATOM 2136 CG2 THR A 673 9.493 15.993 32.096 1.00 36.09 C ATOM 2137 HG1 THR A 673 9.041 17.593 30.124 1.00 0.00 H ATOM 2138 H THR A 673 6.782 15.247 30.364 1.00 0.00 H ATOM 2139 N GLU A 674 5.231 17.796 31.792 1.00 17.80 N ATOM 2140 CA GLU A 674 4.272 18.824 32.170 1.00 14.69 C ATOM 2141 C GLU A 674 3.139 18.221 32.984 1.00 15.12 C ATOM 2142 O GLU A 674 2.666 18.825 33.961 1.00 14.74 O ATOM 2143 CB GLU A 674 3.739 19.528 30.923 1.00 21.12 C ATOM 2144 CG GLU A 674 4.829 19.854 29.909 1.00 24.58 C ATOM 2145 CD GLU A 674 4.282 20.506 28.653 1.00 34.18 C ATOM 2146 OE1 GLU A 674 4.257 21.759 28.578 1.00 56.68 O ATOM 2147 OE2 GLU A 674 3.853 19.766 27.751 1.00 27.08 O ATOM 2148 H GLU A 674 5.278 17.450 30.813 1.00 0.00 H ATOM 2149 N LEU A 675 2.700 17.021 32.601 1.00 14.04 N ATOM 2150 CA LEU A 675 1.630 16.361 33.333 1.00 19.58 C ATOM 2151 C LEU A 675 2.012 16.148 34.793 1.00 17.11 C ATOM 2152 O LEU A 675 1.178 16.356 35.679 1.00 24.57 O ATOM 2153 CB LEU A 675 1.256 15.030 32.652 1.00 15.18 C ATOM 2154 CG LEU A 675 0.597 15.189 31.269 1.00 17.41 C ATOM 2155 CD1 LEU A 675 0.391 13.863 30.504 1.00 16.86 C ATOM 2156 CD2 LEU A 675 -0.724 15.915 31.372 1.00 22.66 C ATOM 2157 H LEU A 675 3.125 16.555 31.774 1.00 0.00 H ATOM 2158 N VAL A 676 3.268 15.756 35.074 1.00 18.09 N ATOM 2159 CA VAL A 676 3.658 15.512 36.469 1.00 18.44 C ATOM 2160 C VAL A 676 3.446 16.784 37.292 1.00 16.80 C ATOM 2161 O VAL A 676 2.889 16.741 38.396 1.00 15.14 O ATOM 2162 CB VAL A 676 5.119 15.007 36.574 1.00 21.76 C ATOM 2163 CG1 VAL A 676 5.621 15.011 38.046 1.00 20.93 C ATOM 2164 CG2 VAL A 676 5.285 13.625 36.003 1.00 18.12 C ATOM 2165 H VAL A 676 3.959 15.626 34.308 1.00 0.00 H ATOM 2166 N CYS A 677 3.855 17.933 36.744 1.00 14.07 N ATOM 2167 CA CYS A 677 3.670 19.222 37.414 1.00 15.70 C ATOM 2168 C CYS A 677 2.192 19.534 37.615 1.00 18.34 C ATOM 2169 O CYS A 677 1.771 19.910 38.719 1.00 13.99 O ATOM 2170 CB CYS A 677 4.353 20.329 36.601 1.00 12.09 C ATOM 2171 SG CYS A 677 6.161 20.181 36.562 1.00 38.97 S ATOM 2172 H CYS A 677 4.319 17.911 35.813 1.00 0.00 H ATOM 2173 N SER A 678 1.382 19.358 36.555 1.00 10.86 N ATOM 2174 CA SER A 678 -0.065 19.555 36.660 1.00 15.64 C ATOM 2175 C SER A 678 -0.676 18.666 37.729 1.00 14.21 C ATOM 2176 O SER A 678 -1.462 19.128 38.559 1.00 11.71 O ATOM 2177 CB SER A 678 -0.754 19.276 35.317 1.00 16.25 C ATOM 2178 OG SER A 678 -0.314 20.179 34.314 1.00 28.55 O ATOM 2179 HG SER A 678 -0.775 19.974 33.462 1.00 0.00 H ATOM 2180 H SER A 678 1.792 19.076 35.642 1.00 0.00 H ATOM 2181 N LEU A 679 -0.364 17.371 37.700 1.00 12.35 N ATOM 2182 CA LEU A 679 -1.014 16.456 38.634 1.00 11.72 C ATOM 2183 C LEU A 679 -0.501 16.668 40.042 1.00 14.79 C ATOM 2184 O LEU A 679 -1.275 16.600 41.003 1.00 13.70 O ATOM 2185 CB LEU A 679 -0.774 15.014 38.213 1.00 8.65 C ATOM 2186 