Browse entries in the PDBbind-CN Database
HEADER 5TKD_COMPLEX COMPND 5TKD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 29 PHE HIS ARG VAL ASP GLN LYS GLU ILE THR GLN LEU SER SEQRES 2 A 29 HIS LEU GLY GLN GLY THR ARG THR ASN VAL TYR GLU GLY SEQRES 3 A 29 ARG LEU ARG SEQRES 1 A 149 LEU ARG VAL VAL LEU LYS VAL LEU ASP PRO SER HIS HIS SEQRES 2 A 149 ASP ILE ALA LEU ALA PHE TYR GLU THR ALA SER LEU MET SEQRES 3 A 149 SER GLN VAL SER HIS THR HIS LEU ALA PHE VAL HIS GLY SEQRES 4 A 149 VAL CYS VAL ARG GLY PRO GLU ASN ILE MET VAL THR GLU SEQRES 5 A 149 TYR VAL GLU HIS GLY PRO LEU ASP VAL TRP LEU ARG ARG SEQRES 6 A 149 GLU ARG GLY HIS VAL PRO MET ALA TRP LYS MET VAL VAL SEQRES 7 A 149 ALA GLN GLN LEU ALA SER ALA LEU SER TYR LEU GLU ASN SEQRES 8 A 149 LYS ASN LEU VAL HIS GLY ASN VAL CYS GLY ARG ASN ILE SEQRES 9 A 149 LEU LEU ALA ARG LEU GLY LEU ALA GLU GLY THR SER PRO SEQRES 10 A 149 PHE ILE LYS LEU SER ASP PRO GLY VAL GLY LEU GLY ALA SEQRES 11 A 149 LEU SER ARG GLU GLU ARG VAL GLU ARG ILE PRO TRP LEU SEQRES 12 A 149 ALA PRO GLU CYS LEU PRO SEQRES 1 A 24 SER THR ALA MET ASP LYS TRP GLY PHE GLY ALA THR LEU SEQRES 2 A 24 LEU GLU ILE CYS PHE ASP GLY GLU ALA PRO LEU SEQRES 1 A 20 ARG SER PRO SER GLU LYS GLU HIS PHE TYR GLN ARG GLN SEQRES 2 A 20 HIS ARG LEU PRO GLU PRO SER SEQRES 1 A 26 LEU ALA THR LEU THR SER GLN CYS LEU THR TYR GLU PRO SEQRES 2 A 26 THR GLN ARG PRO SER PHE ARG THR ILE LEU ARG ASP LEU HET UNN A 335 41 ATOM 1 N PHE A 581 31.176 6.416 37.213 1.00 30.61 N ATOM 2 CA PHE A 581 29.972 5.762 37.706 1.00 29.15 C ATOM 3 C PHE A 581 30.079 5.348 39.152 1.00 35.06 C ATOM 4 O PHE A 581 31.178 5.122 39.652 1.00 34.58 O ATOM 5 CB PHE A 581 29.573 4.554 36.829 1.00 28.95 C ATOM 6 CG PHE A 581 30.638 3.496 36.608 1.00 28.56 C ATOM 7 CD1 PHE A 581 30.901 2.536 37.577 1.00 30.09 C ATOM 8 CD2 PHE A 581 31.316 3.415 35.401 1.00 29.19 C ATOM 9 CE1 PHE A 581 31.871 1.537 37.355 1.00 30.80 C ATOM 10 CE2 PHE A 581 32.275 2.417 35.177 1.00 31.59 C ATOM 11 CZ PHE A 581 32.542 1.486 36.151 1.00 29.50 C ATOM 12 HN3 PHE A 581 31.982 5.765 37.298 1.00 0.00 H ATOM 13 HN2 PHE A 581 31.359 7.271 37.775 1.00 0.00 H ATOM 14 HN1 PHE A 581 31.043 6.677 36.215 1.00 0.00 H ATOM 15 N HIS A 582 28.919 5.212 39.809 1.00 32.36 N ATOM 16 CA HIS A 582 28.807 4.785 41.192 1.00 30.96 C ATOM 17 C HIS A 582 28.989 3.275 41.230 1.00 32.18 C ATOM 18 O HIS A 582 28.482 2.562 40.346 1.00 29.64 O ATOM 19 CB HIS A 582 27.425 5.181 41.750 1.00 32.36 C ATOM 20 CG HIS A 582 27.174 4.696 43.145 1.00 36.85 C ATOM 21 ND1 HIS A 582 26.209 3.736 43.414 1.00 39.82 N ATOM 22 CD2 HIS A 582 27.779 5.045 44.304 1.00 38.74 C ATOM 23 CE1 HIS A 582 26.263 3.529 44.724 1.00 38.85 C ATOM 24 NE2 HIS A 582 27.201 4.288 45.298 1.00 39.10 N ATOM 25 H HIS A 582 28.041 5.426 39.294 1.00 0.00 H ATOM 26 N ARG A 583 29.735 2.783 42.234 1.00 28.70 N ATOM 27 CA ARG A 583 29.963 1.348 42.412 1.00 28.55 C ATOM 28 C ARG A 583 28.891 0.857 43.351 1.00 30.70 C ATOM 29 O ARG A 583 28.698 1.430 44.426 1.00 31.38 O ATOM 30 CB ARG A 583 31.397 1.067 42.961 1.00 29.81 C ATOM 31 CG ARG A 583 31.724 -0.418 43.137 1.00 37.78 C ATOM 32 CD ARG A 583 32.216 -1.095 41.860 1.00 48.87 C ATOM 33 NE ARG A 583 33.681 -1.169 41.819 1.00 59.23 N ATOM 34 CZ ARG A 583 34.392 -2.255 42.102 1.00 64.22 C ATOM 35 NH1 ARG A 583 33.788 -3.388 42.422 1.00 45.46 N ATOM 36 NH2 ARG A 583 35.715 -2.220 42.049 1.00 67.54 N ATOM 37 HE ARG A 583 34.200 -0.309 41.549 1.00 0.00 H ATOM 38 HH12 ARG A 583 34.352 -4.234 42.642 1.00 0.00 H ATOM 39 HH11 ARG A 583 32.749 -3.433 42.453 1.00 0.00 H ATOM 40 HH22 ARG A 583 36.267 -3.073 42.271 1.00 0.00 H ATOM 41 HH21 ARG A 583 36.202 -1.340 41.785 1.00 0.00 H ATOM 42 H ARG A 583 30.166 3.446 42.909 1.00 0.00 H ATOM 43 N VAL A 584 28.172 -0.171 42.948 1.00 26.21 N ATOM 44 CA VAL A 584 27.092 -0.749 43.747 1.00 26.26 C ATOM 45 C VAL A 584 27.607 -2.073 44.303 1.00 33.23 C ATOM 46 O VAL A 584 28.112 -2.882 43.524 1.00 32.50 O ATOM 47 CB VAL A 584 25.821 -0.961 42.859 1.00 30.88 C ATOM 48 CG1 VAL A 584 24.738 -1.763 43.591 1.00 31.16 C ATOM 49 CG2 VAL A 584 25.263 0.368 42.331 1.00 29.75 C ATOM 50 H VAL A 584 28.382 -0.590 42.020 1.00 0.00 H ATOM 51 N ASP A 585 27.453 -2.324 45.625 1.00 31.21 N ATOM 52 CA ASP A 585 27.846 -3.614 46.203 1.00 31.46 C ATOM 53 C ASP A 585 26.741 -4.634 45.904 1.00 36.03 C ATOM 54 O ASP A 585 25.562 -4.269 45.891 1.00 35.43 O ATOM 55 CB ASP A 585 28.036 -3.490 47.728 1.00 33.94 C ATOM 56 CG ASP A 585 28.796 -4.655 48.314 1.00 44.95 C ATOM 57 OD1 ASP A 585 28.152 -5.687 48.639 1.00 44.45 O ATOM 58 OD2 ASP A 585 30.042 -4.570 48.388 1.00 53.75 O ATOM 59 H ASP A 585 27.049 -1.590 46.241 1.00 0.00 H ATOM 60 N GLN A 586 27.102 -5.915 45.712 1.00 33.74 N ATOM 61 CA GLN A 586 26.117 -6.983 45.464 1.00 34.57 C ATOM 62 C GLN A 586 25.110 -7.179 46.614 1.00 39.20 C ATOM 63 O GLN A 586 24.001 -7.664 46.370 1.00 39.18 O ATOM 64 CB GLN A 586 26.806 -8.308 45.118 1.00 36.53 C ATOM 65 H GLN A 586 28.112 -6.161 45.739 1.00 0.00 H ATOM 66 N LYS A 587 25.463 -6.750 47.849 1.00 35.01 N ATOM 67 CA LYS A 587 24.572 -6.840 49.018 1.00 34.40 C ATOM 68 C LYS A 587 23.402 -5.843 48.892 1.00 37.17 C ATOM 69 O LYS A 587 22.360 -6.018 49.532 1.00 38.21 O ATOM 70 CB LYS A 587 25.363 -6.542 50.310 1.00 36.86 C ATOM 71 H LYS A 587 26.409 -6.337 47.978 1.00 0.00 H ATOM 72 N GLU A 588 23.588 -4.795 48.090 1.00 31.87 N ATOM 73 CA GLU A 588 22.586 -3.747 47.886 1.00 32.18 C ATOM 74 C GLU A 588 21.545 -4.087 46.795 1.00 32.78 C ATOM 75 O GLU A 588 20.566 -3.366 46.654 1.00 31.28 O ATOM 76 CB GLU A 588 23.278 -2.406 47.581 1.00 33.76 C ATOM 77 H GLU A 588 24.492 -4.717 47.582 1.00 0.00 H ATOM 78 N ILE A 589 21.730 -5.177 46.054 1.00 30.58 N ATOM 79 CA ILE A 589 20.775 -5.514 44.991 1.00 31.01 C ATOM 80 C ILE A 589 20.113 -6.870 45.164 1.00 35.57 C ATOM 81 O ILE A 589 20.728 -7.803 45.683 1.00 36.31 O ATOM 82 CB ILE A 589 21.381 -5.378 43.552 1.00 34.61 C ATOM 83 CG1 ILE A 589 22.659 -6.215 43.379 1.00 35.32 C ATOM 84 CG2 ILE A 589 21.594 -3.902 43.168 1.00 35.17 C ATOM 85 CD1 ILE A 589 23.099 -6.460 41.856 1.00 42.37 C ATOM 86 H ILE A 589 22.552 -5.790 46.228 1.00 0.00 H ATOM 87 N THR A 590 18.875 -6.974 44.652 1.00 30.34 N ATOM 88 CA THR A 590 18.048 -8.178 44.642 1.00 30.64 C ATOM 89 C THR A 590 17.672 -8.444 43.173 1.00 34.29 C ATOM 90 O THR A 590 17.173 -7.546 42.515 1.00 33.36 O ATOM 91 CB THR A 590 16.791 -7.957 45.529 1.00 38.34 C ATOM 92 OG1 THR A 590 17.196 -7.577 46.845 1.00 40.18 O ATOM 93 CG2 THR A 590 15.908 -9.170 45.610 1.00 35.77 C ATOM 94 HG1 THR A 590 16.394 -7.437 47.408 1.00 0.00 H ATOM 95 H THR A 590 18.468 -6.118 44.223 1.00 0.00 H ATOM 96 N GLN A 591 17.937 -9.651 42.663 1.00 30.42 N ATOM 97 CA GLN A 591 17.585 -9.998 41.290 1.00 29.37 C ATOM 98 C GLN A 591 16.242 -10.720 41.256 1.00 34.61 C ATOM 99 O GLN A 591 16.088 -11.764 41.899 1.00 34.43 O ATOM 100 CB GLN A 591 18.673 -10.842 40.651 1.00 30.08 C ATOM 101 CG GLN A 591 18.401 -11.149 39.192 1.00 30.04 C ATOM 102 CD GLN A 591 19.570 -11.865 38.564 1.00 50.04 C ATOM 103 OE1 GLN A 591 20.714 -11.401 38.583 1.00 45.87 O ATOM 104 NE2 GLN A 591 19.302 -12.997 37.958 1.00 40.61 N ATOM 105 HE22 GLN A 591 18.330 -13.368 37.955 1.00 0.00 H ATOM 106 HE21 GLN A 591 20.061 -13.523 37.480 1.00 0.00 H ATOM 107 H GLN A 591 18.406 -10.361 43.260 1.00 0.00 H ATOM 108 N LEU A 592 15.286 -10.168 40.488 1.00 30.50 N ATOM 109 CA LEU A 592 13.931 -10.690 40.379 1.00 29.92 C ATOM 110 C LEU A 592 13.672 -11.284 38.990 1.00 34.10 C ATOM 111 O LEU A 592 14.589 -11.900 38.436 1.00 34.67 O ATOM 112 CB LEU A 592 12.916 -9.598 40.812 1.00 30.28 C ATOM 113 CG LEU A 592 13.153 -8.986 42.224 1.00 35.71 C ATOM 114 CD1 LEU A 592 12.312 -7.765 42.466 1.00 36.04 C ATOM 115 CD2 LEU A 592 12.929 -10.037 43.336 1.00 39.72 C ATOM 116 H LEU A 592 15.529 -9.318 39.940 1.00 0.00 H ATOM 117 N SER A 593 12.452 -11.140 38.432 1.00 30.37 N ATOM 118 CA SER A 593 12.061 -11.761 37.157 1.00 30.78 C ATOM 119 C SER A 593 12.851 -11.328 35.925 1.00 32.13 C ATOM 120 O SER A 593 13.197 -10.157 35.791 1.00 30.50 O ATOM 121 CB SER A 593 10.574 -11.552 36.886 1.00 34.66 C ATOM 122 OG SER A 593 9.806 -12.246 37.852 1.00 52.46 O ATOM 123 HG SER A 593 8.843 -12.106 37.669 1.00 0.00 H ATOM 124 H SER A 593 11.749 -10.558 38.931 1.00 0.00 H ATOM 125 N HIS A 594 13.096 -12.278 35.018 1.00 29.52 N ATOM 126 CA HIS A 594 13.762 -12.019 33.749 1.00 29.83 C ATOM 127 C HIS A 594 12.820 -11.168 32.880 1.00 34.77 C ATOM 128 O HIS A 594 11.613 -11.430 32.824 1.00 33.07 O ATOM 129 CB HIS A 594 14.112 -13.332 33.059 1.00 30.59 C ATOM 130 CG HIS A 594 14.955 -13.182 31.842 1.00 33.81 C ATOM 131 ND1 HIS A 594 14.421 -13.335 30.573 1.00 36.04 N ATOM 132 CD2 HIS A 594 16.285 -12.944 31.733 1.00 35.52 C ATOM 133 CE1 HIS A 594 15.439 -13.184 29.737 1.00 35.53 C ATOM 134 NE2 HIS A 594 16.584 -12.968 30.390 1.00 35.47 N ATOM 135 H HIS A 594 12.796 -13.251 35.229 1.00 0.00 H ATOM 136 N LEU A 595 13.353 -10.099 32.283 1.00 29.70 N ATOM 137 CA LEU A 595 12.568 -9.199 31.432 1.00 28.59 C ATOM 138 C LEU A 595 12.842 -9.440 29.963 1.00 30.84 C ATOM 139 O LEU A 595 11.937 -9.319 29.152 1.00 31.92 O ATOM 140 CB LEU A 595 12.827 -7.731 31.776 1.00 28.50 C ATOM 141 CG LEU A 595 12.339 -7.208 33.127 1.00 32.09 C ATOM 142 CD1 LEU A 595 12.870 -5.812 33.357 1.00 31.46 C ATOM 143 CD2 LEU A 595 10.794 -7.239 33.244 1.00 33.49 C ATOM 144 H LEU A 595 14.363 -9.897 32.427 1.00 0.00 H ATOM 145 N GLY A 596 14.084 -9.747 29.620 1.00 25.19 N ATOM 146 CA GLY A 596 14.477 -9.984 28.239 1.00 25.41 C ATOM 147 C GLY A 596 15.984 -10.003 28.085 1.00 28.75 C ATOM 148 O GLY A 596 16.721 -9.967 29.070 1.00 28.28 O ATOM 149 H GLY A 596 14.805 -9.821 30.366 1.00 0.00 H ATOM 150 N GLN A 597 16.441 -10.086 26.853 1.00 26.74 N ATOM 151 CA GLN A 597 17.856 -10.132 26.571 1.00 27.21 C ATOM 152 C GLN A 597 18.246 -8.972 25.692 1.00 31.27 C ATOM 153 O GLN A 597 17.479 -8.561 24.812 1.00 30.45 O ATOM 154 CB GLN A 597 18.232 -11.440 25.859 1.00 28.58 C ATOM 155 CG GLN A 597 17.890 -12.697 26.646 1.00 35.25 C ATOM 156 CD GLN A 597 18.484 -13.908 26.010 1.00 51.46 C ATOM 157 OE1 GLN A 597 18.145 -14.261 24.887 1.00 41.90 O ATOM 158 NE2 GLN A 597 19.347 -14.591 26.743 1.00 49.56 N ATOM 159 HE22 GLN A 597 19.605 -14.253 27.692 1.00 0.00 H ATOM 160 HE21 GLN A 597 19.767 -15.466 26.371 1.00 0.00 H ATOM 161 H GLN A 597 15.765 -10.119 26.063 1.00 0.00 H ATOM 162 N GLY A 598 19.437 -8.461 25.949 1.00 27.03 N ATOM 163 CA GLY A 598 20.064 -7.417 25.157 1.00 26.65 C ATOM 164 C GLY A 598 21.285 -8.024 24.504 1.00 29.17 C ATOM 165 O GLY A 598 21.476 -9.244 24.569 1.00 28.53 O ATOM 166 H GLY A 598 19.958 -8.829 26.770 1.00 0.00 H ATOM 167 N THR A 599 22.148 -7.193 23.891 1.00 26.06 N ATOM 168 CA THR A 599 23.390 -7.690 23.297 1.00 24.87 C ATOM 169 C THR A 599 24.339 -8.153 24.423 1.00 26.95 C ATOM 170 O THR A 599 24.802 -7.321 25.212 1.00 23.92 O ATOM 171 CB THR A 599 24.032 -6.606 22.429 1.00 32.24 C ATOM 172 OG1 THR A 599 23.063 -6.166 21.465 1.00 36.11 O ATOM 173 CG2 THR A 599 25.288 -7.106 21.720 1.00 31.58 C ATOM 174 HG1 THR A 599 22.273 -5.800 21.936 1.00 0.00 H ATOM 175 H THR A 599 21.928 -6.178 23.838 1.00 0.00 H ATOM 176 N ARG A 600 24.607 -9.486 24.504 1.00 24.15 N ATOM 177 CA ARG A 600 25.462 -10.126 25.523 1.00 24.26 C ATOM 178 C ARG A 600 24.946 -9.894 26.953 1.00 27.50 C ATOM 179 O ARG A 600 25.713 -10.023 27.899 1.00 27.69 O ATOM 180 CB ARG A 600 26.938 -9.667 25.390 1.00 25.95 C ATOM 181 CG ARG A 600 27.535 -10.038 24.041 1.00 37.10 C ATOM 182 CD ARG A 600 28.789 -9.256 23.777 1.00 44.51 C ATOM 183 NE ARG A 600 29.288 -9.482 22.422 1.00 44.52 N ATOM 184 CZ ARG A 600 30.412 -10.126 22.130 1.00 50.72 C ATOM 185 NH1 ARG A 600 31.146 -10.669 23.094 1.00 34.59 N ATOM 186 NH2 ARG A 600 30.806 -10.243 20.873 1.00 37.79 N ATOM 187 HE ARG A 600 28.723 -9.112 21.631 1.00 0.00 H ATOM 188 HH12 ARG A 600 32.025 -11.172 22.858 1.00 0.00 H ATOM 189 HH11 ARG A 600 30.842 -10.591 24.085 1.00 0.00 H ATOM 190 HH22 ARG A 600 31.687 -10.748 20.649 1.00 0.00 H ATOM 191 HH21 ARG A 600 30.235 -9.830 20.108 1.00 0.00 H ATOM 192 H ARG A 600 24.173 -10.104 23.789 1.00 0.00 H ATOM 193 N THR A 601 23.653 -9.553 27.117 1.00 24.15 N ATOM 194 CA THR A 601 23.098 -9.321 28.448 1.00 24.29 C ATOM 195 C THR A 601 21.754 -10.032 28.652 1.00 27.70 C ATOM 196 O THR A 601 21.060 -10.388 27.697 1.00 26.33 O ATOM 197 CB THR A 601 22.858 -7.816 28.738 1.00 27.24 C ATOM 198 OG1 THR A 601 21.936 -7.330 27.781 1.00 27.71 O