CG LEU A 679 -1.543 14.633 36.974 1.00 17.08 C ATOM 2187 CD1 LEU A 679 -0.786 13.483 36.354 1.00 16.15 C ATOM 2188 CD2 LEU A 679 -2.965 14.300 37.391 1.00 8.63 C ATOM 2189 H LEU A 679 0.336 17.015 37.018 1.00 0.00 H ATOM 2190 N SER A 680 0.815 16.862 40.183 1.00 15.79 N ATOM 2191 CA SER A 680 1.331 17.315 41.463 1.00 18.98 C ATOM 2192 C SER A 680 0.486 18.459 41.956 1.00 16.90 C ATOM 2193 O SER A 680 -0.030 18.439 43.087 1.00 11.50 O ATOM 2194 CB SER A 680 2.814 17.670 41.340 1.00 14.08 C ATOM 2195 OG SER A 680 3.339 17.997 42.612 1.00 38.05 O ATOM 2196 HG SER A 680 3.238 17.221 43.219 1.00 0.00 H ATOM 2197 H SER A 680 1.461 16.691 39.386 1.00 0.00 H ATOM 2198 N ASP A 681 0.240 19.419 41.069 1.00 21.69 N ATOM 2199 CA ASP A 681 -0.674 20.515 41.401 1.00 28.89 C ATOM 2200 C ASP A 681 -2.104 20.040 41.712 1.00 26.14 C ATOM 2201 O ASP A 681 -2.703 20.511 42.698 1.00 15.32 O ATOM 2202 CB ASP A 681 -0.688 21.622 40.311 1.00 27.86 C ATOM 2203 CG ASP A 681 0.557 22.500 40.403 1.00 37.41 C ATOM 2204 OD1 ASP A 681 1.231 22.399 41.455 1.00 40.84 O ATOM 2205 OD2 ASP A 681 0.862 23.249 39.478 1.00 33.95 O ATOM 2206 H ASP A 681 0.698 19.392 40.136 1.00 0.00 H ATOM 2207 N VAL A 682 -2.687 19.138 40.914 1.00 16.79 N ATOM 2208 CA VAL A 682 -4.009 18.660 41.300 1.00 20.33 C ATOM 2209 C VAL A 682 -3.944 17.978 42.673 1.00 16.29 C ATOM 2210 O VAL A 682 -4.844 18.131 43.509 1.00 9.91 O ATOM 2211 CB VAL A 682 -4.600 17.731 40.228 1.00 15.22 C ATOM 2212 CG1 VAL A 682 -5.942 17.231 40.714 1.00 9.84 C ATOM 2213 CG2 VAL A 682 -4.767 18.475 38.885 1.00 21.96 C ATOM 2214 H VAL A 682 -2.216 18.792 40.054 1.00 0.00 H ATOM 2215 N TYR A 683 -2.856 17.262 42.949 1.00 18.01 N ATOM 2216 CA TYR A 683 -2.814 16.432 44.159 1.00 16.28 C ATOM 2217 C TYR A 683 -2.750 17.282 45.424 1.00 12.99 C ATOM 2218 O TYR A 683 -3.499 17.051 46.383 1.00 11.99 O ATOM 2219 CB TYR A 683 -1.623 15.473 44.119 1.00 12.40 C ATOM 2220 CG TYR A 683 -1.401 14.753 45.447 1.00 29.68 C ATOM 2221 CD1 TYR A 683 -2.250 13.727 45.856 1.00 20.14 C ATOM 2222 CD2 TYR A 683 -0.345 15.101 46.282 1.00 23.93 C ATOM 2223 CE1 TYR A 683 -2.060 13.068 47.063 1.00 27.56 C ATOM 2224 CE2 TYR A 683 -0.141 14.442 47.497 1.00 32.80 C ATOM 2225 CZ TYR A 683 -1.011 13.433 47.881 1.00 31.27 C ATOM 2226 OH TYR A 683 -0.832 12.789 49.077 1.00 30.17 O ATOM 2227 HH TYR A 683 -1.537 12.103 49.190 1.00 0.00 H ATOM 2228 H TYR A 683 -2.037 17.291 42.308 1.00 0.00 H ATOM 2229 N GLN A 684 -1.828 18.245 45.453 1.00 11.49 N ATOM 2230 CA GLN A 684 -1.718 19.165 46.586 1.00 21.09 C ATOM 2231 C GLN A 684 -3.035 19.868 46.878 1.00 15.20 C ATOM 2232 O GLN A 684 -3.373 20.103 48.041 1.00 23.79 O ATOM 2233 CB GLN A 684 -0.612 20.196 46.324 1.00 14.64 C ATOM 2234 CG GLN A 684 0.796 19.652 46.479 1.00 16.91 C ATOM 2235 CD GLN A 684 0.988 18.972 47.816 1.00 32.32 C ATOM 2236 OE1 GLN A 684 0.522 19.475 48.841 1.00 33.19 O ATOM 2237 NE2 GLN A 684 1.684 17.824 47.822 1.00 38.10 N ATOM 2238 HE22 GLN A 684 2.058 17.438 46.932 1.00 0.00 H ATOM 2239 HE21 GLN A 684 1.849 17.321 48.717 1.00 0.00 H ATOM 2240 H GLN A 684 -1.172 18.345 44.652 1.00 0.00 H ATOM 2241 N MET A 685 -3.795 20.214 45.842 1.00 17.33 N ATOM 2242 CA MET A 685 -5.075 20.878 46.064 1.00 11.71 C ATOM 2243 C MET A 685 -6.098 19.942 46.688 1.00 15.16 C ATOM 2244 O MET A 685 -6.818 20.321 47.617 1.00 13.73 O ATOM 2245 CB MET A 685 -5.632 21.405 44.757 1.00 15.36 C ATOM 2246 CG MET A 685 -6.938 22.169 44.962 1.00 20.54 C ATOM 2247 SD MET A 685 -7.685 22.831 43.467 1.00 28.99 S ATOM 2248 CE MET A 685 -8.123 21.309 42.632 1.00 27.96 C ATOM 2249 H MET A 685 -3.476 20.011 44.873 1.00 0.00 H ATOM 2250 N GLU A 686 -6.210 18.717 46.167 1.00 20.13 N ATOM 2251 CA GLU A 686 -7.177 17.790 46.743 1.00 15.34 C ATOM 2252 C GLU A 686 -6.810 17.453 48.176 1.00 13.60 C ATOM 2253 O GLU A 686 -7.689 17.210 49.011 1.00 14.49 O ATOM 2254 CB GLU A 686 -7.271 16.520 45.909 1.00 15.81 C ATOM 2255 CG GLU A 686 -7.586 16.724 44.454 1.00 25.73 C ATOM 2256 CD GLU A 686 -8.920 17.377 44.224 1.00 28.54 C ATOM 2257 OE1 GLU A 686 -9.821 17.226 45.069 1.00 32.85 O ATOM 2258 OE2 GLU A 686 -9.061 18.049 43.185 1.00 45.97 O ATOM 2259 H GLU A 686 -5.617 18.429 45.363 1.00 0.00 H ATOM 2260 N LYS A 687 -5.506 17.415 48.465 1.00 17.28 N ATOM 2261 CA LYS A 687 -5.017 17.170 49.816 1.00 22.97 C ATOM 2262 C LYS A 687 -5.433 18.288 50.766 1.00 26.60 C ATOM 2263 O LYS A 687 -5.963 18.017 51.848 1.00 28.08 O ATOM 2264 CB LYS A 687 -3.495 17.004 49.787 1.00 20.92 C ATOM 2265 CG LYS A 687 -2.871 16.632 51.146 1.00 27.52 C ATOM 2266 CD LYS A 687 -1.338 16.641 51.088 1.00 33.58 C ATOM 2267 CE LYS A 687 -0.711 16.399 52.453 1.00 46.07 C ATOM 2268 NZ LYS A 687 0.778 16.565 52.426 1.00 47.49 N ATOM 2269 HZ1 LYS A 687 1.189 15.885 51.755 1.00 0.00 H ATOM 2270 HZ2 LYS A 687 1.012 17.533 52.128 1.00 0.00 H ATOM 2271 HZ3 LYS A 687 1.162 16.391 53.377 1.00 0.00 H ATOM 2272 H LYS A 687 -4.817 17.565 47.701 1.00 0.00 H ATOM 2273 N ASP A 688 -5.242 19.550 50.362 1.00 26.63 N ATOM 2274 CA ASP A 688 -5.743 20.677 51.159 1.00 27.62 C ATOM 2275 C ASP A 688 -7.248 20.605 51.390 1.00 22.29 C ATOM 2276 O ASP A 688 -7.725 20.913 52.487 1.00 29.91 O ATOM 2277 CB ASP A 688 -5.386 22.006 50.496 1.00 15.54 C ATOM 2278 CG ASP A 688 -3.983 22.447 50.832 1.00 41.06 C ATOM 2279 OD1 ASP A 688 -3.159 21.563 51.184 1.00 29.50 O ATOM 2280 OD2 ASP A 688 -3.697 23.663 50.738 1.00 36.23 O ATOM 2281 H ASP A 688 -4.733 19.734 49.474 1.00 0.00 H ATOM 2282 N ILE A 689 -8.028 20.254 50.372 1.00 18.76 N ATOM 2283 CA ILE A 689 -9.468 20.171 50.613 1.00 28.23 C ATOM 2284 C ILE A 689 -9.768 19.062 51.620 1.00 41.78 C ATOM 2285 O ILE A 