ATOM 199 CG2 THR A 601 24.136 -6.975 28.747 1.00 28.30 C ATOM 200 HG1 THR A 601 21.087 -7.834 27.857 1.00 0.00 H ATOM 201 H THR A 601 23.040 -9.453 26.283 1.00 0.00 H ATOM 202 N ASN A 602 21.408 -10.202 29.917 1.00 23.15 N ATOM 203 CA ASN A 602 20.120 -10.652 30.388 1.00 23.17 C ATOM 204 C ASN A 602 19.668 -9.534 31.296 1.00 25.80 C ATOM 205 O ASN A 602 20.430 -9.032 32.127 1.00 25.72 O ATOM 206 CB ASN A 602 20.214 -11.991 31.107 1.00 24.58 C ATOM 207 CG ASN A 602 20.300 -13.131 30.134 1.00 37.98 C ATOM 208 OD1 ASN A 602 19.319 -13.524 29.515 1.00 31.31 O ATOM 209 ND2 ASN A 602 21.499 -13.605 29.893 1.00 28.53 N ATOM 210 HD22 ASN A 602 22.315 -13.254 30.433 1.00 0.00 H ATOM 211 HD21 ASN A 602 21.633 -14.332 29.162 1.00 0.00 H ATOM 212 H ASN A 602 22.129 -9.993 30.637 1.00 0.00 H ATOM 213 N VAL A 603 18.447 -9.076 31.079 1.00 22.72 N ATOM 214 CA VAL A 603 17.877 -7.951 31.788 1.00 20.44 C ATOM 215 C VAL A 603 16.785 -8.446 32.733 1.00 24.76 C ATOM 216 O VAL A 603 15.895 -9.176 32.300 1.00 23.81 O ATOM 217 CB VAL A 603 17.404 -6.881 30.777 1.00 22.46 C ATOM 218 CG1 VAL A 603 16.712 -5.722 31.476 1.00 22.42 C ATOM 219 CG2 VAL A 603 18.582 -6.376 29.924 1.00 21.64 C ATOM 220 H VAL A 603 17.865 -9.550 30.360 1.00 0.00 H ATOM 221 N TYR A 604 16.902 -8.094 34.021 1.00 21.64 N ATOM 222 CA TYR A 604 15.978 -8.531 35.067 1.00 23.24 C ATOM 223 C TYR A 604 15.399 -7.348 35.781 1.00 25.91 C ATOM 224 O TYR A 604 16.042 -6.311 35.893 1.00 24.87 O ATOM 225 CB TYR A 604 16.726 -9.376 36.170 1.00 22.94 C ATOM 226 CG TYR A 604 17.433 -10.597 35.646 1.00 25.08 C ATOM 227 CD1 TYR A 604 18.708 -10.506 35.108 1.00 26.74 C ATOM 228 CD2 TYR A 604 16.813 -11.844 35.650 1.00 25.37 C ATOM 229 CE1 TYR A 604 19.336 -11.613 34.557 1.00 27.05 C ATOM 230 CE2 TYR A 604 17.433 -12.962 35.104 1.00 25.99 C ATOM 231 CZ TYR A 604 18.702 -12.847 34.575 1.00 32.19 C ATOM 232 OH TYR A 604 19.312 -13.952 34.032 1.00 32.69 O ATOM 233 HH TYR A 604 20.210 -13.702 33.700 1.00 0.00 H ATOM 234 H TYR A 604 17.694 -7.476 34.291 1.00 0.00 H ATOM 235 N GLU A 605 14.237 -7.543 36.386 1.00 23.87 N ATOM 236 CA GLU A 605 13.693 -6.569 37.322 1.00 23.55 C ATOM 237 C GLU A 605 14.523 -6.811 38.606 1.00 28.72 C ATOM 238 O GLU A 605 15.022 -7.922 38.839 1.00 30.03 O ATOM 239 CB GLU A 605 12.226 -6.900 37.613 1.00 25.34 C ATOM 240 CG GLU A 605 11.471 -5.766 38.300 1.00 37.69 C ATOM 241 CD GLU A 605 10.015 -6.086 38.601 1.00 52.88 C ATOM 242 OE1 GLU A 605 9.445 -6.970 37.920 1.00 47.21 O ATOM 243 OE2 GLU A 605 9.500 -5.552 39.610 1.00 39.66 O ATOM 244 H GLU A 605 13.701 -8.412 36.188 1.00 0.00 H ATOM 245 N GLY A 606 14.697 -5.778 39.389 1.00 25.96 N ATOM 246 CA GLY A 606 15.424 -5.910 40.637 1.00 27.94 C ATOM 247 C GLY A 606 15.038 -4.860 41.640 1.00 30.80 C ATOM 248 O GLY A 606 14.188 -4.009 41.367 1.00 31.33 O ATOM 249 H GLY A 606 14.310 -4.853 39.114 1.00 0.00 H ATOM 250 N ARG A 607 15.685 -4.924 42.805 1.00 28.87 N ATOM 251 CA ARG A 607 15.534 -3.952 43.881 1.00 27.73 C ATOM 252 C ARG A 607 16.901 -3.459 44.278 1.00 30.85 C ATOM 253 O ARG A 607 17.870 -4.220 44.259 1.00 28.65 O ATOM 254 CB ARG A 607 14.785 -4.532 45.112 1.00 28.05 C ATOM 255 CG ARG A 607 13.353 -5.002 44.840 1.00 34.33 C ATOM 256 CD ARG A 607 12.353 -3.852 44.647 1.00 45.03 C ATOM 257 NE ARG A 607 11.002 -4.349 44.386 1.00 40.85 N ATOM 258 CZ ARG A 607 10.532 -4.642 43.183 1.00 47.73 C ATOM 259 NH1 ARG A 607 11.300 -4.506 42.111 1.00 31.14 N ATOM 260 NH2 ARG A 607 9.301 -5.105 43.043 1.00 43.42 N ATOM 261 HE ARG A 607 10.368 -4.481 45.200 1.00 0.00 H ATOM 262 HH12 ARG A 607 10.924 -4.738 41.169 1.00 0.00 H ATOM 263 HH11 ARG A 607 12.278 -4.167 42.212 1.00 0.00 H ATOM 264 HH22 ARG A 607 8.936 -5.334 42.096 1.00 0.00 H ATOM 265 HH21 ARG A 607 8.698 -5.240 43.880 1.00 0.00 H ATOM 266 H ARG A 607 16.339 -5.718 42.955 1.00 0.00 H ATOM 267 N LEU A 608 16.993 -2.182 44.595 1.00 27.88 N ATOM 268 CA LEU A 608 18.246 -1.562 45.025 1.00 27.71 C ATOM 269 C LEU A 608 17.978 -0.919 46.379 1.00 35.56 C ATOM 270 O LEU A 608 17.051 -0.112 46.497 1.00 35.37 O ATOM 271 CB LEU A 608 18.694 -0.492 44.017 1.00 27.46 C ATOM 272 CG LEU A 608 19.868 0.407 44.433 1.00 32.51 C ATOM 273 CD1 LEU A 608 21.191 -0.388 44.483 1.00 32.67 C ATOM 274 CD2 LEU A 608 19.978 1.633 43.496 1.00 37.25 C ATOM 275 H LEU A 608 16.139 -1.591 44.537 1.00 0.00 H ATOM 276 N ARG A 609 18.767 -1.290 47.402 1.00 33.03 N ATOM 277 CA ARG A 609 18.612 -0.756 48.757 1.00 46.58 C ATOM 278 C ARG A 609 19.048 0.702 48.804 1.00 40.21 C ATOM 279 O ARG A 609 20.083 1.030 48.231 1.00 42.91 O ATOM 280 CB ARG A 609 19.413 -1.591 49.763 1.00 46.36 C ATOM 281 H ARG A 609 19.519 -1.986 47.224 1.00 0.00 H TER 282 ARG A 609 ATOM 283 N LEU A 637 14.366 0.717 46.064 1.00 36.87 N ATOM 284 CA LEU A 637 13.944 1.256 44.775 1.00 36.02 C ATOM 285 C LEU A 637 13.802 0.126 43.765 1.00 37.14 C ATOM 286 O LEU A 637 14.636 -0.779 43.723 1.00 36.02 O ATOM 287 CB LEU A 637 14.985 2.260 44.250 1.00 36.61 C ATOM 288 HN3 LEU A 637 15.282 0.236 45.954 1.00 0.00 H ATOM 289 HN2 LEU A 637 13.655 0.038 46.404 1.00 0.00 H ATOM 290 HN1 LEU A 637 14.461 1.494 46.749 1.00 0.00 H ATOM 291 N ARG A 638 12.778 0.194 42.930 1.00 31.96 N ATOM 292 CA ARG A 638 12.621 -0.780 41.865 1.00 31.23 C ATOM 293 C ARG A 638 13.627 -0.352 40.769 1.00 29.34 C ATOM 294 O ARG A 638 13.766 0.844 40.477 1.00 27.64 O ATOM 295 CB ARG A 638 11.190 -0.768 41.337 1.00 31.50 C ATOM 296 CG ARG A 638 10.889 -1.864 40.336 1.00 42.17 C ATOM 297 CD ARG A 638 9.401 -1.967 40.081 1.00 47.06 C ATOM 298 NE ARG A 638 8.806 -0.730 39.582 1.00 53.73 N ATOM 299 HE ARG A 638 9.400 0.111 39.435 1.00 0.00 H ATOM 300 H ARG A 638 12.077 0.955 43.038 1.00 0.00 H ATOM 301 N VAL A 639 14.345 -1.326 40.217 1.00 24.29 N ATOM 302 CA VAL A 639 15.375 -1.055 39.194 1.00 23.92 C ATOM 303 C VAL A 639 15.345 -2.157 38.161 1.00 26.22 C ATOM 304 O VAL A 639 14.609 -3.144 38.285 1.00 25.72 O ATOM 305 CB VAL A 639 16.828 -0.930 39.803 1.00 26.05 C ATOM 306 CG1 VAL A 639 16.971 0.292 40.720 1.00 25.69 C ATOM 307 CG2 VAL A 639 17.274 -2.228 40.503 1.00 25.97 C ATOM 308 H VAL A 639 14.176 -2.308 40.515 1.00 0.00 H ATOM 309 N VAL A 640 16.222 -2.005 37.185 1.00 22.26 N ATOM 310 CA VAL A 640 16.485 -3.001 36.187 1.00 23.15 C ATOM 311 C VAL A 640 17.974 -3.369 36.355 1.00 24.48 C ATOM 312 O VAL A 640 18.787 -2.507 36.667 1.00 24.73 O ATOM 313 CB VAL A 640 16.085 -2.431 34.805 1.00 29.13 C ATOM 314 CG1 VAL A 640 16.881 -3.036 33.688 1.00 30.67 C ATOM 315 CG2 VAL A 640 14.585 -2.615 34.580 1.00 29.05 C ATOM 316 H VAL A 640 16.752 -1.112 37.137 1.00 0.00 H ATOM 317 N LEU A 641 18.296 -4.652 36.230 1.00 22.47 N ATOM 318 CA LEU A 641 19.657 -5.160 36.324 1.00 22.55 C ATOM 319 C LEU A 641 20.040 -5.702 34.956 1.00 23.74 C ATOM 320 O LEU A 641 19.371 -6.599 34.433 1.00 22.47 O ATOM 321 CB LEU A 641 19.734 -6.276 37.383 1.00 23.23 C ATOM 322 CG LEU A 641 19.199 -5.921 38.797 1.00 27.46 C ATOM 323 CD1 LEU A 641 19.329 -7.134 39.720 1.00 28.09 C ATOM 324 CD2 LEU A 641 19.970 -4.751 39.429 1.00 24.82 C ATOM 325 H LEU A 641 17.530 -5.334 36.055 1.00 0.00 H ATOM 326 N LYS A 642 21.080 -5.127 34.347 1.00 20.86 N ATOM 327 CA LYS A 642 21.513 -5.583 33.020 1.00 20.42 C ATOM 328 C LYS A 642 22.772 -6.359 33.262 1.00 24.00 C ATOM 329 O LYS A 642 23.828 -5.776 33.517 1.00 22.33 O ATOM 330 CB LYS A 642 21.725 -4.405 32.067 1.00 22.31 C ATOM 331 CG LYS A 642 20.494 -3.521 32.018 1.00 30.56 C ATOM 332 CD LYS A 642 20.512 -2.564 30.861 1.00 30.92 C ATOM 333 CE LYS A 642 19.127 -1.945 30.751 1.00 31.21 C ATOM 334 NZ LYS A 642 19.012 -1.084 29.542 1.00 30.16 N ATOM 335 HZ1 LYS A 642 19.713 -0.318 29.595 1.00 0.00 H ATOM 336 HZ2 LYS A 642 19.187 -1.657 28.692 1.00 0.00 H ATOM 337 HZ3 LYS A 642 18.056 -0.678 29.497 1.00 0.00 H ATOM 338 H LYS A 642 21.587 -4.350 34.816 1.00 0.00 H ATOM 339 N VAL A 643 22.640 -7.680 33.203 1.00 20.37 N ATOM 340 CA VAL A 643 23.714 -8.610 33.544 1.00 20.49 C ATOM 341 C VAL A 643 24.487 -9.009 32.311 1.00 23.55 C ATOM 342 O VAL A 643 23.978 -9.723 31.452 1.00 20.96 O ATOM 343 CB VAL A 643 23.170 -9.848 34.314 1.00 23.54 C ATOM 344 CG1 VAL A 643 24.329 -10.759 34.770 1.00 23.00 C ATOM 345 CG2 VAL A 643 22.300 -9.416 35.491 1.00 23.35 C ATOM 346 H VAL A 643 21.726 -8.072 32.899 1.00 0.00 H ATOM 347 N LEU A 644 25.732 -8.550 32.230 1.00 21.26 N ATOM 348 CA LEU A 644 26.566 -8.893 31.090 1.00 21.26 C ATOM 349 C LEU A 644 27.003 -10.340 31.247 1.00 27.29 C ATOM 350 O LEU A 644 27.330 -10.761 32.365 1.00 27.10 O ATOM 351 CB LEU A 644 27.804 -7.949 31.065 1.00 20.60 C ATOM 352 CG LEU A 644 28.757 -8.100 29.902 1.00 23.63 C ATOM 353 CD1 LEU A 644 28.118 -7.614 28.610 1.00 22.64 C ATOM 354 CD2 LEU A 644 30.062 -7.328 30.156 1.00 24.93 C ATOM 355 H LEU A 644 26.111 -7.943 32.985 1.00 0.00 H ATOM 356 N ASP A 645 26.983 -11.099 30.143 1.00 24.79 N ATOM 357 CA ASP A 645 27.479 -12.483 30.114 1.00 26.15 C ATOM 358 C ASP A 645 28.959 -12.491 30.578 1.00 30.35 C ATOM 359 O ASP A 645 29.633 -11.466 30.385 1.00 27.05 O ATOM 360 CB ASP A 645 27.513 -12.959 28.647 1.00 27.93 C ATOM 361 CG ASP A 645 26.179 -13.172 27.952 1.00 44.27 C ATOM 362 OD1 ASP A 645 25.150 -13.254 28.655 1.00 44.50 O ATOM 363 OD2 ASP A 645 26.172 -13.291 26.697 1.00 50.92 O ATOM 364 H ASP A 645 26.599 -10.691 29.267 1.00 0.00 H ATOM 365 N PRO A 646 29.524 -13.636 31.070 1.00 30.16 N ATOM 366 CA PRO A 646 30.986 -13.675 31.310 1.00 30.42 C ATOM 367 C PRO A 646 31.623 -13.282 29.972 1.00 30.54 C ATOM 368 O PRO A 646 31.228 -13.788 28.919 1.00 29.51 O ATOM 369 CB PRO A 646 31.254 -15.146 31.665 1.00 32.67 C ATOM 370 CG PRO A 646 29.935 -15.668 32.135 1.00 37.11 C ATOM 371 CD PRO A 646 28.896 -14.954 31.333 1.00 32.10 C ATOM 372 N SER A 647 32.450 -12.252 29.993 1.00 26.00 N ATOM 373 CA SER A 647 32.982 -11.656 28.779 1.00 25.77 C ATOM 374 C SER A 647 34.428 -11.326 28.863 1.00 27.88 C ATOM 375 O SER A 647 34.965 -11.146 29.959 1.00 28.97 O ATOM 376 CB SER A 647 32.251 -10.337 28.510 1.00 29.09 C ATOM 377 OG SER A 647 30.854 -10.511 28.351 1.00 32.02 O ATOM 378 HG SER A 647 30.476 -10.906 29.176 1.00 0.00 H ATOM 379 H SER A 647 32.731 -11.853 30.912 1.00 0.00 H ATOM 380 N HIS A 648 35.029 -11.133 27.675 1.00 22.72 N ATOM 381 CA HIS A 648 36.394 -10.663 27.453 1.00 23.33 C ATOM 382 C HIS A 648 36.499 -9.258 28.092 1.00 24.20 C ATOM 383 O HIS A 648 35.490 -8.511 28.170 1.00 19.93 O ATOM 384 CB HIS A 648 36.635 -10.562 25.931 1.00 24.93 C ATOM 385 CG HIS A 648 38.049 -10.281 25.498 1.00 30.05 C ATOM 386 ND1 HIS A 648 38.603 -8.999 25.589 1.00 31.94 N ATOM 387 CD2 HIS A 648 38.937 -11.091 24.861 1.00 32.70 C ATOM 388 CE1 HIS A 648 39.811 -9.086 25.061 1.00 31.87 C ATOM 389 NE2 HIS A 648 40.064 -10.325 24.610 1.00 32.65 N ATOM 390 H HIS A 648 34.463 -11.340 26.827 1.00 0.00 H ATOM 391 N HIS A 649 37.709 -8.905 28.556 1.00 19.63 N ATOM 392 CA HIS A 649 37.931 -7.582 29.153 1.00 19.43 C ATOM 393 C HIS A 649 37.568 -6.410 28.224 1.00 24.12 C ATOM 394 O HIS A 649 37.069 -5.400 28.728 1.00 24.35 O ATOM 395 CB HIS A 649 39.342 -7.443 29.679 1.00 18.97 C ATOM 396 CG HIS A 649 39.599 -8.290 30.892 1.00 22.24 C ATOM 397 ND1 HIS A 649 38.948 -8.061 32.097 1.00 23.65 N ATOM 398 CD2 HIS A 649 40.424 -9.355 31.032 1.00 24.24 C ATOM 399 CE1 HIS A 649 39.395 -8.994 32.926 1.00 23.90 C ATOM 400 NE2 HIS A 649 40.325 -9.760 32.339 1.00 24.24 N ATOM 401 H HIS A 649 38.499 -9.578 28.492 1.00 0.00 H ATOM 402 N ASP A 650 37.746 -6.552 26.895 1.00 20.32 N ATOM 403 CA ASP A 650 37.349 -5.505 25.930 1.00 21.45 C ATOM 404 C ASP A 650 35.855 -5.226 25.958 1.00 21.94 C ATOM 405 O ASP A 650 35.445 -4.084 25.832 1.00 19.73 O ATOM 406 CB ASP A 650 37.750 -5.880 24.490 1.00 25.40 C ATOM 407 CG ASP A 650 39.122 -5.407 24.102 1.00 44.00 C ATOM 408 OD1 ASP A 650 39.631 -4.462 24.747 1.00 42.77 O ATOM 409 OD2 ASP A 650 39.672 -5.937 23.105 1.00 56.71 O ATOM 410 H ASP A 650 38.177 -7.428 26.537 1.00 0.00 H ATOM 411 N ILE A 651 35.043 -6.273 26.167 1.00 18.83 N ATOM 412 CA ILE A 651 33.589 -6.162 26.253 1.00 16.90 C ATOM 413 C ILE A 651 33.199 -5.494 27.566 1.00 20.73 C ATOM 414 O ILE A 651 32.376 -4.565 27.574 1.00 20.03 O ATOM 415 CB ILE A 651 32.957 -7.561 26.058 1.00 19.81 C ATOM 416 CG1 ILE A 651 33.351 -8.196 24.653 1.00 21.65 C ATOM 417 CG2 ILE A 651 31.427 -7.557 26.309 1.00 19.27 C ATOM 418 CD1 ILE A 651 32.733 -7.538 23.439 1.00 30.76 C ATOM 419 H ILE A 651 35.472 -7.215 26.274 1.00 0.00 H ATOM 420 N ALA A 652 33.783 -5.946 28.691 1.00 18.62 N ATOM 421 CA ALA A 652 33.493 -5.329 29.999 1.00 18.51 C ATOM 422 C ALA A 652 33.887 -3.856 29.955 1.00 21.76 C ATOM 423 O ALA A 652 33.109 -3.024 30.412 1.00 22.66 O ATOM 424 CB ALA A 652 34.243 -6.057 31.107 1.00 20.07 C ATOM 425 H ALA A 652 34.449 -6.743 28.637 1.00 0.00 H ATOM 426 N LEU A 653 35.037 -3.506 29.326 1.00 18.31 N ATOM 427 CA LEU A 653 35.427 -2.092 29.209 1.00 19.79 C ATOM 428 C LEU A 653 34.404 -1.253 28.406 1.00 23.28 C ATOM 429 O LEU A 653 34.092 -0.129 28.779 1.00 20.96 O ATOM 430 CB LEU A 653 36.802 -1.957 28.552 1.00 20.94 C ATOM 431 CG LEU A 653 37.969 -1.893 29.489 1.00 28.27 C ATOM 432 CD1 LEU A 653 39.266 -2.088 28.737 1.00 29.72 C ATOM 433 CD2 LEU A 653 37.925 -0.615 30.388 1.00 29.47 C ATOM 434 H LEU A 653 35.649 -4.244 28.923 1.00 0.00 H ATOM 435 N ALA A 654 33.874 -1.817 27.323 1.00 20.98 N ATOM 436 CA ALA A 654 32.867 -1.145 26.503 1.00 21.10 C ATOM 437 C ALA A 654 31.555 -0.987 27.288 1.00 25.20 C ATOM 438 O ALA A 654 30.836 -0.006 27.097 1.00 25.05 O ATOM 439 CB ALA A 654 32.638 -1.941 25.231 1.00 21.45 C ATOM 440 H ALA A 654 34.188 -2.770 27.050 1.00 0.00 H ATOM 441 N PHE A 655 31.267 -1.937 28.208 1.00 20.28 N ATOM 442 CA PHE A 655 30.093 -1.893 29.076 1.00 19.95 C ATOM 443 C PHE A 655 30.320 -0.797 30.120 1.00 23.63 C ATOM 444 O PHE A 655 29.425 0.035 30.346 1.00 21.90 O ATOM 445 CB PHE A 655 29.896 -3.268 29.738 1.00 21.51 C ATOM 446 CG PHE A 655 28.560 -3.550 30.385 1.00 23.68 C ATOM 447 CD1 PHE A 655 27.407 -3.680 29.614 1.00 27.57 C ATOM 448 CD2 PHE A 655 28.472 -3.792 31.746 1.00 25.48 C ATOM 449 CE1 PHE A 655 26.181 -4.013 30.205 1.00 28.66 C ATOM 450 CE2 PHE A 655 27.245 -4.116 32.338 1.00 28.65 C ATOM 451 CZ PHE A 655 26.114 -4.244 31.563 1.00 26.66 C ATOM 452 H PHE A 655 31.918 -2.743 28.302 1.00 0.00 H ATOM 453 N TYR A 656 31.543 -0.743 30.713 1.00 19.84 N ATOM 454 CA TYR A 656 31.876 0.316 31.691 1.00 20.45 C ATOM 455 C TYR A 656 31.839 1.694 31.050 1.00 23.67 C ATOM 456 O TYR A 656 31.381 2.617 31.705 1.00 24.36 O ATOM 457 CB TYR A 656 33.266 0.134 32.325 1.00 20.56 C ATOM 458 CG TYR A 656 33.517 -1.186 33.012 1.00 20.92 C ATOM 459 CD1 TYR A 656 32.497 -1.849 33.695 1.00 22.73 C ATOM 460 CD2 TYR A 656 34.802 -1.715 33.086 1.00 20.93 C ATOM 461 CE1 TYR A 656 32.734 -3.056 34.348 1.00 19.97 C ATOM 462 CE2 TYR A 656 35.047 -2.922 33.724 1.00 21.85 C ATOM 463 CZ TYR A 656 34.019 -3.572 34.381 1.00 24.92 C ATOM 464 OH TYR A 656 34.274 -4.761 35.010 1.00 24.61 O ATOM 465 HH TYR A 656 33.442 -5.096 35.430 1.00 0.00 H ATOM 466 H TYR A 656 32.258 -1.460 30.474 1.00 0.00 H ATOM 467 N GLU A 657 32.296 1.832 29.774 1.00 19.67 N ATOM 468 CA GLU A 657 32.265 3.118 29.066 1.00 20.78 C ATOM 469 C GLU A 657 30.806 3.616 28.933 1.00 24.48 C ATOM 470 O GLU A 657 30.549 4.809 29.109 1.00 20.86 O ATOM 471 CB GLU A 657 32.916 3.000 27.680 1.00 22.98 C ATOM 472 H GLU A 657 32.680 0.998 29.285 1.00 0.00 H ATOM 473 N THR A 658 29.856 2.694 28.650 1.00 21.22 N ATOM 474 CA THR A 658 28.416 3.023 28.574 1.00 20.75 C ATOM 475 C THR A 658 27.910 3.500 29.938 1.00 23.98 C ATOM 476 O THR A 658 27.216 4.516 30.018 1.00 23.16 O ATOM 477 CB THR A 658 27.626 1.832 28.032 1.00 24.61 C ATOM 478 OG1 THR A 658 27.951 1.689 26.651 1.00 25.63 O ATOM 479 CG2 THR A 658 26.114 2.007 28.193 1.00 25.36 C ATOM 480 HG1 THR A 658 27.452 0.922 26.273 1.00 0.00 H ATOM 481 H THR A 658 30.152 1.712 28.479 1.00 0.00 H ATOM 482 N ALA A 659 28.254 2.779 31.012 1.00 22.40 N ATOM 483 CA ALA A 659 27.831 3.195 32.342 1.00 23.98 C ATOM 484 C ALA A 659 28.385 4.585 32.667 1.00 28.44 C ATOM 485 O ALA A 659 27.656 5.426 33.195 1.00 27.65 O ATOM 486 CB ALA A 659 28.287 2.187 33.375 1.00 25.01 C ATOM 487 H ALA A 659 28.826 1.918 30.896 1.00 0.00 H ATOM 488 N SER A 660 29.656 4.843 32.294 1.00 26.99 N ATOM 489 CA SER A 660 30.331 6.133 32.510 1.00 27.04 C ATOM 490 C SER A 660 29.637 7.266 31.740 1.00 29.00 C ATOM 491 O SER A 660 29.313 8.305 32.321 1.00 29.14 O ATOM 492 CB SER A 660 31.817 6.016 32.155 1.00 29.49 C ATOM 493 OG SER A 660 32.471 7.251 32.378 1.00 40.25 O ATOM 494 HG SER A 660 33.429 7.162 32.145 1.00 0.00 H ATOM 495 H SER A 660 30.191 4.084 31.825 1.00 0.00 H ATOM 496 N LEU A 661 29.343 7.033 30.458 1.00 25.80 N ATOM 497 CA LEU A 661 28.626 7.979 29.593 1.00 27.15 C ATOM 498 C LEU A 661 27.232 8.340 30.162 1.00 28.90 C ATOM 499 O LEU A 661 26.885 9.518 30.261 1.00 27.47 O ATOM 500 CB LEU A 661 28.476 7.356 28.188 1.00 29.02 C ATOM 501 CG LEU A 661 27.484 7.997 27.203 1.00 36.66 C ATOM 502 CD1 LEU A 661 27.997 9.286 26.688 1.00 37.49 C ATOM 503 CD2 LEU A 661 27.235 7.082 26.017 1.00 42.45 C ATOM 504 H LEU A 661 29.640 6.125 30.047 1.00 0.00 H ATOM 505 N MET A 662 26.450 7.322 30.538 1.00 25.35 N ATOM 506 CA MET A 662 25.096 7.545 31.045 1.00 27.11 C ATOM 507 C MET A 662 25.041 8.142 32.461 1.00 32.55 C ATOM 508 O MET A 662 24.033 8.757 32.813 1.00 33.04 O ATOM 509 CB MET A 662 24.246 6.276 30.938 1.00 29.33 C ATOM 510 CG MET A 662 24.108 5.764 29.509 1.00 32.62 C ATOM 511 SD MET A 662 23.111 6.791 28.450 1.00 36.95 S ATOM 512 CE MET A 662 24.226 8.065 27.969 1.00 35.95 C ATOM 513 H MET A 662 26.813 6.350 30.468 1.00 0.00 H ATOM 514 N SER A 663 26.116 7.986 33.242 1.00 30.35 N ATOM 515 CA SER A 663 26.212 8.550 34.592 1.00 31.38 C ATOM 516 C SER A 663 26.627 10.044 34.550 1.00 37.56 C ATOM 517 O SER A 663 26.378 10.779 35.505 1.00 38.05 O ATOM 518 CB SER A 663 27.209 7.752 35.426 1.00 33.92 C ATOM 519 OG SER A 663 26.778 6.403 35.545 1.00 38.86 O ATOM 520 HG SER A 663 26.711 5.999 34.644 1.00 0.00 H ATOM 521 H SER A 663 26.921 7.439 32.875 1.00 0.00 H ATOM 522 N GLN A 664 27.237 10.488 33.451 1.00 33.70 N ATOM 523 CA GLN A 664 27.701 11.872 33.300 1.00 33.73 C ATOM 524 C GLN A 664 26.684 12.777 32.581 1.00 37.57 C ATOM 525 O GLN A 664 26.915 13.982 32.424 1.00 38.23 O ATOM 526 CB GLN A 664 29.042 11.888 32.551 1.00 35.79 C ATOM 527 H GLN A 664 27.391 9.824 32.666 1.00 0.00 H ATOM 528 N VAL A 665 25.576 12.205 32.119 1.00 30.70 N ATOM 529 CA VAL A 665 24.571 12.994 31.404 1.00 29.76 C ATOM 530 C VAL A 665 23.314 13.058 32.237 1.00 30.94 C ATOM 531 O VAL A 665 23.108 12.202 33.096 1.00 29.36 O ATOM 532 CB VAL A 665 24.281 12.435 29.980 1.00 33.74 C ATOM 533 CG1 VAL A 665 25.508 12.538 29.084 1.00 33.63 C ATOM 534 CG2 VAL A 665 23.764 11.004 30.049 1.00 33.35 C ATOM 535 H VAL A 665 25.422 11.187 32.267 1.00 0.00 H ATOM 536 N SER A 666 22.467 14.058 31.971 1.00 27.49 N ATOM 537 CA SER A 666 21.187 14.210 32.663 1.00 28.48 C ATOM 538 C SER A 666 20.218 14.893 31.704 1.00 29.31 C ATOM 539 O SER A 666 20.491 15.986 31.200 1.00 27.72 O ATOM 540 CB SER A 666 21.348 15.038 33.937 1.00 35.58 C ATOM 541 OG SER A 666 20.163 14.905 34.705 1.00 48.48 O ATOM 542 HG SER A 666 20.249 15.436 35.536 1.00 0.00 H ATOM 543 H SER A 666 22.728 14.755 31.244 1.00 0.00 H ATOM 544 N HIS A 667 19.109 14.218 31.395 1.00 24.28 N ATOM 545 CA HIS A 667 18.121 14.755 30.461 1.00 22.22 C ATOM 546 C HIS A 667 16.802 14.072 30.740 1.00 25.83 C ATOM 547 O HIS A 667 16.758 12.872 31.041 1.00 24.30 O ATOM 548 CB HIS A 667 18.548 14.527 28.994 1.00 22.61 C ATOM 549 CG HIS A 667 17.709 15.254 27.984 1.00 26.02 C ATOM 550 ND1 HIS A 667 16.510 14.728 27.530 1.00 27.67 N ATOM 551 CD2 HIS A 667 17.926 16.442 27.372 1.00 27.77 C ATOM 552 CE1 HIS A 667 16.039 15.606 26.656 1.00 27.62 C ATOM 553 NE2 HIS A 667 16.863 16.651 26.516 1.00 27.74 N ATOM 554 H HIS A 667 18.944 13.288 31.829 1.00 0.00 H ATOM 555 N THR A 668 15.722 14.857 30.643 1.00 22.06 N ATOM 556 CA THR A 668 14.327 14.432 30.836 1.00 22.70 C ATOM 557 C THR A 668 14.030 13.118 30.098 1.00 24.33 C ATOM 558 O THR A 668 13.286 12.279 30.614 1.00 23.60 O ATOM 559 CB THR A 668 13.402 15.550 30.314 1.00 27.90 C ATOM 560 OG1 THR A 668 13.712 16.757 31.025 1.00 27.90 O ATOM 561 CG2 THR A 668 11.907 15.218 30.469 1.00 28.93 C ATOM 562 HG1 THR A 668 13.563 16.616 31.993 1.00 0.00 H ATOM 563 H THR A 668 15.884 15.858 30.410 1.00 0.00 H ATOM 564 N HIS A 669 14.596 12.954 28.889 1.00 19.56 N ATOM 565 CA HIS A 669 14.268 11.799 28.046 1.00 18.20 C ATOM 566 C HIS A 669 15.414 10.779 27.932 1.00 20.61 C ATOM 567 O HIS A 669 15.479 10.049 26.958 1.00 18.53 O ATOM 568 CB HIS A 669 13.750 12.290 26.677 1.00 17.80 C ATOM 569 CG HIS A 669 12.431 13.028 26.808 1.00 20.56 C ATOM 570 ND1 HIS A 669 11.310 12.415 27.344 1.00 21.97 N ATOM 571 CD2 HIS A 669 12.135 14.330 26.562 1.00 22.12 C ATOM 572 CE1 HIS A 669 10.366 13.350 27.385 1.00 21.71 C ATOM 573 NE2 HIS A 669 10.814 14.519 26.932 1.00 21.56 N ATOM 574 H HIS A 669 15.279 13.659 28.545 1.00 0.00 H ATOM 575 N LEU A 670 16.342 10.772 28.910 1.00 18.25 N ATOM 576 CA LEU A 670 17.434 9.789 28.980 1.00 18.31 C ATOM 577 C LEU A 670 17.251 8.972 30.253 1.00 21.74 C ATOM 578 O LEU A 670 17.049 9.561 31.329 1.00 20.76 O ATOM 579 CB LEU A 670 18.841 10.447 28.972 1.00 18.93 C ATOM 580 CG LEU A 670 19.317 11.069 27.644 1.00 23.76 C ATOM 581 CD1 LEU A 670 20.710 11.695 27.831 1.00 24.98 C ATOM 582 CD2 LEU A 670 19.391 10.032 26.539 1.00 24.08 C ATOM 583 H LEU A 670 16.283 11.498 29.652 1.00 0.00 H ATOM 584 N ALA A 671 17.322 7.633 30.161 1.00 18.99 N ATOM 585 CA ALA A 671 17.174 6.780 31.362 1.00 20.18 C ATOM 586 C ALA A 671 18.340 6.983 32.321 1.00 24.65 C ATOM 587 O ALA A 671 19.490 7.189 31.880 1.00 23.37 O ATOM 588 CB ALA A 671 17.080 5.298 30.977 1.00 21.89 C ATOM 589 H ALA A 671 17.483 7.190 29.234 1.00 0.00 H ATOM 590 N PHE A 672 18.043 6.921 33.629 1.00 20.91 N ATOM 591 CA PHE A 672 19.045 7.089 34.689 1.00 22.40 C ATOM 592 C PHE A 672 19.867 5.805 34.935 1.00 26.43 C ATOM 593 O PHE A 672 19.319 4.703 34.900 1.00 25.22 O ATOM 594 CB PHE A 672 18.323 7.465 36.006 1.00 24.54 C ATOM 595 CG PHE A 672 19.241 7.881 37.135 1.00 27.17 C ATOM 596 CD1 PHE A 672 19.827 9.147 37.146 1.00 31.39 C ATOM 597 CD2 PHE A 672 19.502 7.019 38.198 1.00 29.13 C ATOM 598 CE1 PHE A 672 20.672 9.538 38.194 1.00 33.06 C ATOM 599 CE2 PHE A 672 20.338 7.423 39.258 1.00 33.17 C ATOM 600 CZ PHE A 672 20.913 8.676 39.244 1.00 32.15 C ATOM 601 H PHE A 672 17.056 6.746 33.905 1.00 0.00 H ATOM 602 N VAL A 673 21.161 5.956 35.227 1.00 23.87 N ATOM 603 CA VAL A 673 22.005 4.803 35.581 1.00 23.75 C ATOM 604 C VAL A 673 22.346 4.951 37.075 1.00 27.78 C ATOM 605 O VAL A 673 22.909 5.973 37.456 1.00 29.69 O ATOM 606 CB VAL A 673 23.264 4.680 34.672 1.00 27.96 C ATOM 607 CG1 VAL A 673 24.252 3.635 35.213 1.00 27.29 C ATOM 608 CG2 VAL A 673 22.834 4.307 33.260 1.00 28.83 C ATOM 609 H VAL A 673 21.581 6.907 35.204 1.00 0.00 H ATOM 610 N HIS A 674 21.958 3.981 37.907 1.00 24.86 N ATOM 611 CA HIS A 674 22.258 3.997 39.357 1.00 26.26 C ATOM 612 C HIS A 674 23.719 3.642 39.627 1.00 30.90 C ATOM 613 O HIS A 674 24.316 4.124 40.594 1.00 30.66 O ATOM 614 CB HIS A 674 21.354 3.020 40.115 1.00 27.31 C ATOM 615 CG HIS A 674 19.911 3.360 39.978 1.00 31.30 C ATOM 616 ND1 HIS A 674 19.339 4.369 40.728 1.00 34.39 N ATOM 617 CD2 HIS A 674 18.979 2.849 39.143 1.00 33.55 C ATOM 618 CE1 HIS A 674 18.064 4.413 40.361 1.00 33.73 C ATOM 619 NE2 HIS A 674 17.804 3.526 39.398 1.00 33.77 N ATOM 620 H HIS A 674 21.421 3.179 37.519 1.00 0.00 H ATOM 621 N GLY A 675 24.271 2.768 38.787 1.00 27.35 N ATOM 622 CA GLY A 675 25.667 2.373 38.937 1.00 26.42 C ATOM 623 C GLY A 675 25.972 1.009 38.371 1.00 27.40 C ATOM 624 O GLY A 675 25.170 0.440 37.623 1.00 23.86 O ATOM 625 H GLY A 675 23.701 2.363 38.017 1.00 0.00 H ATOM 626 N VAL A 676 27.159 0.494 38.725 1.00 24.80 N ATOM 627 CA VAL A 676 27.691 -0.792 38.255 1.00 24.62 C ATOM 628 C VAL A 676 28.061 -1.672 39.435 1.00 28.63 C ATOM 629 O VAL A 676 28.713 -1.227 40.383 1.00 28.15 O ATOM 630 CB VAL A 676 28.898 -0.596 37.283 1.00 28.80 C ATOM 631 CG1 VAL A 676 29.554 -1.926 36.887 1.00 28.87 C ATOM 632 CG2 VAL A 676 28.478 0.168 36.030 1.00 29.07 C ATOM 633 H VAL A 676 27.747 1.047 39.381 1.00 0.00 H ATOM 634 N CYS A 677 27.656 -2.930 39.355 1.00 25.47 N ATOM 635 CA CYS A 677 27.990 -3.939 40.337 1.00 26.00 C ATOM 636 C CYS A 677 28.820 -5.039 39.647 1.00 29.15 C ATOM 637 O CYS A 677 28.446 -5.507 38.572 1.00 26.22 O ATOM 638 CB CYS A 677 26.726 -4.517 40.963 1.00 27.39 C ATOM 639 SG CYS A 677 27.033 -5.927 42.071 1.00 32.65 S ATOM 640 H CYS A 677 27.067 -3.207 38.544 1.00 0.00 H ATOM 641 N VAL A 678 29.914 -5.454 40.265 1.00 26.26 N ATOM 642 CA VAL A 678 30.689 -6.598 39.769 1.00 27.00 C ATOM 643 C VAL A 678 30.388 -7.787 40.682 1.00 32.60 C ATOM 644 O VAL A 678 30.697 -7.723 41.870 1.00 33.70 O ATOM 645 CB VAL A 678 32.197 -6.330 39.620 1.00 29.58 C ATOM 646 CG1 VAL A 