689 -10.450 19.281 52.629 1.00 40.83 O ATOM 2286 CB ILE A 689 -10.243 19.964 49.305 1.00 26.21 C ATOM 2287 CG1 ILE A 689 -9.902 21.064 48.309 1.00 25.35 C ATOM 2288 CG2 ILE A 689 -11.731 19.977 49.608 1.00 24.62 C ATOM 2289 CD1 ILE A 689 -10.321 20.747 46.913 1.00 19.57 C ATOM 2290 H ILE A 689 -7.627 20.045 49.435 1.00 0.00 H ATOM 2291 N ALA A 690 -9.267 17.859 51.359 1.00 18.16 N ATOM 2292 CA ALA A 690 -9.213 16.817 52.383 1.00 39.13 C ATOM 2293 C ALA A 690 -8.396 17.306 53.591 1.00 39.75 C ATOM 2294 O ALA A 690 -8.852 17.251 54.734 1.00 38.31 O ATOM 2295 CB ALA A 690 -8.602 15.532 51.816 1.00 13.61 C ATOM 2296 H ALA A 690 -8.906 17.654 50.406 1.00 0.00 H TER 2297 ALA A 690 HETATM 2298 O HOH 1 -0.997 19.726 50.206 1.00 34.64 O HETATM 2299 O HOH 2 13.466 -18.050 52.585 1.00 34.68 O HETATM 2300 O HOH 3 -0.923 9.642 51.128 1.00 36.96 O HETATM 2301 O HOH 4 -7.149 -4.527 21.400 1.00 27.39 O HETATM 2302 O HOH 5 15.356 8.023 31.514 1.00 44.62 O HETATM 2303 O HOH 6 17.222 -20.925 30.808 1.00 46.34 O HETATM 2304 O HOH 7 21.064 -15.891 37.847 1.00 47.55 O HETATM 2305 O HOH 8 1.766 3.884 23.239 1.00 23.45 O HETATM 2306 O HOH 9 -8.566 1.935 11.809 1.00 42.36 O HETATM 2307 O HOH 10 15.187 -6.874 47.376 1.00 40.50 O HETATM 2308 O HOH 11 -10.741 -3.267 36.613 1.00 27.65 O HETATM 2309 O HOH 12 9.505 13.390 30.700 1.00 28.74 O HETATM 2310 O HOH 13 -4.031 11.067 15.991 1.00 22.86 O HETATM 2311 O HOH 14 -15.378 -1.050 48.878 1.00 32.34 O HETATM 2312 O HOH 15 1.175 -5.690 47.057 1.00 31.72 O HETATM 2313 O HOH 16 9.998 -2.341 45.948 1.00 28.54 O HETATM 2314 O HOH 17 20.264 -21.701 38.839 1.00 37.36 O HETATM 2315 O HOH 18 -0.160 -2.926 53.602 1.00 34.78 O HETATM 2316 O HOH 19 -12.471 0.602 16.110 1.00 21.51 O HETATM 2317 O HOH 20 -9.717 15.938 48.338 1.00 26.44 O HETATM 2318 O HOH 21 1.795 9.213 18.089 1.00 24.39 O HETATM 2319 O HOH 22 -4.262 22.203 20.737 1.00 38.81 O HETATM 2320 O HOH 23 10.879 -20.222 31.200 1.00 27.24 O HETATM 2321 O HOH 24 -15.693 6.186 47.884 1.00 42.63 O HETATM 2322 O HOH 25 18.392 -12.986 51.939 1.00 42.66 O HETATM 2323 O HOH 26 15.140 3.993 36.663 1.00 34.35 O HETATM 2324 O HOH 27 3.861 9.202 46.017 1.00 23.88 O HETATM 2325 O HOH 28 -0.155 19.800 31.687 1.00 25.20 O HETATM 2326 O HOH 29 -5.849 2.373 49.315 1.00 35.04 O HETATM 2327 O HOH 30 13.814 -3.486 39.098 1.00 21.48 O HETATM 2328 O HOH 31 2.864 15.950 22.267 1.00 25.76 O HETATM 2329 O HOH 32 -9.105 5.306 23.958 1.00 16.44 O HETATM 2330 O HOH 33 5.404 -21.308 30.659 1.00 26.45 O HETATM 2331 O HOH 34 18.098 -22.791 30.656 1.00 46.45 O HETATM 2332 O HOH 35 -10.682 -2.439 23.510 1.00 22.57 O HETATM 2333 O HOH 36 11.960 -0.154 38.986 1.00 13.23 O HETATM 2334 O HOH 37 5.840 -15.186 31.705 1.00 23.74 O HETATM 2335 O HOH 38 -6.243 -6.710 43.221 1.00 21.27 O HETATM 2336 O HOH 39 -24.181 -0.076 