678 32.899 -7.551 39.025 1.00 28.75 C ATOM 647 CG2 VAL A 678 32.436 -5.099 38.749 1.00 28.68 C ATOM 648 H VAL A 678 30.232 -4.958 41.122 1.00 0.00 H ATOM 649 N ARG A 679 29.758 -8.851 40.135 1.00 28.57 N ATOM 650 CA ARG A 679 29.346 -10.033 40.895 1.00 28.54 C ATOM 651 C ARG A 679 29.999 -11.253 40.267 1.00 31.83 C ATOM 652 O ARG A 679 29.480 -11.805 39.288 1.00 29.71 O ATOM 653 CB ARG A 679 27.803 -10.124 40.862 1.00 31.69 C ATOM 654 CG ARG A 679 27.209 -11.241 41.729 1.00 36.64 C ATOM 655 CD ARG A 679 25.686 -11.243 41.690 1.00 42.84 C ATOM 656 NE ARG A 679 25.157 -11.684 40.398 1.00 46.84 N ATOM 657 CZ ARG A 679 23.899 -11.518 40.001 1.00 54.16 C ATOM 658 NH1 ARG A 679 23.510 -11.959 38.814 1.00 35.44 N ATOM 659 NH2 ARG A 679 23.031 -10.874 40.770 1.00 33.95 N ATOM 660 HE ARG A 679 25.811 -12.161 39.745 1.00 0.00 H ATOM 661 HH12 ARG A 679 22.525 -11.827 38.507 1.00 0.00 H ATOM 662 HH11 ARG A 679 24.190 -12.437 38.189 1.00 0.00 H ATOM 663 HH22 ARG A 679 22.049 -10.748 40.453 1.00 0.00 H ATOM 664 HH21 ARG A 679 23.333 -10.495 41.690 1.00 0.00 H ATOM 665 H ARG A 679 29.554 -8.829 39.115 1.00 0.00 H ATOM 666 N GLY A 680 31.182 -11.610 40.779 1.00 31.30 N ATOM 667 CA GLY A 680 32.004 -12.687 40.233 1.00 30.68 C ATOM 668 C GLY A 680 32.381 -12.367 38.795 1.00 33.98 C ATOM 669 O GLY A 680 32.834 -11.256 38.519 1.00 35.31 O ATOM 670 H GLY A 680 31.535 -11.094 41.610 1.00 0.00 H ATOM 671 N PRO A 681 32.070 -13.252 37.822 1.00 30.52 N ATOM 672 CA PRO A 681 32.396 -12.942 36.416 1.00 29.77 C ATOM 673 C PRO A 681 31.346 -12.054 35.733 1.00 33.57 C ATOM 674 O PRO A 681 31.503 -11.710 34.564 1.00 34.22 O ATOM 675 CB PRO A 681 32.425 -14.328 35.767 1.00 31.17 C ATOM 676 CG PRO A 681 31.414 -15.093 36.517 1.00 35.53 C ATOM 677 CD PRO A 681 31.478 -14.601 37.945 1.00 31.18 C ATOM 678 N GLU A 682 30.277 -11.700 36.452 1.00 28.86 N ATOM 679 CA GLU A 682 29.182 -10.898 35.929 1.00 28.46 C ATOM 680 C GLU A 682 29.300 -9.397 36.217 1.00 31.03 C ATOM 681 O GLU A 682 29.411 -8.987 37.366 1.00 30.94 O ATOM 682 CB GLU A 682 27.845 -11.422 36.474 1.00 30.03 C ATOM 683 CG GLU A 682 27.472 -12.785 35.935 1.00 41.65 C ATOM 684 CD GLU A 682 26.155 -13.339 36.432 1.00 57.05 C ATOM 685 OE1 GLU A 682 25.448 -13.989 35.630 1.00 50.69 O ATOM 686 OE2 GLU A 682 25.815 -13.095 37.610 1.00 45.82 O ATOM 687 H GLU A 682 30.225 -12.016 37.442 1.00 0.00 H ATOM 688 N ASN A 683 29.230 -8.580 35.162 1.00 25.91 N ATOM 689 CA ASN A 683 29.194 -7.128 35.278 1.00 24.39 C ATOM 690 C ASN A 683 27.720 -6.730 35.179 1.00 27.22 C ATOM 691 O ASN A 683 27.036 -7.129 34.236 1.00 26.66 O ATOM 692 CB ASN A 683 30.025 -6.474 34.194 1.00 19.45 C ATOM 693 CG ASN A 683 31.494 -6.675 34.446 1.00 27.76 C ATOM 694 OD1 ASN A 683 32.043 -6.107 35.391 1.00 22.53 O ATOM 695 ND2 ASN A 683 32.118 -7.593 33.712 1.00 22.11 N ATOM 696 HD22 ASN A 683 31.622 -8.052 32.921 1.00 0.00 H ATOM 697 HD21 ASN A 683 33.102 -7.852 33.929 1.00 0.00 H ATOM 698 H ASN A 683 29.200 -9.001 34.212 1.00 0.00 H ATOM 699 N ILE A 684 27.228 -5.979 36.160 1.00 23.01 N ATOM 700 CA ILE A 684 25.803 -5.590 36.215 1.00 22.86 C ATOM 701 C ILE A 684 25.610 -4.099 36.139 1.00 28.62 C ATOM 702 O ILE A 684 26.119 -3.386 36.998 1.00 30.57 O ATOM 703 CB ILE A 684 25.104 -6.175 37.475 1.00 24.24 C ATOM 704 CG1 ILE A 684 25.384 -7.707 37.622 1.00 24.17 C ATOM 705 CG2 ILE A 684 23.581 -5.833 37.476 1.00 24.71 C ATOM 706 CD1 ILE A 684 24.990 -8.337 38.969 1.00 23.36 C ATOM 707 H ILE A 684 27.867 -5.655 36.914 1.00 0.00 H ATOM 708 N MET A 685 24.833 -3.622 35.163 1.00 23.83 N ATOM 709 CA MET A 685 24.534 -2.192 35.130 1.00 24.03 C ATOM 710 C MET A 685 23.163 -2.049 35.772 1.00 26.03 C ATOM 711 O MET A 685 22.240 -2.764 35.388 1.00 24.27 O ATOM 712 CB MET A 685 24.577 -1.632 33.705 1.00 26.99 C ATOM 713 CG MET A 685 24.810 -0.112 33.667 1.00 31.72 C ATOM 714 SD MET A 685 24.697 0.574 31.993 1.00 36.47 S ATOM 715 CE MET A 685 25.971 -0.384 31.173 1.00 31.41 C ATOM 716 H MET A 685 24.447 -4.259 34.437 1.00 0.00 H ATOM 717 N VAL A 686 23.064 -1.208 36.811 1.00 22.80 N ATOM 718 CA VAL A 686 21.838 -0.990 37.591 1.00 22.39 C ATOM 719 C VAL A 686 21.204 0.267 37.004 1.00 25.29 C ATOM 720 O VAL A 686 21.788 1.347 37.104 1.00 23.28 O ATOM 721 CB VAL A 686 22.125 -0.862 39.112 1.00 25.69 C ATOM 722 CG1 VAL A 686 20.808 -0.786 39.897 1.00 25.73 C ATOM 723 CG2 VAL A 686 22.988 -2.030 39.606 1.00 25.13 C ATOM 724 H VAL A 686 23.913 -0.673 37.084 1.00 0.00 H ATOM 725 N THR A 687 20.082 0.102 36.288 1.00 20.99 N ATOM 726 CA THR A 687 19.500 1.226 35.568 1.00 21.96 C ATOM 727 C THR A 687 18.035 1.454 35.946 1.00 25.25 C ATOM 728 O THR A 687 17.437 0.656 36.675 1.00 23.33 O ATOM 729 CB THR A 687 19.721 1.071 34.029 1.00 29.02 C ATOM 730 OG1 THR A 687 18.932 -0.003 33.548 1.00 27.80 O ATOM 731 CG2 THR A 687 21.185 0.804 33.643 1.00 28.06 C ATOM 732 HG1 THR A 687 17.977 0.184 33.729 1.00 0.00 H ATOM 733 H THR A 687 19.626 -0.832 36.247 1.00 0.00 H ATOM 734 N GLU A 688 17.467 2.554 35.428 1.00 22.84 N ATOM 735 CA GLU A 688 16.095 2.965 35.722 1.00 22.01 C ATOM 736 C GLU A 688 15.054 1.943 35.266 1.00 24.48 C ATOM 737 O GLU A 688 15.065 1.508 34.105 1.00 22.95 O ATOM 738 CB GLU A 688 15.848 4.323 35.061 1.00 22.83 C ATOM 739 CG GLU A 688 14.521 4.956 35.421 1.00 24.72 C ATOM 740 CD GLU A 688 14.316 6.344 34.858 1.00 31.02 C ATOM 741 OE1 GLU A 688 15.256 6.899 34.250 1.00 26.56 O ATOM 742 OE2 GLU A 688 13.219 6.899 35.066 1.00 28.36 O ATOM 743 H GLU A 688 18.032 3.144 34.784 1.00 0.00 H ATOM 744 N TYR A 689 14.141 1.566 36.170 1.00 21.46 N ATOM 745 CA TYR A 689 13.001 0.730 35.801 1.00 20.53 C ATOM 746 C TYR A 689 11.995 1.718 35.218 1.00 23.43 C ATOM 747 O TYR A 689 11.624 2.683 35.894 1.00 21.88 O ATOM 748 CB TYR A 689 12.401 0.023 37.019 1.00 21.25 C ATOM 749 CG TYR A 689 11.237 -0.896 36.684 1.00 23.28 C ATOM 750 CD1 TYR A 689 9.940 -0.403 36.583 1.00 25.40 C ATOM 751 CD2 TYR A 689 11.436 -2.253 36.468 1.00 25.30 C ATOM 752 CE1 TYR A 689 8.861 -1.247 36.302 1.00 27.00 C ATOM 753 CE2 TYR A 689 10.367 -3.106 36.171 1.00 26.50 C ATOM 754 CZ TYR A 689 9.079 -2.599 36.116 1.00 33.01 C ATOM 755 OH TYR A 689 8.014 -3.429 35.862 1.00 34.22 O ATOM 756 HH TYR A 689 7.178 -2.899 35.860 1.00 0.00 H ATOM 757 H TYR A 689 14.246 1.875 37.157 1.00 0.00 H ATOM 758 N VAL A 690 11.617 1.530 33.953 1.00 20.27 N ATOM 759 CA VAL A 690 10.693 2.446 33.271 1.00 19.58 C ATOM 760 C VAL A 690 9.360 1.696 33.134 1.00 24.67 C ATOM 761 O VAL A 690 9.325 0.596 32.594 1.00 24.47 O ATOM 762 CB VAL A 690 11.264 3.025 31.956 1.00 21.68 C ATOM 763 CG1 VAL A 690 10.297 4.040 31.352 1.00 21.51 C ATOM 764 CG2 VAL A 690 12.620 3.695 32.192 1.00 20.62 C ATOM 765 H VAL A 690 11.988 0.709 33.433 1.00 0.00 H ATOM 766 N GLU A 691 8.281 2.288 33.674 1.00 22.00 N ATOM 767 CA GLU A 691 6.971 1.683 33.884 1.00 21.81 C ATOM 768 C GLU A 691 6.470 0.716 32.809 1.00 26.20 C ATOM 769 O GLU A 691 6.051 -0.383 33.160 1.00 27.18 O ATOM 770 CB GLU A 691 5.894 2.754 34.146 1.00 23.34 C ATOM 771 CG GLU A 691 4.569 2.176 34.635 1.00 31.88 C ATOM 772 CD GLU A 691 4.590 1.476 35.984 1.00 51.12 C ATOM 773 OE1 GLU A 691 5.385 1.880 36.866 1.00 37.24 O ATOM 774 OE2 GLU A 691 3.792 0.529 36.161 1.00 44.49 O ATOM 775 H GLU A 691 8.392 3.278 33.972 1.00 0.00 H ATOM 776 N HIS A 692 6.445 1.121 31.530 1.00 19.98 N ATOM 777 CA HIS A 692 5.809 0.301 30.512 1.00 20.26 C ATOM 778 C HIS A 692 6.752 -0.391 29.542 1.00 23.59 C ATOM 779 O HIS A 692 6.305 -1.010 28.581 1.00 23.38 O ATOM 780 CB HIS A 692 4.757 1.135 29.769 1.00 22.19 C ATOM 781 CG HIS A 692 3.672 1.602 30.686 1.00 27.30 C ATOM 782 ND1 HIS A 692 3.608 2.920 31.118 1.00 30.49 N ATOM 783 CD2 HIS A 692 2.655 0.908 31.246 1.00 29.16 C ATOM 784 CE1 HIS A 692 2.552 2.987 31.914 1.00 29.64 C ATOM 785 NE2 HIS A 692 1.960 1.798 32.039 1.00 30.04 N ATOM 786 H HIS A 692 6.883 2.026 31.266 1.00 0.00 H ATOM 787 N GLY A 693 8.034 -0.364 29.838 1.00 19.94 N ATOM 788 CA GLY A 693 8.976 -1.095 29.011 1.00 20.49 C ATOM 789 C GLY A 693 9.186 -0.580 27.597 1.00 21.85 C ATOM 790 O GLY A 693 8.821 0.553 27.275 1.00 18.64 O ATOM 791 H GLY A 693 8.370 0.178 30.660 1.00 0.00 H ATOM 792 N PRO A 694 9.791 -1.430 26.751 1.00 18.84 N ATOM 793 CA PRO A 694 10.212 -0.984 25.398 1.00 18.28 C ATOM 794 C PRO A 694 9.112 -0.571 24.424 1.00 20.05 C ATOM 795 O PRO A 694 8.071 -1.215 24.337 1.00 16.98 O ATOM 796 CB PRO A 694 11.009 -2.178 24.867 1.00 19.77 C ATOM 797 CG PRO A 694 11.534 -2.845 26.134 1.00 25.06 C ATOM 798 CD PRO A 694 10.330 -2.769 27.052 1.00 20.99 C ATOM 799 N LEU A 695 9.369 0.494 23.664 1.00 16.14 N ATOM 800 CA LEU A 695 8.415 1.021 22.672 1.00 16.06 C ATOM 801 C LEU A 695 8.084 0.021 21.540 1.00 19.94 C ATOM 802 O LEU A 695 6.928 -0.055 21.141 1.00 21.09 O ATOM 803 CB LEU A 695 8.981 2.342 22.091 1.00 16.67 C ATOM 804 CG LEU A 695 8.255 2.968 20.872 1.00 21.02 C ATOM 805 CD1 LEU A 695 6.871 3.486 21.248 1.00 20.79 C ATOM 806 CD2 LEU A 695 9.091 4.101 20.273 1.00 20.60 C ATOM 807 H LEU A 695 10.284 0.975 23.776 1.00 0.00 H ATOM 808 N ASP A 696 9.077 -0.728 21.014 1.00 18.55 N ATOM 809 CA ASP A 696 8.829 -1.646 19.893 1.00 19.22 C ATOM 810 C ASP A 696 7.772 -2.705 20.248 1.00 21.23 C ATOM 811 O ASP A 696 6.863 -2.970 19.456 1.00 19.68 O ATOM 812 CB ASP A 696 10.150 -2.306 19.388 1.00 20.56 C ATOM 813 CG ASP A 696 10.758 -3.326 20.346 1.00 24.86 C ATOM 814 OD1 ASP A 696 10.882 -3.014 21.548 1.00 23.56 O ATOM 815 OD2 ASP A 696 11.087 -4.443 19.894 1.00 27.03 O ATOM 816 H ASP A 696 10.036 -0.654 21.410 1.00 0.00 H ATOM 817 N VAL A 697 7.870 -3.261 21.467 1.00 20.52 N ATOM 818 CA VAL A 697 6.949 -4.286 21.983 1.00 21.14 C ATOM 819 C VAL A 697 5.563 -3.685 22.091 1.00 22.29 C ATOM 820 O VAL A 697 4.591 -4.265 21.602 1.00 19.65 O ATOM 821 CB VAL A 697 7.440 -4.870 23.338 1.00 25.54 C ATOM 822 CG1 VAL A 697 6.383 -5.795 23.963 1.00 25.80 C ATOM 823 CG2 VAL A 697 8.765 -5.609 23.161 1.00 26.03 C ATOM 824 H VAL A 697 8.646 -2.947 22.085 1.00 0.00 H ATOM 825 N TRP A 698 5.475 -2.501 22.713 1.00 21.29 N ATOM 826 CA TRP A 698 4.193 -1.810 22.851 1.00 20.90 C ATOM 827 C TRP A 698 3.556 -1.486 21.480 1.00 21.34 C ATOM 828 O TRP A 698 2.355 -1.703 21.305 1.00 20.36 O ATOM 829 CB TRP A 698 4.377 -0.549 23.678 1.00 20.98 C ATOM 830 CG TRP A 698 3.069 0.058 24.072 1.00 24.03 C ATOM 831 CD1 TRP A 698 2.250 -0.354 25.085 1.00 27.42 C ATOM 832 CD2 TRP A 698 2.369 1.103 23.387 1.00 24.74 C ATOM 833 NE1 TRP A 698 1.106 0.401 25.102 1.00 27.83 N ATOM 834 CE2 TRP A 698 1.158 1.315 24.080 1.00 29.78 C ATOM 835 CE3 TRP A 698 2.654 1.904 22.265 1.00 26.53 C ATOM 836 CZ2 TRP A 698 0.240 2.291 23.691 1.00 30.64 C ATOM 837 CZ3 TRP A 698 1.727 2.851 21.866 1.00 28.68 C ATOM 838 CH2 TRP A 698 0.556 3.063 22.593 1.00 29.78 C ATOM 839 HE1 TRP A 698 0.324 0.298 25.780 1.00 0.00 H ATOM 840 H TRP A 698 6.334 -2.065 23.105 1.00 0.00 H ATOM 841 N LEU A 699 4.345 -0.941 20.523 1.00 18.64 N ATOM 842 CA LEU A 699 3.803 -0.628 19.180 1.00 18.00 C ATOM 843 C LEU A 699 3.208 -1.855 18.477 1.00 20.32 C ATOM 844 O LEU A 699 2.135 -1.746 17.901 1.00 20.18 O ATOM 845 CB LEU A 699 4.838 0.041 18.269 1.00 17.57 C ATOM 846 CG LEU A 699 5.205 1.475 18.584 1.00 21.63 C ATOM 847 CD1 LEU A 699 6.355 1.923 17.722 1.00 24.67 C ATOM 848 CD2 LEU A 699 4.013 2.445 18.426 1.00 21.13 C ATOM 849 H LEU A 699 5.343 -0.740 20.734 1.00 0.00 H ATOM 850 N ARG A 700 3.885 -3.012 18.537 1.00 19.80 N ATOM 851 CA ARG A 700 3.367 -4.242 17.904 1.00 20.32 C ATOM 852 C ARG A 700 2.081 -4.703 18.570 1.00 25.35 C ATOM 853 O ARG A 700 1.174 -5.160 17.884 1.00 25.51 O ATOM 854 CB ARG A 700 4.393 -5.385 17.968 1.00 21.76 C ATOM 855 CG ARG A 700 5.474 -5.266 16.896 1.00 28.45 C ATOM 856 CD ARG A 700 6.476 -6.405 17.088 1.00 35.64 C ATOM 857 NE ARG A 700 7.826 -5.889 16.913 1.00 54.09 N ATOM 858 CZ ARG A 700 8.755 -5.833 17.856 1.00 57.89 C ATOM 859 NH1 ARG A 700 8.526 -6.349 19.057 1.00 39.05 N ATOM 860 NH2 ARG A 700 9.943 -5.323 17.586 1.00 53.47 N ATOM 861 HE ARG A 700 8.083 -5.535 15.969 1.00 0.00 H ATOM 862 HH12 ARG A 700 9.260 -6.301 19.792 1.00 0.00 H ATOM 863 HH11 ARG A 700 7.612 -6.801 19.263 1.00 0.00 H ATOM 864 HH22 ARG A 700 10.671 -5.280 18.327 1.00 0.00 H ATOM 865 HH21 ARG A 700 10.150 -4.965 16.632 1.00 0.00 H ATOM 866 H ARG A 700 4.795 -3.043 19.040 1.00 0.00 H ATOM 867 N ARG A 701 1.990 -4.566 19.901 1.00 23.77 N ATOM 868 CA ARG A 701 0.785 -4.946 20.649 1.00 24.69 C ATOM 869 C ARG A 701 -0.381 -4.001 20.284 1.00 25.19 C ATOM 870 O ARG A 701 -1.512 -4.442 20.190 1.00 23.02 O ATOM 871 CB ARG A 701 1.074 -4.893 22.157 1.00 30.60 C ATOM 872 CG ARG A 701 0.023 -5.559 23.028 1.00 49.31 C ATOM 873 CD ARG A 701 0.286 -5.325 24.503 1.00 59.39 C ATOM 874 H ARG A 701 2.802 -4.177 20.422 1.00 0.00 H ATOM 875 N GLU A 702 -0.097 -2.710 20.050 1.00 19.63 N ATOM 876 CA GLU A 702 -1.125 -1.722 19.702 1.00 19.20 C ATOM 877 C GLU A 702 -1.212 -1.440 18.180 1.00 24.05 C ATOM 878 O GLU A 702 -1.760 -0.414 17.793 1.00 23.95 O ATOM 879 CB GLU A 702 -0.846 -0.419 20.477 1.00 21.06 C ATOM 880 CG GLU A 702 -0.959 -0.586 21.982 1.00 27.20 C ATOM 881 CD GLU A 702 -2.373 -0.749 22.501 1.00 40.13 C ATOM 882 OE1 GLU A 702 -3.302 -0.176 21.892 1.00 34.28 O ATOM 883 OE2 GLU A 702 -2.545 -1.414 23.543 1.00 32.45 O ATOM 884 H GLU A 702 0.892 -2.397 20.118 1.00 0.00 H ATOM 885 N ARG A 703 -0.658 -2.332 17.326 1.00 22.65 N ATOM 886 CA ARG A 703 -0.623 -2.140 15.863 1.00 24.15 C ATOM 887 C ARG A 703 -1.984 -1.781 15.256 1.00 27.24 C ATOM 888 O ARG A 703 -2.992 -2.421 15.551 1.00 25.42 O ATOM 889 CB ARG A 703 0.011 -3.347 15.133 1.00 27.53 C ATOM 890 CG ARG A 703 -0.760 -4.670 15.232 1.00 35.60 C ATOM 891 CD ARG A 703 -0.087 -5.762 14.422 1.00 47.16 C ATOM 892 H ARG A 703 -0.236 -3.197 17.721 1.00 0.00 H ATOM 893 N GLY A 704 -1.997 -0.721 14.467 1.00 24.82 N ATOM 894 CA GLY A 704 -3.203 -0.220 13.810 1.00 25.37 C ATOM 895 C GLY A 704 -4.007 0.782 14.625 1.00 28.01 C ATOM 896 O GLY A 704 -4.928 1.397 14.096 1.00 28.03 O ATOM 897 H GLY A 704 -1.102 -0.217 14.305 1.00 0.00 H ATOM 898 N HIS A 705 -3.654 0.985 15.908 1.00 22.89 N ATOM 899 CA HIS A 705 -4.394 1.886 16.797 1.00 22.76 C ATOM 900 C HIS A 705 -3.515 2.945 17.459 1.00 27.81 C ATOM 901 O HIS A 705 -3.869 3.459 18.530 1.00 27.35 O ATOM 902 CB HIS A 705 -5.185 1.065 17.834 1.00 23.12 C ATOM 903 CG HIS A 705 -6.023 -0.004 17.195 1.00 26.77 C ATOM 904 ND1 HIS A 705 -7.255 0.283 16.633 1.00 28.97 N ATOM 905 CD2 HIS A 705 -5.734 -1.305 16.963 1.00 28.56 C ATOM 906 CE1 HIS A 705 -7.695 -0.856 16.129 1.00 27.98 C ATOM 907 NE2 HIS A 705 -6.820 -1.840 16.311 1.00 28.32 N ATOM 908 H HIS A 705 -2.824 0.483 16.283 1.00 0.00 H ATOM 909 N VAL A 706 -2.378 3.299 16.811 1.00 22.71 N ATOM 910 CA VAL A 706 -1.482 4.319 17.365 1.00 22.90 C ATOM 911 C VAL A 706 -1.574 5.546 16.453 1.00 26.10 C ATOM 912 O VAL A 706 -1.138 5.463 15.311 1.00 25.11 O ATOM 913 CB VAL A 706 -0.022 3.813 17.589 1.00 26.10 C ATOM 914 CG1 VAL A 706 0.842 4.907 18.208 1.00 25.85 C ATOM 915 CG2 VAL A 706 0.014 2.553 18.461 1.00 25.32 C ATOM 916 H VAL A 706 -2.138 2.841 15.909 1.00 0.00 H ATOM 917 N PRO A 707 -2.163 6.671 16.907 1.00 26.40 N ATOM 918 CA PRO A 707 -2.316 7.827 16.004 1.00 26.25 C ATOM 919 C PRO A 707 -0.987 8.493 15.685 1.00 29.05 C ATOM 920 O PRO A 707 -0.044 8.410 16.475 1.00 25.11 O ATOM 921 CB PRO A 707 -3.220 8.795 16.789 1.00 28.69 C ATOM 922 CG PRO A 707 -3.745 8.014 17.954 1.00 33.19 C ATOM 923 CD PRO A 707 -2.755 6.936 18.238 1.00 28.00 C ATOM 924 N MET A 708 -0.940 9.175 14.530 1.00 27.84 N ATOM 925 CA MET A 708 0.210 9.911 14.038 1.00 29.76 C ATOM 926 C MET A 708 0.639 11.008 15.006 1.00 29.53 C ATOM 927 O MET A 708 1.834 11.221 15.165 1.00 29.84 O ATOM 928 CB MET A 708 -0.083 10.506 12.644 1.00 34.08 C ATOM 929 CG MET A 708 1.172 10.876 11.873 1.00 40.74 C ATOM 930 SD MET A 708 2.279 9.456 11.665 1.00 48.86 S ATOM 931 CE MET A 708 3.788 10.177 12.195 1.00 45.96 C ATOM 932 H MET A 708 -1.797 9.176 13.940 1.00 0.00 H ATOM 933 N ALA A 709 -0.312 11.682 15.669 1.00 25.81 N ATOM 934 CA ALA A 709 0.027 12.753 16.622 1.00 25.16 C ATOM 935 C ALA A 709 0.852 12.185 17.796 1.00 27.92 C ATOM 936 O ALA A 709 1.809 12.834 18.235 1.00 26.98 O ATOM 937 CB ALA A 709 -1.243 13.440 17.132 1.00 25.58 C ATOM 938 H ALA A 709 -1.311 11.443 15.507 1.00 0.00 H ATOM 939 N TRP A 710 0.489 10.965 18.281 1.00 23.05 N ATOM 940 CA TRP A 710 1.200 10.255 19.361 1.00 22.40 C ATOM 941 C TRP A 710 2.652 9.968 18.905 1.00 23.97 C ATOM 942 O TRP A 710 3.599 10.247 19.632 1.00 22.44 O ATOM 943 CB TRP A 710 0.451 8.944 19.688 1.00 20.97 C ATOM 944 CG TRP A 710 0.919 8.234 20.918 1.00 21.92 C ATOM 945 CD1 TRP A 710 0.333 8.277 22.146 1.00 24.64 C ATOM 946 CD2 TRP A 710 2.009 7.297 21.025 1.00 21.86 C ATOM 947 NE1 TRP A 710 1.011 7.470 23.019 1.00 23.70 N ATOM 948 CE2 TRP A 710 2.025 6.831 22.355 1.00 25.74 C ATOM 949 CE3 TRP A 710 2.983 6.807 20.123 1.00 22.96 C ATOM 950 CZ2 TRP A 710 3.000 5.939 22.828 1.00 25.39 C ATOM 951 CZ3 TRP A 710 3.891 5.859 20.570 1.00 24.60 C ATOM 952 CH2 TRP A 710 3.915 5.457 21.918 1.00 25.36 C ATOM 953 HE1 TRP A 710 0.791 7.359 24.029 1.00 0.00 H ATOM 954 H TRP A 710 -0.344 10.504 17.862 1.00 0.00 H ATOM 955 N LYS A 711 2.816 9.461 17.677 1.00 22.46 N ATOM 956 CA LYS A 711 4.130 9.150 17.093 1.00 23.20 C ATOM 957 C LYS A 711 5.019 10.387 16.942 1.00 26.01 C ATOM 958 O LYS A 711 6.228 10.301 17.167 1.00 25.10 O ATOM 959 CB LYS A 711 3.972 8.442 15.739 1.00 24.91 C ATOM 960 CG LYS A 711 3.297 7.090 15.889 1.00 23.64 C ATOM 961 CD LYS A 711 3.087 6.424 14.548 1.00 25.25 C ATOM 962 CE LYS A 711 2.423 5.084 14.750 1.00 27.15 C ATOM 963 NZ LYS A 711 2.238 4.363 13.468 1.00 23.20 N ATOM 964 HZ1 LYS A 711 1.641 4.932 12.835 1.00 0.00 H ATOM 965 HZ2 LYS A 711 3.165 4.205 13.023 1.00 0.00 H ATOM 966 HZ3 LYS A 711 1.779 3.448 13.650 1.00 0.00 H ATOM 967 H LYS A 711 1.968 9.277 17.104 1.00 0.00 H ATOM 968 N MET A 712 4.411 11.535 16.599 1.00 24.46 N ATOM 969 CA MET A 712 5.123 12.809 16.439 1.00 25.47 C ATOM 970 C MET A 712 5.667 13.315 17.771 1.00 24.40 C ATOM 971 O MET A 712 6.765 13.860 17.799 1.00 23.43 O ATOM 972 CB MET A 712 4.239 13.863 15.745 1.00 29.29 C ATOM 973 CG MET A 712 3.944 13.543 14.276 1.00 35.34 C ATOM 974 SD MET A 712 5.410 13.331 13.221 1.00 42.68 S ATOM 975 CE MET A 712 6.073 15.007 13.259 1.00 40.59 C ATOM 976 H MET A 712 3.384 11.520 16.439 1.00 0.00 H ATOM 977 N VAL A 713 4.918 13.111 18.870 1.00 22.59 N ATOM 978 CA VAL A 713 5.372 13.489 20.231 1.00 23.10 C ATOM 979 C VAL A 713 6.633 12.663 20.596 1.00 23.48 C ATOM 980 O VAL A 713 7.627 13.233 21.066 1.00 22.15 O ATOM 981 CB VAL A 713 4.244 13.360 21.290 1.00 27.86 C ATOM 982 CG1 VAL A 713 4.780 13.524 22.712 1.00 27.92 C ATOM 983 CG2 VAL A 713 3.124 14.369 21.018 1.00 28.03 C ATOM 984 H VAL A 713 3.982 12.670 18.761 1.00 0.00 H ATOM 985 N VAL A 714 6.589 11.335 20.359 1.00 20.17 N ATOM 986 CA VAL A 714 7.727 10.416 20.608 1.00 19.82 C ATOM 987 C VAL A 714 8.940 10.858 19.805 1.00 23.17 C ATOM 988 O VAL A 714 10.031 10.911 20.367 1.00 21.66 O ATOM 989 CB VAL A 714 7.362 8.922 20.344 1.00 23.41 C ATOM 990 CG1 VAL A 714 8.604 8.003 20.356 1.00 23.55 C ATOM 991 CG2 VAL A 714 6.346 8.435 21.372 1.00 23.48 C ATOM 992 H VAL A 714 5.708 10.933 19.980 1.00 0.00 H ATOM 993 N ALA A 715 8.762 11.148 18.483 1.00 20.50 N ATOM 994 CA ALA A 715 9.851 11.579 17.607 1.00 20.69 C ATOM 995 C ALA A 715 10.533 12.833 18.161 1.00 26.23 C ATOM 996 O ALA A 715 11.755 12.911 18.134 1.00 26.31 O ATOM 997 CB ALA A 715 9.325 11.866 16.190 1.00 21.43 C ATOM 998 H ALA A 715 7.807 11.058 18.080 1.00 0.00 H ATOM 999 N GLN A 716 9.746 13.826 18.628 1.00 23.19 N ATOM 1000 CA GLN A 716 10.280 15.090 19.164 1.00 22.66 C ATOM 1001 C GLN A 716 11.032 14.873 20.443 1.00 22.07 C ATOM 1002 O GLN A 716 12.109 15.448 20.601 1.00 21.39 O ATOM 1003 CB GLN A 716 9.140 16.114 19.374 1.00 25.30 C ATOM 1004 CG GLN A 716 8.607 16.661 18.069 1.00 37.50 C ATOM 1005 H GLN A 716 8.715 13.692 18.608 1.00 0.00 H ATOM 1006 N GLN A 717 10.503 14.006 21.355 1.00 16.14 N ATOM 1007 CA GLN A 717 11.156 13.696 22.614 1.00 17.06 C ATOM 1008 C GLN A 717 12.480 12.972 22.348 1.00 19.79 C ATOM 1009 O GLN A 717 13.487 13.293 22.970 1.00 19.18 O ATOM 1010 CB GLN A 717 10.248 12.862 23.530 1.00 18.07 C ATOM 1011 CG GLN A 717 9.002 13.615 24.034 1.00 24.28 C ATOM 1012 CD GLN A 717 8.122 12.787 24.961 1.00 29.14 C ATOM 1013 OE1 GLN A 717 8.456 11.651 25.312 1.00 21.90 O ATOM 1014 NE2 GLN A 717 6.982 13.352 25.422 1.00 19.24 N ATOM 1015 HE22 GLN A 717 6.716 14.310 25.116 1.00 0.00 H ATOM 1016 HE21 GLN A 717 6.372 12.829 26.082 1.00 0.00 H ATOM 1017 H GLN A 717 9.594 13.548 21.139 1.00 0.00 H ATOM 1018 N LEU A 718 12.482 12.052 21.383 1.00 16.71 N ATOM 1019 CA LEU A 718 13.697 11.330 21.023 1.00 19.21 C ATOM 1020 C LEU A 718 14.710 12.297 20.403 1.00 23.17 C ATOM 1021 O LEU A 718 15.863 12.267 20.819 1.00 21.24 O ATOM 1022 CB LEU A 718 13.366 10.167 20.062 1.00 20.05 C ATOM 1023 CG LEU A 718 14.561 9.381 19.499 1.00 24.42 C ATOM 1024 CD1 LEU A 718 15.400 8.744 20.617 1.00 23.66 C ATOM 1025 CD2 LEU A 718 14.094 8.330 18.517 1.00 25.78 C ATOM 1026 H LEU A 718 11.598 11.845 20.876 1.00 0.00 H ATOM 1027 N ALA A 719 14.282 13.156 19.440 1.00 21.70 N ATOM 1028 CA ALA A 719 15.179 14.157 18.834 1.00 22.70 C ATOM 1029 C ALA A 719 15.766 15.123 19.883 1.00 27.64 C ATOM 1030 O ALA A 719 16.926 15.523 19.741 1.00 26.92 O ATOM 1031 CB ALA A 719 14.463 14.946 17.734 1.00 23.69 C ATOM 1032 H ALA A 719 13.293 13.106 19.122 1.00 0.00 H ATOM 1033 N SER A 720 14.998 15.446 20.965 1.00 24.28 N ATOM 1034 CA SER A 720 15.488 16.319 22.022 1.00 24.61 C ATOM 1035 C SER A 720 16.603 15.680 22.797 1.00 26.89 C ATOM 1036 O SER A 720 17.607 16.350 23.056 1.00 25.42 O ATOM 1037 CB SER A 720 14.364 16.816 22.934 1.00 28.46 C ATOM 1038 OG SER A 720 14.023 15.937 23.990 1.00 44.22 O ATOM 1039 HG SER A 720 13.724 15.071 23.614 1.00 0.00 H ATOM 1040 H SER A 720 14.036 15.057 21.036 1.00 0.00 H ATOM 1041 N ALA A 721 16.449 14.371 23.166 1.00 23.39 N ATOM 1042 CA ALA A 721 17.500 13.629 23.872 1.00 22.81 C ATOM 1043 C ALA A 721 18.752 13.562 22.997 1.00 24.60 C ATOM 1044 O ALA A 721 19.856 13.748 23.505 1.00 24.10 O ATOM 1045 CB ALA A 721 17.023 12.208 24.200 1.00 23.74 C ATOM 1046 H ALA A 721 15.558 13.886 22.938 1.00 0.00 H ATOM 1047 N LEU A 722 18.584 13.310 21.689 1.00 21.12 N ATOM 1048 CA LEU A 722 19.719 13.172 20.785 1.00 20.45 C ATOM 1049 C LEU A 722 20.403 14.511 20.472 1.00 24.69 C ATOM 1050 O LEU A 722 21.610 14.507 20.291 1.00 22.95 O ATOM 1051 CB LEU A 722 19.341 12.405 19.513 1.00 19.90 C ATOM 1052 CG LEU A 722 18.967 10.916 19.747 1.00 23.87 C ATOM 1053 CD1 LEU A 722 18.351 10.308 18.506 1.00 24.13 C ATOM 1054 CD2 LEU A 722 20.163 10.113 20.192 1.00 26.00 C ATOM 1055 H LEU A 722 17.620 13.211 21.311 1.00 0.00 H ATOM 1056 N SER A 723 19.657 15.632 20.462 1.00 23.83 N ATOM 1057 CA SER A 723 20.209 17.000 20.270 1.00 24.27 C ATOM 1058 C SER A 723 21.110 17.339 21.469 1.00 28.06 C ATOM 1059 O SER A 723 22.193 17.904 21.298 1.00 27.14 O ATOM 1060 CB SER A 723 19.084 18.032 20.170 1.00 29.44 C ATOM 1061 OG SER A 723 19.639 19.327 20.003 1.00 37.41 O ATOM 1062 HG SER A 723 18.908 19.992 19.939 1.00 0.00 H ATOM 1063 H SER A 723 18.630 15.535 20.597 1.00 0.00 H ATOM 1064 N TYR A 724 20.655 16.984 22.671 1.00 25.56 N ATOM 1065 CA TYR A 724 21.387 17.157 23.924 1.00 25.22 C ATOM 1066 C TYR A 724 22.721 16.397 23.832 1.00 30.41 C ATOM 1067 O TYR A 724 23.764 16.969 24.163 1.00 28.33 O ATOM 1068 CB TYR A 724 20.536 16.640 25.110 1.00 25.58 C ATOM 1069 CG TYR A 724 21.300 16.470 26.404 1.00 26.80 C ATOM 1070 CD1 TYR A 724 21.578 17.564 27.221 1.00 29.17 C ATOM 1071 CD2 TYR A 724 21.747 15.217 26.815 1.00 26.75 C ATOM 1072 CE1 TYR A 724 22.283 17.413 28.413 1.00 29.93 C ATOM 1073 CE2 TYR A 724 22.469 15.057 27.992 1.00 27.47 C ATOM 1074 CZ TYR A 724 22.743 16.163 28.783 1.00 34.48 C ATOM 1075 OH TYR A 724 23.437 16.018 29.948 1.00 31.60 O ATOM 1076 HH TYR A 724 23.541 16.902 30.381 1.00 0.00 H ATOM 1077 H TYR A 724 19.710 16.552 22.720 1.00 0.00 H ATOM 1078 N LEU A 725 22.697 15.121 23.366 1.00 27.33 N ATOM 1079 CA LEU A 725 23.937 14.343 23.217 1.00 26.76 C ATOM 1080 C LEU A 725 24.858 14.919 22.157 1.00 30.18 C ATOM 1081 O LEU A 725 26.069 15.003 22.383 1.00 31.03 O ATOM 1082 CB LEU A 725 23.675 12.845 22.942 1.00 26.05 C ATOM 1083 CG LEU A 725 22.960 12.077 24.067 1.00 30.49 C ATOM 1084 CD1 LEU A 725 22.645 10.644 23.650 1.00 29.87 C ATOM 1085 CD2 LEU A 725 23.799 12.064 25.337 1.00 30.95 C ATOM 1086 H LEU A 725 21.787 14.687 23.110 1.00 0.00 H ATOM 1087 N GLU A 726 24.290 15.310 21.012 1.00 27.37 N ATOM 1088 CA GLU A 726 25.017 15.895 19.883 1.00 28.19 C ATOM 1089 C GLU A 726 25.769 17.157 20.338 1.00 34.31 C ATOM 1090 O GLU A 726 26.951 17.313 20.024 1.00 34.83 O ATOM 1091 CB GLU A 726 24.041 16.235 18.746 1.00 29.66 C ATOM 1092 CG GLU A 726 24.642 17.060 17.617 1.00 40.47 C ATOM 1093 CD GLU A 726 23.608 17.612 16.655 1.00 52.78 C ATOM 1094 OE1 GLU A 726 23.024 