24.049 1.00 30.25 O HETATM 2337 O HOH 40 7.916 -26.006 45.480 1.00 22.21 O HETATM 2338 O HOH 41 -3.667 -5.101 29.989 1.00 34.53 O HETATM 2339 O HOH 42 8.241 8.337 20.660 1.00 32.11 O HETATM 2340 O HOH 43 -7.695 19.158 56.366 1.00 45.25 O HETATM 2341 O HOH 44 -16.820 1.393 39.391 1.00 30.09 O HETATM 2342 O HOH 45 -0.344 23.435 18.636 1.00 38.77 O HETATM 2343 O HOH 46 -11.157 14.094 17.418 1.00 15.94 O HETATM 2344 O HOH 47 -7.128 -2.102 32.691 1.00 22.42 O HETATM 2345 O HOH 48 -9.469 4.135 21.758 1.00 30.62 O HETATM 2346 O HOH 49 -9.991 13.188 48.643 1.00 15.06 O HETATM 2347 O HOH 50 -10.060 6.741 11.145 1.00 26.61 O HETATM 2348 O HOH 51 -2.561 11.068 50.496 1.00 38.72 O HETATM 2349 O HOH 52 -11.428 9.878 25.367 1.00 12.44 O HETATM 2350 O HOH 53 -8.856 16.708 18.999 1.00 21.23 O HETATM 2351 O HOH 54 -6.136 17.905 55.343 1.00 33.97 O HETATM 2352 O HOH 55 3.710 -9.042 34.761 1.00 25.76 O HETATM 2353 O HOH 56 21.864 -4.927 31.476 1.00 28.20 O HETATM 2354 O HOH 57 5.364 12.629 24.748 1.00 27.88 O HETATM 2355 O HOH 58 -19.060 13.741 35.998 1.00 23.30 O HETATM 2356 O HOH 59 22.580 -3.596 34.720 1.00 24.73 O HETATM 2357 O HOH 60 3.043 6.361 52.500 1.00 42.97 O HETATM 2358 O HOH 61 -15.729 -5.522 21.053 1.00 35.49 O HETATM 2359 O HOH 62 4.810 -16.333 47.436 1.00 32.15 O HETATM 2360 O HOH 63 -8.525 -3.604 51.421 1.00 42.52 O HETATM 2361 O HOH 64 3.135 16.929 45.372 1.00 34.15 O HETATM 2362 O HOH 65 -16.473 8.238 39.509 1.00 25.42 O HETATM 2363 O HOH 66 7.720 17.717 36.358 1.00 28.60 O HETATM 2364 O HOH 67 5.807 -22.544 32.214 1.00 39.22 O HETATM 2365 O HOH 68 -5.520 -8.879 40.838 1.00 29.79 O HETATM 2366 O HOH 69 17.006 10.513 32.285 1.00 26.93 O HETATM 2367 O HOH 70 3.400 13.885 24.311 1.00 21.66 O HETATM 2368 O HOH 71 13.384 -19.920 48.345 1.00 25.22 O HETATM 2369 O HOH 72 3.095 -6.959 34.376 1.00 18.92 O HETATM 2370 O HOH 73 16.683 -18.749 55.883 1.00 32.58 O HETATM 2371 O HOH 74 20.262 -11.987 38.079 1.00 33.49 O HETATM 2372 O HOH 75 -1.732 4.464 22.115 1.00 18.06 O HETATM 2373 O HOH 76 10.251 -0.591 42.578 1.00 21.29 O HETATM 2374 O HOH 77 5.481 3.049 15.896 1.00 34.33 O HETATM 2375 O HOH 78 3.838 -13.756 52.988 1.00 35.74 O HETATM 2376 O HOH 79 6.255 11.691 20.448 1.00 33.36 O HETATM 2377 O HOH 80 -18.353 14.829 30.254 1.00 23.58 O HETATM 2378 O HOH 81 5.407 -13.195 29.879 1.00 24.53 O HETATM 2379 O HOH 82 -9.714 7.871 24.836 1.00 21.30 O HETATM 2380 O HOH 83 9.740 -25.518 43.185 1.00 16.97 O HETATM 2381 O HOH 84 -19.695 9.360 33.842 1.00 18.09 O HETATM 2382 O HOH 85 10.597 2.652 22.366 1.00 37.34 O HETATM 2383 O HOH 86 10.013 -0.213 24.419 1.00 31.69 O HETATM 2384 O HOH 87 12.063 -18.545 18.578 1.00 41.69 O HETATM 2385 O HOH 88 -13.957 19.758 32.819 1.00 22.43 O HETATM 2386 O HOH 89 -4.564 -5.195 20.329 1.00 42.36 O HETATM 2387 O HOH 90 -5.921 1.891 