18.683 16.935 1.00 63.64 O ATOM 1095 OE2 GLU A 726 23.348 16.939 15.638 1.00 44.20 O ATOM 1096 H GLU A 726 23.261 15.191 20.916 1.00 0.00 H ATOM 1097 N ASN A 727 25.105 18.024 21.087 1.00 31.84 N ATOM 1098 CA ASN A 727 25.722 19.255 21.580 1.00 33.30 C ATOM 1099 C ASN A 727 26.887 19.017 22.545 1.00 38.44 C ATOM 1100 O ASN A 727 27.733 19.904 22.702 1.00 38.78 O ATOM 1101 CB ASN A 727 24.678 20.170 22.186 1.00 34.30 C ATOM 1102 CG ASN A 727 23.693 20.716 21.192 1.00 57.04 C ATOM 1103 OD1 ASN A 727 23.952 20.783 19.984 1.00 51.87 O ATOM 1104 ND2 ASN A 727 22.543 21.140 21.692 1.00 48.17 N ATOM 1105 HD22 ASN A 727 22.362 21.067 22.713 1.00 0.00 H ATOM 1106 HD21 ASN A 727 21.821 21.546 21.063 1.00 0.00 H ATOM 1107 H ASN A 727 24.114 17.823 21.332 1.00 0.00 H ATOM 1108 N LYS A 728 26.933 17.822 23.175 1.00 33.55 N ATOM 1109 CA LYS A 728 28.005 17.426 24.077 1.00 33.94 C ATOM 1110 C LYS A 728 29.039 16.544 23.354 1.00 38.78 C ATOM 1111 O LYS A 728 29.982 16.067 23.994 1.00 40.04 O ATOM 1112 CB LYS A 728 27.428 16.708 25.316 1.00 36.12 C ATOM 1113 CG LYS A 728 26.792 17.668 26.325 1.00 41.91 C ATOM 1114 CD LYS A 728 26.006 16.971 27.439 1.00 47.51 C ATOM 1115 CE LYS A 728 26.721 16.524 28.697 1.00 50.44 C ATOM 1116 NZ LYS A 728 27.721 17.505 29.186 1.00 58.59 N ATOM 1117 HZ1 LYS A 728 28.443 17.657 28.453 1.00 0.00 H ATOM 1118 HZ2 LYS A 728 27.246 18.405 29.399 1.00 0.00 H ATOM 1119 HZ3 LYS A 728 28.173 17.138 30.048 1.00 0.00 H ATOM 1120 H LYS A 728 26.159 17.148 23.006 1.00 0.00 H ATOM 1121 N ASN A 729 28.863 16.329 22.022 1.00 34.30 N ATOM 1122 CA ASN A 729 29.703 15.465 21.174 1.00 34.25 C ATOM 1123 C ASN A 729 29.764 14.031 21.716 1.00 37.20 C ATOM 1124 O ASN A 729 30.818 13.392 21.724 1.00 36.25 O ATOM 1125 CB ASN A 729 31.111 16.063 20.921 1.00 40.72 C ATOM 1126 H ASN A 729 28.067 16.816 21.563 1.00 0.00 H ATOM 1127 N LEU A 730 28.604 13.517 22.157 1.00 32.09 N ATOM 1128 CA LEU A 730 28.502 12.172 22.703 1.00 30.50 C ATOM 1129 C LEU A 730 27.691 11.297 21.771 1.00 34.72 C ATOM 1130 O LEU A 730 26.692 11.760 21.229 1.00 35.87 O ATOM 1131 CB LEU A 730 27.859 12.218 24.089 1.00 30.59 C ATOM 1132 CG LEU A 730 28.652 12.954 25.202 1.00 34.62 C ATOM 1133 CD1 LEU A 730 27.801 13.095 26.432 1.00 35.29 C ATOM 1134 CD2 LEU A 730 29.957 12.230 25.561 1.00 33.81 C ATOM 1135 H LEU A 730 27.746 14.103 22.106 1.00 0.00 H ATOM 1136 N VAL A 731 28.150 10.062 21.542 1.00 28.58 N ATOM 1137 CA VAL A 731 27.495 9.104 20.662 1.00 28.86 C ATOM 1138 C VAL A 731 26.688 8.129 21.521 1.00 29.64 C ATOM 1139 O VAL A 731 27.207 7.593 22.504 1.00 27.58 O ATOM 1140 CB VAL A 731 28.523 8.306 19.798 1.00 34.41 C ATOM 1141 CG1 VAL A 731 27.827 7.280 18.909 1.00 34.91 C ATOM 1142 CG2 VAL A 731 29.415 9.227 18.963 1.00 34.68 C ATOM 1143 H VAL A 731 29.026 9.769 22.020 1.00 0.00 H ATOM 1144 N HIS A 732 25.446 7.851 21.113 1.00 24.57 N ATOM 1145 CA HIS A 732 24.652 6.806 21.772 1.00 22.53 C ATOM 1146 C HIS A 732 25.046 5.498 21.069 1.00 27.14 C ATOM 1147 O HIS A 732 25.605 4.587 21.688 1.00 28.44 O ATOM 1148 CB HIS A 732 23.143 7.122 21.676 1.00 21.39 C ATOM 1149 CG HIS A 732 22.279 6.126 22.392 1.00 21.55 C ATOM 1150 ND1 HIS A 732 21.867 4.958 21.774 1.00 21.50 N ATOM 1151 CD2 HIS A 732 21.737 6.181 23.629 1.00 20.79 C ATOM 1152 CE1 HIS A 732 21.106 4.334 22.654 1.00 19.78 C ATOM 1153 NE2 HIS A 732 20.985 5.044 23.781 1.00 20.65 N ATOM 1154 H HIS A 732 25.036 8.382 20.318 1.00 0.00 H ATOM 1155 N GLY A 733 24.820 5.429 19.768 1.00 24.29 N ATOM 1156 CA GLY A 733 25.231 4.281 18.966 1.00 24.49 C ATOM 1157 C GLY A 733 24.315 3.080 18.971 1.00 27.98 C ATOM 1158 O GLY A 733 24.668 2.055 18.386 1.00 27.09 O ATOM 1159 H GLY A 733 24.333 6.220 19.300 1.00 0.00 H ATOM 1160 N ASN A 734 23.111 3.201 19.594 1.00 23.20 N ATOM 1161 CA ASN A 734 22.149 2.094 19.606 1.00 21.63 C ATOM 1162 C ASN A 734 20.724 2.633 19.679 1.00 23.89 C ATOM 1163 O ASN A 734 19.907 2.194 20.517 1.00 20.54 O ATOM 1164 CB ASN A 734 22.450 1.144 20.757 1.00 22.23 C ATOM 1165 CG ASN A 734 21.898 -0.245 20.578 1.00 30.32 C ATOM 1166 OD1 ASN A 734 21.364 -0.600 19.538 1.00 26.82 O ATOM 1167 ND2 ASN A 734 22.026 -1.065 21.606 1.00 23.87 N ATOM 1168 HD22 ASN A 734 22.485 -0.736 22.479 1.00 0.00 H ATOM 1169 HD21 ASN A 734 21.668 -2.039 21.542 1.00 0.00 H ATOM 1170 H ASN A 734 22.869 4.094 20.070 1.00 0.00 H ATOM 1171 N VAL A 735 20.427 3.604 18.798 1.00 19.31 N ATOM 1172 CA VAL A 735 19.095 4.207 18.753 1.00 19.31 C ATOM 1173 C VAL A 735 18.181 3.246 17.999 1.00 22.60 C ATOM 1174 O VAL A 735 18.422 2.962 16.830 1.00 23.14 O ATOM 1175 CB VAL A 735 19.113 5.630 18.119 1.00 20.89 C ATOM 1176 CG1 VAL A 735 17.697 6.203 17.994 1.00 19.06 C ATOM 1177 CG2 VAL A 735 20.016 6.576 18.918 1.00 20.27 C ATOM 1178 H VAL A 735 21.158 3.933 18.136 1.00 0.00 H ATOM 1179 N CYS A 736 17.137 2.745 18.677 1.00 18.77 N ATOM 1180 CA CYS A 736 16.152 1.822 18.100 1.00 17.68 C ATOM 1181 C CYS A 736 14.963 1.774 19.044 1.00 18.96 C ATOM 1182 O CYS A 736 15.079 2.179 20.191 1.00 20.37 O ATOM 1183 CB CYS A 736 16.758 0.439 17.888 1.00 18.06 C ATOM 1184 SG CYS A 736 17.294 -0.339 19.422 1.00 22.33 S ATOM 1185 H CYS A 736 17.019 3.028 19.671 1.00 0.00 H ATOM 1186 N GLY A 737 13.822 1.307 18.556 1.00 16.87 N ATOM 1187 CA GLY A 737 12.593 1.198 19.335 1.00 16.91 C ATOM 1188 C GLY A 737 12.770 0.368 20.590 1.00 20.83 C ATOM 1189 O GLY A 737 12.159 0.668 21.606 1.00 21.01 O ATOM 1190 H GLY A 737 13.802 1.001 17.562 1.00 0.00 H ATOM 1191 N ARG A 738 13.630 -0.676 20.547 1.00 18.10 N ATOM 1192 CA ARG A 738 13.896 -1.511 21.719 1.00 17.62 C ATOM 1193 C ARG A 738 14.567 -0.710 22.839 1.00 22.14 C ATOM 1194 O ARG A 738 14.361 -1.009 24.016 1.00 20.11 O ATOM 1195 CB ARG A 738 14.753 -2.732 21.332 1.00 17.95 C ATOM 1196 CG ARG A 738 15.190 -3.636 22.534 1.00 16.17 C ATOM 1197 CD ARG A 738 14.006 -4.221 23.321 1.00 17.81 C ATOM 1198 NE ARG A 738 13.030 -4.888 22.448 1.00 24.56 N ATOM 1199 CZ ARG A 738 13.129 -6.158 22.049 1.00 40.24 C ATOM 1200 NH1 ARG A 738 12.218 -6.677 21.234 1.00 30.15 N ATOM 1201 NH2 ARG A 738 14.142 -6.917 22.463 1.00 26.10 N ATOM 1202 HE ARG A 738 12.211 -4.336 22.121 1.00 0.00 H ATOM 1203 HH12 ARG A 738 12.300 -7.667 20.926 1.00 0.00 H ATOM 1204 HH11 ARG A 738 11.423 -6.093 20.904 1.00 0.00 H ATOM 1205 HH22 ARG A 738 14.213 -7.906 22.148 1.00 0.00 H ATOM 1206 HH21 ARG A 738 14.862 -6.521 23.101 1.00 0.00 H ATOM 1207 H ARG A 738 14.117 -0.892 19.654 1.00 0.00 H ATOM 1208 N ASN A 739 15.361 0.300 22.485 1.00 19.64 N ATOM 1209 CA ASN A 739 16.017 1.129 23.499 1.00 19.49 C ATOM 1210 C ASN A 739 15.230 2.375 23.877 1.00 21.30 C ATOM 1211 O ASN A 739 15.767 3.280 24.506 1.00 24.59 O ATOM 1212 CB ASN A 739 17.442 1.480 23.048 1.00 14.00 C ATOM 1213 CG ASN A 739 18.378 0.332 23.245 1.00 32.94 C ATOM 1214 OD1 ASN A 739 18.128 -0.613 24.002 1.00 31.19 O ATOM 1215 ND2 ASN A 739 19.488 0.389 22.584 1.00 31.37 N ATOM 1216 HD22 ASN A 739 19.677 1.194 21.953 1.00 0.00 H ATOM 1217 HD21 ASN A 739 20.192 -0.370 22.683 1.00 0.00 H ATOM 1218 H ASN A 739 15.517 0.502 21.477 1.00 0.00 H ATOM 1219 N ILE A 740 13.996 2.473 23.426 1.00 16.76 N ATOM 1220 CA ILE A 740 13.146 3.603 23.808 1.00 16.58 C ATOM 1221 C ILE A 740 12.149 3.012 24.823 1.00 22.04 C ATOM 1222 O ILE A 740 11.394 2.121 24.472 1.00 21.24 O ATOM 1223 CB ILE A 740 12.459 4.263 22.594 1.00 18.96 C ATOM 1224 CG1 ILE A 740 13.540 4.924 21.659 1.00 19.43 C ATOM 1225 CG2 ILE A 740 11.437 5.296 23.072 1.00 18.64 C ATOM 1226 CD1 ILE A 740 13.014 5.216 20.343 1.00 25.49 C ATOM 1227 H ILE A 740 13.621 1.739 22.791 1.00 0.00 H ATOM 1228 N LEU A 741 12.152 3.504 26.074 1.00 16.54 N ATOM 1229 CA LEU A 741 11.279 2.980 27.111 1.00 15.86 C ATOM 1230 C LEU A 741 10.108 3.943 27.375 1.00 20.55 C ATOM 1231 O LEU A 741 10.278 5.159 27.292 1.00 18.92 O ATOM 1232 CB LEU A 741 12.123 2.805 28.375 1.00 15.41 C ATOM 1233 CG LEU A 741 13.359 1.889 28.206 1.00 22.33 C ATOM 1234 CD1 LEU A 741 14.402 2.198 29.289 1.00 23.51 C ATOM 1235 CD2 LEU A 741 12.950 0.400 28.170 1.00 21.76 C ATOM 1236 H LEU A 741 12.799 4.284 26.307 1.00 0.00 H ATOM 1237 N LEU A 742 8.931 3.395 27.669 1.00 17.54 N ATOM 1238 CA LEU A 742 7.745 4.208 27.919 1.00 19.16 C ATOM 1239 C LEU A 742 7.471 4.413 29.395 1.00 22.02 C ATOM 1240 O LEU A 742 7.080 3.467 30.087 1.00 22.05 O ATOM 1241 CB LEU A 742 6.516 3.601 27.221 1.00 20.29 C ATOM 1242 CG LEU A 742 6.536 3.637 25.700 1.00 25.74 C ATOM 1243 CD1 LEU A 742 5.602 2.581 25.127 1.00 26.20 C ATOM 1244 CD2 LEU A 742 6.176 5.063 25.152 1.00 25.61 C ATOM 1245 H LEU A 742 8.854 2.359 27.722 1.00 0.00 H ATOM 1246 N ALA A 743 7.687 5.658 29.888 1.00 17.92 N ATOM 1247 CA ALA A 743 7.412 6.025 31.290 1.00 17.61 C ATOM 1248 C ALA A 743 5.906 6.280 31.386 1.00 23.64 C ATOM 1249 O ALA A 743 5.286 5.951 32.397 1.00 23.64 O ATOM 1250 CB ALA A 743 8.183 7.292 31.681 1.00 17.91 C ATOM 1251 H ALA A 743 8.064 6.387 29.249 1.00 0.00 H ATOM 1252 N ARG A 744 5.325 6.863 30.317 1.00 21.99 N ATOM 1253 CA ARG A 744 3.889 7.145 30.246 1.00 21.59 C ATOM 1254 C ARG A 744 3.385 6.765 28.869 1.00 21.53 C ATOM 1255 O ARG A 744 4.051 7.032 27.876 1.00 20.52 O ATOM 1256 CB ARG A 744 3.593 8.646 30.541 1.00 23.51 C ATOM 1257 CG ARG A 744 4.107 9.169 31.889 1.00 25.34 C ATOM 1258 CD ARG A 744 3.172 8.775 33.013 1.00 28.87 C ATOM 1259 NE ARG A 744 3.589 9.348 34.298 1.00 27.65 N ATOM 1260 CZ ARG A 744 4.459 8.783 35.123 1.00 33.92 C ATOM 1261 NH1 ARG A 744 5.032 7.634 34.805 1.00 28.56 N ATOM 1262 NH2 ARG A 744 4.755 9.357 36.278 1.00 25.37 N ATOM 1263 HE ARG A 744 3.174 10.259 34.580 1.00 0.00 H ATOM 1264 HH12 ARG A 744 5.714 7.195 35.456 1.00 0.00 H ATOM 1265 HH11 ARG A 744 4.801 7.169 33.904 1.00 0.00 H ATOM 1266 HH22 ARG A 744 5.438 8.909 36.921 1.00 0.00 H ATOM 1267 HH21 ARG A 744 4.304 10.256 36.542 1.00 0.00 H ATOM 1268 H ARG A 744 5.923 7.124 29.507 1.00 0.00 H ATOM 1269 N LEU A 745 2.216 6.151 28.807 1.00 19.47 N ATOM 1270 CA LEU A 745 1.645 5.696 27.534 1.00 20.30 C ATOM 1271 C LEU A 745 0.922 6.790 26.758 1.00 24.07 C ATOM 1272 O LEU A 745 0.927 6.762 25.536 1.00 24.44 O ATOM 1273 CB LEU A 745 0.703 4.490 27.775 1.00 20.21 C ATOM 1274 CG LEU A 745 1.378 3.188 28.297 1.00 24.43 C ATOM 1275 CD1 LEU A 745 0.358 2.117 28.567 1.00 24.27 C ATOM 1276 CD2 LEU A 745 2.458 2.669 27.316 1.00 25.78 C ATOM 1277 H LEU A 745 1.685 5.986 29.686 1.00 0.00 H ATOM 1278 N GLY A 746 0.294 7.725 27.452 1.00 21.03 N ATOM 1279 CA GLY A 746 -0.439 8.808 26.790 1.00 21.51 C ATOM 1280 C GLY A 746 -1.663 8.319 26.030 1.00 26.29 C ATOM 1281 O GLY A 746 -1.923 8.787 24.919 1.00 26.27 O ATOM 1282 H GLY A 746 0.321 7.691 28.491 1.00 0.00 H ATOM 1283 N LEU A 747 -2.381 7.315 26.589 1.00 22.85 N ATOM 1284 CA LEU A 747 -3.600 6.727 25.996 1.00 23.09 C ATOM 1285 C LEU A 747 -4.855 7.458 26.485 1.00 27.23 C ATOM 1286 O LEU A 747 -5.843 7.521 25.752 1.00 26.24 O ATOM 1287 CB LEU A 747 -3.733 5.229 26.365 1.00 23.23 C ATOM 1288 CG LEU A 747 -2.798 4.230 25.651 1.00 28.21 C ATOM 1289 CD1 LEU A 747 -2.944 2.858 26.270 1.00 28.99 C ATOM 1290 CD2 LEU A 747 -3.113 4.137 24.159 1.00 31.31 C ATOM 1291 H LEU A 747 -2.051 6.932 27.498 1.00 0.00 H ATOM 1292 N ALA A 748 -4.855 7.932 27.748 1.00 22.82 N ATOM 1293 CA ALA A 748 -6.025 8.642 28.283 1.00 23.68 C ATOM 1294 C ALA A 748 -6.172 10.055 27.639 1.00 30.74 C ATOM 1295 O ALA A 748 -5.177 10.690 27.260 1.00 27.05 O ATOM 1296 CB ALA A 748 -5.922 8.757 29.799 1.00 24.31 C ATOM 1297 H ALA A 748 -4.018 7.793 28.349 1.00 0.00 H ATOM 1298 N GLU A 749 -7.417 10.538 27.519 1.00 30.30 N ATOM 1299 CA GLU A 749 -7.697 11.886 26.986 1.00 31.82 C ATOM 1300 C GLU A 749 -6.942 12.959 27.780 1.00 32.58 C ATOM 1301 O GLU A 749 -6.880 12.895 29.003 1.00 32.36 O ATOM 1302 CB GLU A 749 -9.216 12.176 27.038 1.00 34.12 C ATOM 1303 H GLU A 749 -8.216 9.940 27.813 1.00 0.00 H ATOM 1304 N GLY A 750 -6.330 13.900 27.078 1.00 30.17 N ATOM 1305 CA GLY A 750 -5.591 14.986 27.717 1.00 29.75 C ATOM 1306 C GLY A 750 -4.202 14.624 28.215 1.00 33.52 C ATOM 1307 O GLY A 750 -3.570 15.426 28.912 1.00 33.37 O ATOM 1308 H GLY A 750 -6.377 13.865 26.040 1.00 0.00 H ATOM 1309 N THR A 751 -3.698 13.423 27.858 1.00 27.56 N ATOM 1310 CA THR A 751 -2.353 12.999 28.286 1.00 26.37 C ATOM 1311 C THR A 751 -1.458 12.797 27.054 1.00 29.96 C ATOM 1312 O THR A 751 -1.942 12.669 25.931 1.00 30.84 O ATOM 1313 CB THR A 751 -2.410 11.708 29.141 1.00 32.13 C ATOM 1314 OG1 THR A 751 -2.708 10.590 28.288 1.00 25.58 O ATOM 1315 CG2 THR A 751 -3.428 11.794 30.285 1.00 30.91 C ATOM 1316 HG1 THR A 751 -3.582 10.737 27.847 1.00 0.00 H ATOM 1317 H THR A 751 -4.270 12.785 27.269 1.00 0.00 H ATOM 1318 N SER A 752 -0.157 12.731 27.264 1.00 25.35 N ATOM 1319 CA SER A 752 0.766 12.540 26.156 1.00 26.53 C ATOM 1320 C SER A 752 1.782 11.453 26.540 1.00 25.80 C ATOM 1321 O SER A 752 2.016 11.254 27.732 1.00 25.23 O ATOM 1322 CB SER A 752 1.492 13.854 25.860 1.00 34.72 C ATOM 1323 OG SER A 752 2.206 14.260 27.017 1.00 49.94 O ATOM 1324 HG SER A 752 2.865 13.562 27.259 1.00 0.00 H ATOM 1325 H SER A 752 0.213 12.816 28.232 1.00 0.00 H ATOM 1326 N PRO A 753 2.387 10.723 25.599 1.00 22.28 N ATOM 1327 CA PRO A 753 3.390 9.724 26.009 1.00 21.60 C ATOM 1328 C PRO A 753 4.641 10.410 26.551 1.00 23.99 C ATOM 1329 O PRO A 753 4.883 11.593 26.283 1.00 21.99 O ATOM 1330 CB PRO A 753 3.707 8.984 24.697 1.00 23.36 C ATOM 1331 CG PRO A 753 3.399 9.949 23.635 1.00 27.22 C ATOM 1332 CD PRO A 753 2.278 10.810 24.124 1.00 22.98 C ATOM 1333 N PHE A 754 5.434 9.670 27.305 1.00 19.74 N ATOM 1334 CA PHE A 754 6.690 10.167 27.844 1.00 19.72 C ATOM 1335 C PHE A 754 7.713 9.046 27.651 1.00 20.52 C ATOM 1336 O PHE A 754 7.549 7.974 28.230 1.00 17.40 O ATOM 1337 CB PHE A 754 6.524 10.497 29.331 1.00 22.33 C ATOM 1338 CG PHE A 754 7.660 11.249 29.984 1.00 26.35 C ATOM 1339 CD1 PHE A 754 8.951 10.722 30.004 1.00 30.52 C ATOM 1340 CD2 PHE A 754 7.430 12.453 30.638 1.00 32.89 C ATOM 1341 CE1 PHE A 754 9.998 11.406 30.642 1.00 32.34 C ATOM 1342 CE2 PHE A 754 8.477 13.130 31.290 1.00 36.32 C ATOM 1343 CZ PHE A 754 9.745 12.581 31.312 1.00 33.12 C ATOM 1344 H PHE A 754 5.149 8.694 27.522 1.00 0.00 H ATOM 1345 N ILE A 755 8.776 9.302 26.885 1.00 16.02 N ATOM 1346 CA ILE A 755 9.799 8.290 26.637 1.00 16.37 C ATOM 1347 C ILE A 755 11.100 8.557 27.410 1.00 22.89 C ATOM 1348 O ILE A 755 11.358 9.691 27.851 1.00 22.16 O ATOM 1349 CB ILE A 755 10.096 8.103 25.095 1.00 20.41 C ATOM 1350 CG1 ILE A 755 10.830 9.331 24.485 1.00 21.74 C ATOM 1351 CG2 ILE A 755 8.845 7.734 24.294 1.00 21.90 C ATOM 1352 CD1 ILE A 755 12.092 9.051 23.707 1.00 24.33 C ATOM 1353 H ILE A 755 8.878 10.244 26.455 1.00 0.00 H ATOM 1354 N LYS A 756 11.917 7.482 27.586 1.00 20.30 N ATOM 1355 CA LYS A 756 13.275 7.565 28.126 1.00 20.07 C ATOM 1356 C LYS A 756 14.150 6.709 27.185 1.00 21.99 C ATOM 1357 O LYS A 756 13.897 5.517 27.028 1.00 20.06 O ATOM 1358 CB LYS A 756 13.386 6.977 29.557 1.00 22.46 C ATOM 1359 CG LYS A 756 12.472 7.590 30.626 1.00 28.10 C ATOM 1360 CD LYS A 756 13.136 8.749 31.315 1.00 27.01 C ATOM 1361 CE LYS A 756 12.376 9.174 32.548 1.00 34.36 C ATOM 1362 NZ LYS A 756 12.961 10.430 33.074 1.00 37.74 N ATOM 1363 HZ1 LYS A 756 13.960 10.271 33.317 1.00 0.00 H ATOM 1364 HZ2 LYS A 756 12.894 11.173 32.349 1.00 0.00 H ATOM 1365 HZ3 LYS A 756 12.439 10.725 33.924 1.00 0.00 H ATOM 1366 H LYS A 756 11.554 6.544 27.320 1.00 0.00 H ATOM 1367 N LEU A 757 15.139 7.316 26.551 1.00 18.55 N ATOM 1368 CA LEU A 757 16.111 6.609 25.725 1.00 18.16 C ATOM 1369 C LEU A 757 17.024 5.859 26.693 1.00 21.46 C ATOM 1370 O LEU A 757 17.630 6.448 27.597 1.00 22.03 O ATOM 1371 CB LEU A 757 16.866 7.586 24.797 1.00 18.62 C ATOM 1372 CG LEU A 757 18.039 7.012 23.947 1.00 23.44 C ATOM 1373 CD1 LEU A 757 17.556 5.895 22.986 1.00 22.78 C ATOM 1374 CD2 LEU A 757 18.708 8.111 23.150 1.00 26.55 C ATOM 1375 H LEU A 757 15.228 8.348 26.646 1.00 0.00 H ATOM 1376 N SER A 758 17.029 4.545 26.573 1.00 19.73 N ATOM 1377 CA SER A 758 17.790 3.635 27.423 1.00 19.72 C ATOM 1378 C SER A 758 19.301 3.818 27.181 1.00 22.80 C ATOM 1379 O SER A 758 19.718 4.391 26.164 1.00 20.87 O ATOM 1380 CB SER A 758 17.390 2.194 27.088 1.00 23.51 C ATOM 1381 OG SER A 758 18.275 1.224 27.625 1.00 38.13 O ATOM 1382 HG SER A 758 19.184 1.372 27.263 1.00 0.00 H ATOM 1383 H SER A 758 16.448 4.128 25.818 1.00 0.00 H ATOM 1384 N ASP A 759 20.120 3.276 28.092 1.00 20.40 N ATOM 1385 CA ASP A 759 21.569 3.220 27.865 1.00 21.22 C ATOM 1386 C ASP A 759 21.784 2.352 26.578 1.00 23.57 C ATOM 1387 O ASP A 759 21.006 1.419 26.324 1.00 21.21 O ATOM 1388 CB ASP A 759 22.276 2.545 29.060 1.00 24.03 C ATOM 1389 CG ASP A 759 21.971 1.074 29.190 1.00 33.80 C ATOM 1390 OD1 ASP A 759 20.959 0.738 29.846 1.00 35.73 O ATOM 1391 OD2 ASP A 759 22.703 0.252 28.569 1.00 27.29 O ATOM 1392 H ASP A 759 19.724 2.890 28.972 1.00 0.00 H ATOM 1393 N PRO A 760 22.848 2.598 25.793 1.00 20.98 N ATOM 1394 CA PRO A 760 23.058 1.789 24.582 1.00 21.04 C ATOM 1395 C PRO A 760 23.643 0.384 24.775 1.00 26.84 C ATOM 1396 O PRO A 760 23.886 -0.301 23.777 1.00 26.35 O ATOM 1397 CB PRO A 760 23.998 2.663 23.754 1.00 22.08 C ATOM 1398 CG PRO A 760 24.793 3.409 24.780 1.00 26.09 C ATOM 1399 CD PRO A 760 23.850 3.680 25.910 1.00 22.04 C ATOM 1400 N GLY A 761 23.876 -0.035 26.025 1.00 24.02 N ATOM 1401 CA GLY A 761 24.461 -1.349 26.331 1.00 23.32 C ATOM 1402 C GLY A 761 25.932 -1.446 25.940 1.00 24.10 C ATOM 1403 O GLY A 761 26.610 -0.431 25.853 1.00 23.90 O ATOM 1404 H GLY A 761 23.633 0.597 26.814 1.00 0.00 H ATOM 1405 N VAL A 762 26.428 -2.645 25.626 1.00 20.07 N ATOM 1406 CA VAL A 762 27.832 -2.785 25.189 1.00 20.65 C ATOM 1407 C VAL A 762 28.092 -1.885 23.976 1.00 25.68 C ATOM 1408 O VAL A 762 27.367 -1.963 22.976 1.00 25.11 O ATOM 1409 CB VAL A 762 28.193 -4.247 24.870 1.00 22.42 C ATOM 1410 CG1 VAL A 762 29.627 -4.365 24.376 1.00 22.38 C ATOM 1411 CG2 VAL A 762 27.957 -5.138 26.075 1.00 21.93 C ATOM 1412 H VAL A 762 25.821 -3.487 25.690 1.00 0.00 H ATOM 1413 N GLY A 763 29.106 -1.044 24.096 1.00 23.45 N ATOM 1414 CA GLY A 763 29.501 -0.112 23.049 1.00 24.64 C ATOM 1415 C GLY A 763 29.693 -0.769 21.707 1.00 29.58 C ATOM 1416 O GLY A 763 30.279 -1.851 21.606 1.00 27.56 O ATOM 1417 H GLY A 763 29.649 -1.049 24.983 1.00 0.00 H ATOM 1418 N LEU A 764 29.171 -0.113 20.662 1.00 28.67 N ATOM 1419 CA LEU A 764 29.227 -0.587 19.278 1.00 29.43 C ATOM 1420 C LEU A 764 30.640 -0.982 18.800 1.00 31.33 C ATOM 1421 O LEU A 764 30.783 -1.981 18.107 1.00 28.88 O ATOM 1422 CB LEU A 764 28.620 0.485 18.339 1.00 30.34 C ATOM 1423 CG LEU A 764 28.524 0.137 16.848 1.00 34.74 C ATOM 1424 CD1 LEU A 764 27.627 -1.072 16.618 1.00 34.82 C ATOM 1425 CD2 LEU A 764 28.039 1.326 16.065 1.00 37.80 C ATOM 1426 H LEU A 764 28.694 0.793 20.846 1.00 0.00 H ATOM 1427 N GLY A 765 31.663 -0.227 19.210 1.00 29.76 N ATOM 1428 CA GLY A 765 33.047 -0.498 18.824 1.00 30.34 C ATOM 1429 C GLY A 765 33.592 -1.840 19.273 1.00 34.55 C ATOM 1430 O GLY A 765 34.571 -2.319 18.698 1.00 34.30 O ATOM 1431 H GLY A 765 31.467 0.586 19.828 1.00 0.00 H ATOM 1432 N ALA A 766 32.951 -2.479 20.284 1.00 29.02 N ATOM 1433 CA ALA A 766 33.401 -3.771 20.812 1.00 29.01 C ATOM 1434 C ALA A 766 32.668 -4.985 20.237 1.00 31.97 C ATOM 1435 O ALA A 766 33.026 -6.128 20.549 1.00 31.43 O ATOM 1436 CB ALA A 766 33.295 -3.768 22.331 1.00 29.93 C ATOM 1437 H ALA A 766 32.108 -2.035 20.701 1.00 0.00 H ATOM 1438 N LEU A 767 31.656 -4.752 19.396 1.00 27.50 N ATOM 1439 CA LEU A 767 30.850 -5.831 18.826 1.00 27.52 C ATOM 1440 C LEU A 767 31.473 -6.466 17.592 1.00 32.27 C ATOM 1441 O LEU A 767 32.252 -5.813 16.891 1.00 32.27 O ATOM 1442 CB LEU A 767 29.425 -5.327 18.526 1.00 27.29 C ATOM 1443 CG LEU A 767 28.665 -4.702 19.727 1.00 32.47 C ATOM 1444 CD1 LEU A 767 27.257 -4.332 19.327 1.00 33.19 C ATOM 1445 CD2 LEU A 767 28.632 -5.647 20.947 1.00 34.71 C ATOM 1446 H LEU A 767 31.434 -3.769 19.138 1.00 0.00 H ATOM 1447 N SER A 768 31.106 -7.726 17.320 1.00 28.39 N ATOM 1448 CA SER A 768 31.586 -8.476 16.147 1.00 28.39 C ATOM 1449 C SER A 768 30.814 -8.023 14.897 1.00 30.52 C ATOM 1450 O SER A 768 29.737 -7.413 15.024 1.00 26.38 O ATOM 1451 CB SER A 768 31.373 -9.972 16.352 1.00 28.83 C ATOM 1452 OG SER A 768 29.988 -10.296 16.400 1.00 32.70 O ATOM 1453 HG SER A 768 29.563 -9.811 17.151 1.00 0.00 H ATOM 1454 H SER A 768 30.448 -8.199 17.972 1.00 0.00 H ATOM 1455 N ARG A 769 31.333 -8.371 13.700 1.00 28.23 N ATOM 1456 CA ARG A 769 30.669 -8.068 12.425 1.00 28.11 C ATOM 1457 C ARG A 769 29.266 -8.674 12.395 1.00 30.26 C ATOM 1458 O ARG A 769 28.335 -8.010 11.946 1.00 28.95 O ATOM 1459 CB ARG A 769 31.496 -8.529 11.205 1.00 28.83 C ATOM 1460 CG ARG A 769 30.912 -8.008 9.886 1.00 42.77 C ATOM 1461 CD ARG A 769 31.500 -8.606 8.612 1.00 44.90 C ATOM 1462 NE ARG A 769 30.848 -8.027 7.428 1.00 41.85 N ATOM 1463 CZ ARG A 769 31.211 -6.884 6.853 1.00 49.93 C ATOM 1464 NH1 ARG A 769 32.249 -6.199 7.317 1.00 35.74 N ATOM 1465 NH2 ARG A 769 30.549 -6.425 5.796 1.00 40.69 N ATOM 1466 HE ARG A 769 30.049 -8.547 7.012 1.00 0.00 H ATOM 1467 HH12 ARG A 769 32.528 -5.306 6.863 1.00 0.00 H ATOM 1468 HH11 ARG A 769 32.784 -6.555 8.135 1.00 0.00 H ATOM 1469 HH22 ARG A 769 30.837 -5.531 5.350 1.00 0.00 H ATOM 1470 HH21 ARG A 769 29.743 -6.960 5.415 1.00 0.00 H ATOM 1471 H ARG A 769 32.242 -8.875 13.680 1.00 0.00 H ATOM 1472 N GLU A 770 29.102 -9.908 12.934 1.00 29.50 N ATOM 1473 CA GLU A 770 27.809 -10.605 12.974 1.00 29.71 C ATOM 1474 C GLU A 770 26.792 -9.810 13.802 1.00 30.66 C ATOM 1475 O GLU A 770 25.639 -9.689 13.399 1.00 29.41 O ATOM 1476 CB GLU A 770 27.972 -12.025 13.532 1.00 31.68 C ATOM 1477 CG GLU A 770 26.768 -12.923 13.327 1.00 45.57 C ATOM 1478 H GLU A 770 29.933 -10.385 13.339 1.00 0.00 H ATOM 1479 N GLU A 771 27.232 -9.262 14.948 1.00 25.76 N ATOM 1480 CA GLU A 771 26.377 -8.425 15.807 1.00 24.28 C ATOM 1481 C GLU A 771 25.997 -7.117 15.126 1.00 25.06 C ATOM 1482 O GLU A 771 24.867 -6.645 15.301 1.00 26.27 O ATOM 1483 CB GLU A 771 27.056 -8.161 17.164 1.00 25.27 C ATOM 1484 CG GLU A 771 27.016 -9.400 18.040 1.00 31.78 C ATOM 1485 CD GLU A 771 27.939 -9.360 19.240 1.00 37.90 C ATOM 1486 OE1 GLU A 771 29.119 -8.971 19.086 1.00 33.19 O ATOM 1487 OE2 GLU A 771 27.480 -9.745 20.335 1.00 31.00 O ATOM 1488 H GLU A 771 28.215 -9.436 15.240 1.00 0.00 H ATOM 1489 N ARG A 772 26.927 -6.520 14.373 1.00 21.45 N ATOM 1490 CA ARG A 772 26.650 -5.280 13.646 1.00 22.56 C ATOM 1491 C ARG A 772 25.633 -5.543 12.518 1.00 26.75 C ATOM 1492 O ARG A 772 24.709 -4.751 12.337 1.00 23.55 O ATOM 1493 CB ARG A 772 27.936 -4.638 13.111 1.00 23.91 C ATOM 1494 CG ARG A 772 28.888 -4.213 14.226 1.00 27.80 C ATOM 1495 CD ARG A 772 29.970 -3.263 13.745 1.00 29.91 C ATOM 1496 NE ARG A 772 30.734 -3.802 12.615 1.00 35.39 N ATOM 1497 CZ ARG A 772 31.797 -4.590 12.728 1.00 49.68 C ATOM 1498 NH1 ARG A 772 32.434 -5.013 11.645 1.00 39.42 N ATOM 1499 NH2 ARG A 772 32.231 -4.964 13.927 1.00 33.42 N ATOM 1500 HE ARG A 772 30.421 -3.549 11.656 1.00 0.00 H ATOM 1501 HH12 ARG A 772 33.266 -5.630 11.739 1.00 0.00 H ATOM 1502 HH11 ARG A 772 32.102 -4.728 10.702 1.00 0.00 H ATOM 1503 HH22 ARG A 772 33.064 -5.581 14.009 1.00 0.00 H ATOM 1504 HH21 ARG A 772 31.738 -4.639 14.783 1.00 0.00 H ATOM 1505 H ARG A 772 27.872 -6.948 14.302 1.00 0.00 H ATOM 1506 N VAL A 773 25.775 -6.667 11.800 1.00 25.61 N ATOM 1507 CA VAL A 773 24.801 -7.075 10.763 1.00 26.89 C ATOM 1508 C VAL A 773 23.399 -7.272 11.407 1.00 29.61 C ATOM 1509 O VAL A 773 22.404 -6.821 10.833 1.00 28.00 O ATOM 1510 CB VAL A 773 25.299 -8.319 9.954 1.00 30.47 C ATOM 1511 CG1 VAL A 773 24.184 -8.946 9.111 1.00 30.10 C ATOM 1512 CG2 VAL A 773 26.472 -7.944 9.072 1.00 30.42 C ATOM 1513 H VAL A 773 26.600 -7.274 11.979 1.00 0.00 H ATOM 1514 N GLU A 774 23.328 -7.858 12.624 1.00 26.98 N ATOM 1515 CA GLU A 774 22.058 -8.045 13.363 1.00 26.93 C ATOM 1516 C GLU A 774 21.388 -6.713 13.687 1.00 29.16 C ATOM 1517 O GLU A 774 20.185 -6.680 13.928 1.00 30.21 O ATOM 1518 CB GLU A 774 22.260 -8.822 14.675 1.00 28.61 C ATOM 1519 CG GLU A 774 22.395 -10.331 14.501 1.00 43.30 C ATOM 1520 CD GLU A 774 22.794 -11.056 15.775 1.00 74.31 C ATOM 1521 OE1 GLU A 774 22.103 -10.878 16.805 1.00 63.11 O ATOM 1522 OE2 GLU A 774 23.799 -11.804 15.744 1.00 76.23 O ATOM 1523 H GLU A 774 24.209 -8.194 13.063 1.00 0.00 H ATOM 1524 N ARG A 775 22.160 -5.622 13.688 1.00 23.64 N ATOM 1525 CA ARG A 775 21.655 -4.279 14.003 1.00 22.64 C ATOM 1526 C ARG A 775 21.088 -3.543 12.823 1.00 24.65 C ATOM 1527 O ARG A 775 20.608 -2.430 12.989 1.00 22.24 O ATOM 1528 CB ARG A 775 22.753 -3.419 14.612 1.00 22.39 C ATOM 1529 CG ARG A 775 23.101 -3.859 15.956 1.00 37.43 C ATOM 1530 CD ARG A 775 23.424 -2.691 16.831 1.00 43.44 C ATOM 1531 NE ARG A 775 23.529 -3.276 18.144 1.00 41.01 N ATOM 1532 CZ ARG A 775 24.117 -2.730 19.185 1.00 37.05 C ATOM 1533 NH1 ARG A 775 24.662 -1.523 19.092 1.00 25.20 N ATOM 1534 NH2 ARG A 775 24.187 -3.390 20.323 1.00 31.56 N ATOM 1535 HE ARG A 775 23.101 -4.214 18.280 1.00 0.00 H ATOM 1536 HH12 ARG A 775 25.126 -1.097 