8.264 1.00 41.70 O HETATM 2388 O HOH 91 12.320 -24.733 41.582 1.00 40.05 O HETATM 2389 O HOH 92 -5.716 22.957 18.565 1.00 40.66 O HETATM 2390 O HOH 93 -7.567 -4.728 49.351 1.00 22.00 O HETATM 2391 O HOH 94 -17.755 7.205 37.162 1.00 10.88 O HETATM 2392 O HOH 95 3.981 1.871 11.252 1.00 38.47 O HETATM 2393 O HOH 96 -6.851 3.971 8.720 1.00 33.56 O HETATM 2394 O HOH 97 19.462 -0.877 38.203 1.00 32.54 O HETATM 2395 O HOH 98 -5.509 -3.292 28.740 1.00 34.41 O HETATM 2396 O HOH 99 -21.403 11.949 33.999 1.00 39.08 O HETATM 2397 O HOH 100 -15.649 7.966 49.962 1.00 36.44 O HETATM 2398 O HOH 101 18.695 -24.156 32.750 1.00 37.76 O HETATM 2399 O HOH 102 11.982 12.208 34.527 1.00 22.08 O HETATM 2400 O HOH 103 -9.002 19.206 20.626 1.00 39.85 O HETATM 2401 O HOH 104 -20.904 8.904 36.092 1.00 46.07 O HETATM 2402 O HOH 105 -5.508 15.406 55.558 1.00 42.89 O HETATM 2403 O HOH 106 27.503 -14.839 48.203 1.00 37.55 O HETATM 2404 O HOH 107 12.223 14.116 29.332 1.00 34.42 O HETATM 2405 O HOH 108 -2.646 -22.104 25.799 1.00 35.56 O HETATM 2406 O HOH 109 9.620 -17.360 17.107 1.00 45.26 O HETATM 2407 O HOH 110 16.628 13.452 31.196 1.00 20.67 O HETATM 2408 O HOH 111 3.230 10.947 15.984 1.00 26.01 O HETATM 2409 O HOH 112 8.266 -20.397 21.371 1.00 36.49 O HETATM 2410 O HOH 113 3.159 3.512 53.911 1.00 44.23 O HETATM 2411 O HOH 114 8.312 -19.013 19.017 1.00 45.09 O HETATM 2412 O HOH 115 13.523 10.917 35.284 1.00 35.28 O HETATM 2413 O HOH 116 -8.127 22.513 20.005 1.00 43.25 O HETATM 2414 O HOH 117 -18.154 17.204 31.649 1.00 33.53 O HETATM 2415 O HOH 118 15.272 14.860 29.811 1.00 28.42 O HETATM 2416 O HOH 119 6.992 -21.588 20.855 1.00 45.67 O HETATM 2417 O HOH 120 -9.489 -12.915 46.079 1.00 33.84 O HETATM 2418 O HOH 121 10.300 -20.367 20.265 1.00 31.29 O HETATM 2419 O HOH 122 -16.893 18.723 32.678 1.00 27.84 O HETATM 2420 C35 YAM A 123 -1.634 -12.372 37.433 1.00 0.05 C HETATM 2421 N30 YAM A 123 -0.888 -11.728 36.329 1.00 -0.17 N HETATM 2422 C20 YAM A 123 -0.660 -10.275 36.309 1.00 0.14 C HETATM 2423 C13 YAM A 123 0.594 -9.731 36.613 1.00 0.03 C HETATM 2424 C17 YAM A 123 0.735 -8.331 36.569 1.00 -0.05 C HETATM 2425 C18 YAM A 123 -0.348 -7.532 36.225 1.00 -0.06 C HETATM 2426 C19 YAM A 123 -1.548 -8.172 35.933 1.00 -0.02 C HETATM 2427 N1 YAM A 123 -1.733 -9.510 35.967 1.00 -0.30 N HETATM 2428 H10 YAM A 123 -2.395 -7.553 35.659 1.00 0.07 H HETATM 2429 H8 YAM A 123 -0.261 -6.452 36.186 1.00 0.05 H HETATM 2430 H11 YAM A 123 1.690 -7.876 36.804 1.00 0.06 H HETATM 2431 C12 YAM A 123 1.762 -10.597 36.983 1.00 0.07 C HETATM 2432 N10 YAM A 123 2.872 -9.776 37.410 1.00 -0.28 N HETATM 2433 C5 YAM A 123 3.014 -9.477 38.758 1.00 0.15 C HETATM 2434 C6 YAM A 123 4.171 -8.843 39.208 1.00 0.10 C HETATM 2435 C7 YAM A 123 4.231 -8.555 40.563 1.00 0.04 C HETATM 2436 N2 YAM A 123 3.265 -8.883 41.442 1.00 -0.23 N HETATM 2437 C3 YAM A 123 2.178 -9.504 40.932 1.00 0.23 C HETATM 2438 N4 YAM A 123 2.034 -9.819 39.625 1.00 -0.21 N HETATM 2439 N9 YAM A 123 1.167 -9.820 41.835 1.00 -0.24 N HETATM 2440 C11 YAM A 123 -0.159 -10.238 41.632 1.00 0.06 C HETATM 2441 C16 YAM A 123 -0.906 -10.003 40.447 1.00 -0.05 C HETATM 2442 C15 YAM A 123 -2.223 -10.442 40.294 1.00 -0.05 C HETATM 2443 C21 YAM A 123 -2.766 -11.123 41.360 1.00 0.06 C HETATM 2444 C22 YAM A 123 -2.053 -11.368 42.526 1.00 -0.01 C HETATM 2445 C14 YAM A 123 -0.757 -10.948 42.689 1.00 -0.04 C HETATM 2446 H16 YAM A 123 -0.212 -11.156 43.602 1.00 0.05 H HETATM 2447 C23 YAM A 123 -2.904 -12.127 43.488 1.00 0.07 C HETATM 2448 C24 YAM A 123 -4.218 -12.295 42.714 1.00 0.21 C HETATM 2449 N25 YAM A 123 -4.042 -11.667 41.473 1.00 -0.24 N HETATM 2450 H20 YAM A 123 -4.743 -11.617 40.761 1.00 0.22 H HETATM 2451 O26 YAM A 123 -5.206 -12.881 43.144 1.00 -0.39 O HETATM 2452 H17 YAM A 123 -3.060 -11.557 44.416 1.00 0.06 H HETATM 2453 H18 YAM A 123 -2.458 -13.103 43.728 1.00 0.06 H HETATM 2454 H19 YAM A 123 -2.786 -10.257 39.386 1.00 0.05 H HETATM 2455 H9 YAM A 123 -0.437 -9.463 39.632 1.00 0.05 H HETATM 2456 H15 YAM A 123 1.438 -9.732 42.825 1.00 0.23 H HETATM 2457 H7 YAM A 123 5.106 -8.036 40.936 1.00 0.11 H HETATM 2458 C8 YAM A 123 5.262 -8.419 38.285 1.00 0.36 C HETATM 2459 F29 YAM A 123 4.772 -7.592 37.311 1.00 -0.24 F HETATM 2460 F28 YAM A 123 6.206 -7.635 38.877 1.00 -0.24 F HETATM 2461 F27 YAM A 123 5.898 -9.444 37.667 1.00 -0.24 F HETATM 2462 H14 YAM A 123 3.550 -9.417 36.722 1.00 0.20 H HETATM 2463 H12 YAM A 123 2.065 -11.193 36.109 1.00 0.07 H HETATM 2464 H13 YAM A 123 1.471 -11.270 37.803 1.00 0.07 H HETATM 2465 S31 YAM A 123 -0.362 -12.680 35.002 1.00 0.06 S HETATM 2466 C34 YAM A 123 -1.798 -12.338 33.985 1.00 0.08 C HETATM 2467 H4 YAM A 123 -1.815 -11.270 33.722 1.00 0.05 H HETATM 2468 H5 YAM A 123 -2.711 -12.593 34.542 1.00 0.05 H HETATM 2469 H6 YAM A 123 -1.749 -12.941 33.066 1.00 0.05 H HETATM 2470 O33 YAM A 123 0.751 -12.047 34.307 1.00 -0.15 O HETATM 2471 O32 YAM A 123 -0.382 -14.088 35.321 1.00 -0.15 O HETATM 2472 H1 YAM A 123 -1.890 -11.618 38.192 1.00 0.05 H HETATM 2473 H2 YAM A 123 -1.010 -13.155 37.890 1.00 0.05 H HETATM 2474 H3 YAM A 123 -2.557 -12.822 37.038 1.00 0.05 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 229 230 239 240 241 CONECT 239 229 CONECT 240 229 CONECT 241 229 CONECT 350 351 355 356 357 CONECT 355 350 CONECT 356 350 CONECT 357 350 CONECT 610 611 616 617 618 CONECT 617 610 CONECT 618 610 CONECT 1304 1305 1310 1311 1312 CONECT 1311 1304 CONECT 1312 1304 CONECT 2420 2421 2472 2473 2474 CONECT 2421 2420 2422 2465 CONECT 2422 2421 2423 2427 CONECT 2423 2422 2424 2431 CONECT 2424 2423 2425 2430 CONECT 2425 2424 2426 2429 CONECT 2426 2425 2427 2428 CONECT 2427 2422 2426 CONECT 2428 2426 CONECT 2429 2425 CONECT 2430 2424 CONECT 2431 2423 2432 2463 2464 CONECT 2432 2431 2433 2462 CONECT 2433 2432 2434 2438 CONECT 2434 2433 2435 2458 CONECT 2435 2434 2436 2457 CONECT 2436 2435 2437 CONECT 2437 2436 2438 2439 CONECT 2438 2433 2437 CONECT 2439 2437 2440 2456 CONECT 2440 2439 2441 2445 CONECT 2441 2440 2442 2455 CONECT 2442 2441 2443 2454 CONECT 2443 2442 2444 2449 CONECT 2444 2443 2445 2447 CONECT 2445 2440 2444 2446 CONECT 2446 2445 CONECT 2447 2444 2448 2452 2453 CONECT 2448 2447 2449 2451 CONECT 2449 2443 2448 2450 CONECT 2450 2449 CONECT 2451 2448 CONECT 2452 2447 CONECT 2453 2447 CONECT 2454 2442 CONECT 2455 2441 CONECT 2456 2439 CONECT 2457 2435 CONECT 2458 2434 2459 2460 2461 CONECT 2459 2458 CONECT 2460 2458 CONECT 2461 2458 CONECT 2462 2432 CONECT 2463 2431 CONECT 2464 2431 CONECT 2465 2421 2466 2470 2471 CONECT 2466 2465 2467 2468 2469 CONECT 2467 2466 CONECT 2468 2466 CONECT 2469 2466 CONECT 2470 2465 CONECT 2471 2465 CONECT 2472 2420 CONECT 2473 2420 CONECT 2474 2420 MASTER 0 0 0 0 0 0 0 0 2469 5 73 21 END
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Structure:
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Related entries of code: 5tob
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
277aa, >3ET7_1|Chain... at 100%
3fzr
RCSB PDB
PDBbind
277aa, >3FZR_1|Chain... at 100%
3fzs
RCSB PDB
PDBbind
277aa, >3FZS_1|Chain... at 100%
3fzt
RCSB PDB
PDBbind
277aa, >3FZT_1|Chain... at 100%
3h3c
RCSB PDB
PDBbind
277aa, >3H3C_1|Chain... at 100%
4h1j
RCSB PDB
PDBbind
293aa, >4H1J_1|Chain... *
4h1m
RCSB PDB
PDBbind
293aa, >4H1M_1|Chain... at 100%
5to8
RCSB PDB
PDBbind
282aa, >5TO8_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
3bz3
RCSB PDB
PDBbind
YAM
5x4o
RCSB PDB
PDBbind
YAM
Entry Information
PDB ID
5tob
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Protein-tyrosine kinase 2-beta
Ligand Name
YAM
EC.Number
E.C.-.-.-.-
Resolution
2.12(Å)
Affinity (Kd/Ki/IC50)
IC50=1.5nM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Bioorg. Med. Chem. Lett. Vol. 26: pp. 5926-5930
Ligand Properties
Formula
C
2
1
H
2
0
F
3
N
7
O
3
S
Molecular Weight
507.489
Exact Mass
507.130
No. of atoms
55
No. of bonds
58
Polar Surface Area
137.59
LOGP Value
2.04 (
Computed with XLOGP3
)
4.50 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 4
Canonical SMILES
O=C1Nc2c(C1)cc(cc2)Nc1ncc(c(n1)NCc1cccnc1N(S(=O)(=O)C)C)C(F)(F)F
InChI String
InChI=1S/C21H20F3N7O3S/c1-31(35(2,33)34)19-12(4-3-7-25-19)10-26-18-15(21(22,23)24)11-27-20(30-18)28-14-5-6-16-13(8-14)9-17(32)29-16/h3-8,11H,9-10H2,1-2H3,(H,29,32)(H2,26,27,28,30)
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):
Q14289
Entrez Gene ID
NCBI Entrez Gene ID:
2185
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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