19.920 1.00 0.00 H ATOM 1537 HH11 ARG A 775 24.625 -1.004 18.192 1.00 0.00 H ATOM 1538 HH22 ARG A 775 24.652 -2.958 21.147 1.00 0.00 H ATOM 1539 HH21 ARG A 775 23.777 -4.343 20.398 1.00 0.00 H ATOM 1540 H ARG A 775 23.168 -5.729 13.454 1.00 0.00 H ATOM 1541 N ILE A 776 21.227 -4.100 11.614 1.00 23.37 N ATOM 1542 CA ILE A 776 20.653 -3.507 10.396 1.00 21.38 C ATOM 1543 C ILE A 776 19.124 -3.657 10.517 1.00 25.07 C ATOM 1544 O ILE A 776 18.659 -4.713 10.953 1.00 25.31 O ATOM 1545 CB ILE A 776 21.226 -4.203 9.127 1.00 24.03 C ATOM 1546 CG1 ILE A 776 22.717 -3.869 8.980 1.00 23.62 C ATOM 1547 CG2 ILE A 776 20.407 -3.831 7.837 1.00 26.26 C ATOM 1548 CD1 ILE A 776 23.471 -4.704 7.906 1.00 29.34 C ATOM 1549 H ILE A 776 21.762 -4.988 11.532 1.00 0.00 H ATOM 1550 N PRO A 777 18.311 -2.617 10.252 1.00 21.65 N ATOM 1551 CA PRO A 777 18.628 -1.314 9.627 1.00 21.37 C ATOM 1552 C PRO A 777 18.981 -0.136 10.536 1.00 21.94 C ATOM 1553 O PRO A 777 19.135 0.984 10.020 1.00 18.59 O ATOM 1554 CB PRO A 777 17.325 -1.016 8.864 1.00 23.88 C ATOM 1555 CG PRO A 777 16.276 -1.490 9.856 1.00 27.07 C ATOM 1556 CD PRO A 777 16.851 -2.795 10.398 1.00 21.83 C ATOM 1557 N TRP A 778 19.105 -0.352 11.880 1.00 18.71 N ATOM 1558 CA TRP A 778 19.405 0.766 12.774 1.00 19.01 C ATOM 1559 C TRP A 778 20.863 1.172 12.681 1.00 22.86 C ATOM 1560 O TRP A 778 21.204 2.326 12.930 1.00 21.94 O ATOM 1561 CB TRP A 778 18.995 0.437 14.226 1.00 17.62 C ATOM 1562 CG TRP A 778 17.530 0.097 14.352 1.00 18.27 C ATOM 1563 CD1 TRP A 778 16.489 0.970 14.489 1.00 20.82 C ATOM 1564 CD2 TRP A 778 16.950 -1.215 14.286 1.00 18.76 C ATOM 1565 NE1 TRP A 778 15.301 0.267 14.612 1.00 21.27 N ATOM 1566 CE2 TRP A 778 15.561 -1.074 14.494 1.00 23.22 C ATOM 1567 CE3 TRP A 778 17.482 -2.513 14.146 1.00 21.32 C ATOM 1568 CZ2 TRP A 778 14.687 -2.178 14.511 1.00 24.14 C ATOM 1569 CZ3 TRP A 778 16.622 -3.609 14.192 1.00 23.42 C ATOM 1570 CH2 TRP A 778 15.242 -3.436 14.354 1.00 24.08 C ATOM 1571 HE1 TRP A 778 14.363 0.689 14.769 1.00 0.00 H ATOM 1572 H TRP A 778 18.986 -1.310 12.266 1.00 0.00 H ATOM 1573 N LEU A 779 21.722 0.219 12.327 1.00 20.12 N ATOM 1574 CA LEU A 779 23.152 0.451 12.197 1.00 20.45 C ATOM 1575 C LEU A 779 23.443 1.380 11.013 1.00 26.87 C ATOM 1576 O LEU A 779 22.947 1.131 9.924 1.00 26.31 O ATOM 1577 CB LEU A 779 23.834 -0.910 11.941 1.00 20.92 C ATOM 1578 CG LEU A 779 25.376 -0.856 11.873 1.00 25.47 C ATOM 1579 CD1 LEU A 779 25.971 -1.069 13.248 1.00 24.21 C ATOM 1580 CD2 LEU A 779 25.926 -1.923 10.912 1.00 27.93 C ATOM 1581 H LEU A 779 21.354 -0.735 12.135 1.00 0.00 H ATOM 1582 N ALA A 780 24.265 2.418 11.211 1.00 24.14 N ATOM 1583 CA ALA A 780 24.658 3.299 10.111 1.00 23.35 C ATOM 1584 C ALA A 780 25.572 2.481 9.162 1.00 27.59 C ATOM 1585 O ALA A 780 26.365 1.671 9.662 1.00 25.28 O ATOM 1586 CB ALA A 780 25.385 4.519 10.650 1.00 23.23 C ATOM 1587 H ALA A 780 24.632 2.602 12.167 1.00 0.00 H ATOM 1588 N PRO A 781 25.413 2.581 7.810 1.00 25.72 N ATOM 1589 CA PRO A 781 26.227 1.745 6.906 1.00 25.53 C ATOM 1590 C PRO A 781 27.738 1.895 7.042 1.00 29.11 C ATOM 1591 O PRO A 781 28.447 0.912 6.840 1.00 29.79 O ATOM 1592 CB PRO A 781 25.749 2.132 5.501 1.00 27.63 C ATOM 1593 CG PRO A 781 24.468 2.834 5.708 1.00 33.26 C ATOM 1594 CD PRO A 781 24.519 3.473 7.047 1.00 27.82 C ATOM 1595 N GLU A 782 28.221 3.090 7.410 1.00 27.79 N ATOM 1596 CA GLU A 782 29.658 3.332 7.612 1.00 28.19 C ATOM 1597 C GLU A 782 30.221 2.544 8.816 1.00 34.39 C ATOM 1598 O GLU A 782 31.438 2.404 8.932 1.00 33.55 O ATOM 1599 CB GLU A 782 29.973 4.838 7.727 1.00 29.50 C ATOM 1600 CG GLU A 782 29.378 5.552 8.939 1.00 34.27 C ATOM 1601 CD GLU A 782 27.970 6.107 8.783 1.00 38.17 C ATOM 1602 OE1 GLU A 782 27.234 5.654 7.873 1.00 33.04 O ATOM 1603 OE2 GLU A 782 27.600 6.997 9.583 1.00 30.82 O ATOM 1604 H GLU A 782 27.555 3.875 7.558 1.00 0.00 H ATOM 1605 N CYS A 783 29.330 2.009 9.693 1.00 31.21 N ATOM 1606 CA CYS A 783 29.709 1.223 10.876 1.00 30.10 C ATOM 1607 C CYS A 783 29.806 -0.238 10.554 1.00 33.10 C ATOM 1608 O CYS A 783 30.264 -1.008 11.398 1.00 30.86 O ATOM 1609 CB CYS A 783 28.742 1.473 12.032 1.00 30.25 C ATOM 1610 SG CYS A 783 28.656 3.205 12.543 1.00 34.68 S ATOM 1611 H CYS A 783 28.317 2.166 9.516 1.00 0.00 H ATOM 1612 N LEU A 784 29.306 -0.649 9.371 1.00 30.73 N ATOM 1613 CA LEU A 784 29.344 -2.055 8.987 1.00 30.94 C ATOM 1614 C LEU A 784 30.805 -2.531 8.823 1.00 37.63 C ATOM 1615 O LEU A 784 31.135 -3.528 9.456 1.00 36.00 O ATOM 1616 CB LEU A 784 28.452 -2.353 7.758 1.00 30.82 C ATOM 1617 CG LEU A 784 28.441 -3.779 7.226 1.00 35.72 C ATOM 1618 CD1 LEU A 784 28.009 -4.781 8.308 1.00 34.98 C ATOM 1619 CD2 LEU A 784 27.546 -3.888 6.001 1.00 38.58 C ATOM 1620 H LEU A 784 28.887 0.048 8.723 1.00 0.00 H ATOM 1621 N PRO A 785 31.716 -1.814 8.105 1.00 38.28 N ATOM 1622 CA PRO A 785 33.118 -2.287 8.048 1.00 44.66 C ATOM 1623 C PRO A 785 33.905 -1.860 9.279 1.00 79.99 C ATOM 1624 O PRO A 785 34.310 -2.712 10.059 1.00 62.13 O ATOM 1625 CB PRO A 785 33.665 -1.641 6.773 1.00 45.68 C ATOM 1626 CG PRO A 785 32.852 -0.408 6.583 1.00 48.24 C ATOM 1627 CD PRO A 785 31.533 -0.579 7.300 1.00 42.03 C TER 1628 PRO A 785 ATOM 1629 N SER A 792 31.343 8.591 15.502 1.00 41.89 N ATOM 1630 CA SER A 792 30.792 9.907 15.155 1.00 40.48 C ATOM 1631 C SER A 792 29.303 10.025 15.495 1.00 40.20 C ATOM 1632 O SER A 792 28.558 9.055 15.338 1.00 38.67 O ATOM 1633 CB SER A 792 30.985 10.177 13.667 1.00 44.72 C ATOM 1634 OG SER A 792 30.394 11.411 13.287 1.00 53.62 O ATOM 1635 HG SER A 792 30.535 11.559 12.318 1.00 0.00 H ATOM 1636 HN3 SER A 792 30.833 7.853 14.975 1.00 0.00 H ATOM 1637 HN2 SER A 792 31.232 8.429 16.523 1.00 0.00 H ATOM 1638 HN1 SER A 792 32.352 8.562 15.252 1.00 0.00 H ATOM 1639 N THR A 793 28.863 11.246 15.865 1.00 35.16 N ATOM 1640 CA THR A 793 27.459 11.560 16.161 1.00 34.92 C ATOM 1641 C THR A 793 26.589 11.417 14.909 1.00 36.86 C ATOM 1642 O THR A 793 25.374 11.228 15.041 1.00 36.15 O ATOM 1643 CB THR A 793 27.284 12.914 16.875 1.00 42.25 C ATOM 1644 OG1 THR A 793 27.766 13.946 16.031 1.00 43.62 O ATOM 1645 CG2 THR A 793 27.979 12.971 18.253 1.00 38.93 C ATOM 1646 HG1 THR A 793 27.656 14.819 16.484 1.00 0.00 H ATOM 1647 H THR A 793 29.562 12.012 15.946 1.00 0.00 H ATOM 1648 N ALA A 794 27.213 11.415 13.700 1.00 30.85 N ATOM 1649 CA ALA A 794 26.495 11.196 12.436 1.00 30.23 C ATOM 1650 C ALA A 794 25.795 9.819 12.432 1.00 30.78 C ATOM 1651 O ALA A 794 24.739 9.698 11.828 1.00 30.53 O ATOM 1652 CB ALA A 794 27.443 11.306 11.245 1.00 31.45 C ATOM 1653 H ALA A 794 28.240 11.575 13.669 1.00 0.00 H ATOM 1654 N MET A 795 26.350 8.790 13.114 1.00 26.27 N ATOM 1655 CA MET A 795 25.681 7.475 13.133 1.00 25.75 C ATOM 1656 C MET A 795 24.295 7.496 13.801 1.00 26.39 C ATOM 1657 O MET A 795 23.420 6.730 13.384 1.00 25.48 O ATOM 1658 CB MET A 795 26.555 6.368 13.740 1.00 28.73 C ATOM 1659 CG MET A 795 26.601 6.384 15.279 1.00 33.36 C ATOM 1660 SD MET A 795 27.441 4.940 15.995 1.00 38.90 S ATOM 1661 CE MET A 795 29.158 5.344 15.597 1.00 35.81 C ATOM 1662 H MET A 795 27.246 8.926 13.624 1.00 0.00 H ATOM 1663 N ASP A 796 24.096 8.342 14.838 1.00 21.59 N ATOM 1664 CA ASP A 796 22.806 8.444 15.542 1.00 21.31 C ATOM 1665 C ASP A 796 21.745 9.109 14.693 1.00 24.87 C ATOM 1666 O ASP A 796 20.562 8.923 14.953 1.00 23.16 O ATOM 1667 CB ASP A 796 22.949 9.163 16.887 1.00 22.49 C ATOM 1668 CG ASP A 796 23.709 8.367 17.931 1.00 30.47 C ATOM 1669 OD1 ASP A 796 23.734 7.109 17.831 1.00 26.83 O ATOM 1670 OD2 ASP A 796 24.244 8.984 18.856 1.00 35.09 O ATOM 1671 H ASP A 796 24.885 8.944 15.150 1.00 0.00 H ATOM 1672 N LYS A 797 22.156 9.880 13.660 1.00 21.67 N ATOM 1673 CA LYS A 797 21.185 10.497 12.744 1.00 20.75 C ATOM 1674 C LYS A 797 20.554 9.373 11.909 1.00 23.79 C ATOM 1675 O LYS A 797 19.344 9.390 11.691 1.00 23.46 O ATOM 1676 CB LYS A 797 21.870 11.562 11.860 1.00 23.86 C ATOM 1677 CG LYS A 797 22.166 12.841 12.646 1.00 28.32 C ATOM 1678 CD LYS A 797 23.483 13.474 12.283 1.00 40.71 C ATOM 1679 CE LYS A 797 23.737 14.697 13.135 1.00 38.83 C ATOM 1680 H LYS A 797 23.173 10.039 13.512 1.00 0.00 H ATOM 1681 N TRP A 798 21.362 8.375 11.476 1.00 20.46 N ATOM 1682 CA TRP A 798 20.839 7.213 10.743 1.00 20.59 C ATOM 1683 C TRP A 798 19.928 6.395 11.716 1.00 23.89 C ATOM 1684 O TRP A 798 18.810 6.072 11.342 1.00 22.98 O ATOM 1685 CB TRP A 798 21.972 6.336 10.158 1.00 20.18 C ATOM 1686 CG TRP A 798 21.486 5.126 9.414 1.00 21.97 C ATOM 1687 CD1 TRP A 798 20.936 3.996 9.957 1.00 24.69 C ATOM 1688 CD2 TRP A 798 21.422 4.958 7.982 1.00 22.16 C ATOM 1689 NE1 TRP A 798 20.557 3.131 8.960 1.00 24.79 N ATOM 1690 CE2 TRP A 798 20.868 3.684 7.739 1.00 26.47 C ATOM 1691 CE3 TRP A 798 21.840 5.741 6.881 1.00 24.12 C ATOM 1692 CZ2 TRP A 798 20.715 3.165 6.442 1.00 26.28 C ATOM 1693 CZ3 TRP A 798 21.695 5.221 5.594 1.00 26.38 C ATOM 1694 CH2 TRP A 798 21.123 3.954 5.386 1.00 27.07 C ATOM 1695 HE1 TRP A 798 20.106 2.205 9.105 1.00 0.00 H ATOM 1696 H TRP A 798 22.382 8.433 11.668 1.00 0.00 H ATOM 1697 N GLY A 799 20.421 6.067 12.932 1.00 21.22 N ATOM 1698 CA GLY A 799 19.652 5.312 13.936 1.00 20.07 C ATOM 1699 C GLY A 799 18.310 5.976 14.206 1.00 22.25 C ATOM 1700 O GLY A 799 17.272 5.314 14.231 1.00 19.47 O ATOM 1701 H GLY A 799 21.390 6.362 13.170 1.00 0.00 H ATOM 1702 N PHE A 800 18.309 7.310 14.314 1.00 18.78 N ATOM 1703 CA PHE A 800 17.094 8.105 14.477 1.00 17.93 C ATOM 1704 C PHE A 800 16.130 7.908 13.306 1.00 21.63 C ATOM 1705 O PHE A 800 14.943 7.655 13.545 1.00 22.95 O ATOM 1706 CB PHE A 800 17.436 9.598 14.640 1.00 19.65 C ATOM 1707 CG PHE A 800 16.214 10.477 14.776 1.00 20.30 C ATOM 1708 CD1 PHE A 800 15.534 10.567 15.987 1.00 23.35 C ATOM 1709 CD2 PHE A 800 15.739 11.207 13.692 1.00 21.01 C ATOM 1710 CE1 PHE A 800 14.410 11.387 16.119 1.00 23.45 C ATOM 1711 CE2 PHE A 800 14.610 12.022 13.824 1.00 24.27 C ATOM 1712 CZ PHE A 800 13.950 12.103 15.035 1.00 22.08 C ATOM 1713 H PHE A 800 19.222 7.807 14.280 1.00 0.00 H ATOM 1714 N GLY A 801 16.632 8.029 12.058 1.00 18.17 N ATOM 1715 CA GLY A 801 15.816 7.850 10.852 1.00 17.47 C ATOM 1716 C GLY A 801 15.193 6.467 10.766 1.00 21.44 C ATOM 1717 O GLY A 801 14.003 6.330 10.468 1.00 20.60 O ATOM 1718 H GLY A 801 17.640 8.259 11.947 1.00 0.00 H ATOM 1719 N ALA A 802 15.991 5.422 11.055 1.00 19.80 N ATOM 1720 CA ALA A 802 15.514 4.030 11.026 1.00 20.26 C ATOM 1721 C ALA A 802 14.452 3.807 12.117 1.00 20.89 C ATOM 1722 O ALA A 802 13.487 3.089 11.877 1.00 19.69 O ATOM 1723 CB ALA A 802 16.681 3.069 11.226 1.00 20.93 C ATOM 1724 H ALA A 802 16.983 5.605 11.309 1.00 0.00 H ATOM 1725 N THR A 803 14.623 4.452 13.292 1.00 19.11 N ATOM 1726 CA THR A 803 13.660 4.378 14.406 1.00 19.11 C ATOM 1727 C THR A 803 12.345 5.081 14.010 1.00 24.23 C ATOM 1728 O THR A 803 11.269 4.563 14.336 1.00 21.67 O ATOM 1729 CB THR A 803 14.275 4.904 15.716 1.00 25.13 C ATOM 1730 OG1 THR A 803 15.469 4.148 15.971 1.00 24.63 O ATOM 1731 CG2 THR A 803 13.325 4.757 16.899 1.00 20.93 C ATOM 1732 HG1 THR A 803 16.102 4.269 15.219 1.00 0.00 H ATOM 1733 H THR A 803 15.478 5.031 13.417 1.00 0.00 H ATOM 1734 N LEU A 804 12.415 6.211 13.238 1.00 20.41 N ATOM 1735 CA LEU A 804 11.179 6.843 12.757 1.00 20.38 C ATOM 1736 C LEU A 804 10.435 5.904 11.841 1.00 22.40 C ATOM 1737 O LEU A 804 9.208 5.865 11.906 1.00 21.67 O ATOM 1738 CB LEU A 804 11.428 8.168 12.001 1.00 21.68 C ATOM 1739 CG LEU A 804 12.014 9.329 12.761 1.00 28.83 C ATOM 1740 CD1 LEU A 804 11.882 10.616 11.928 1.00 29.59 C ATOM 1741 CD2 LEU A 804 11.340 9.511 14.139 1.00 30.48 C ATOM 1742 H LEU A 804 13.340 6.620 12.994 1.00 0.00 H ATOM 1743 N LEU A 805 11.144 5.141 10.978 1.00 19.93 N ATOM 1744 CA LEU A 805 10.469 4.156 10.104 1.00 20.13 C ATOM 1745 C LEU A 805 9.794 3.073 10.945 1.00 22.67 C ATOM 1746 O LEU A 805 8.630 2.738 10.720 1.00 21.62 O ATOM 1747 CB LEU A 805 11.457 3.488 9.119 1.00 20.25 C ATOM 1748 CG LEU A 805 12.080 4.369 8.022 1.00 24.53 C ATOM 1749 CD1 LEU A 805 12.836 3.492 7.018 1.00 22.90 C ATOM 1750 CD2 LEU A 805 11.011 5.136 7.256 1.00 26.11 C ATOM 1751 H LEU A 805 12.177 5.248 10.928 1.00 0.00 H ATOM 1752 N GLU A 806 10.532 2.528 11.922 1.00 20.74 N ATOM 1753 CA GLU A 806 10.065 1.486 12.829 1.00 19.12 C ATOM 1754 C GLU A 806 8.796 1.958 13.557 1.00 21.80 C ATOM 1755 O GLU A 806 7.839 1.188 13.664 1.00 20.47 O ATOM 1756 CB GLU A 806 11.198 1.178 13.833 1.00 20.83 C ATOM 1757 CG GLU A 806 10.856 0.140 14.883 1.00 23.84 C ATOM 1758 CD GLU A 806 11.958 -0.053 15.915 1.00 31.00 C ATOM 1759 OE1 GLU A 806 12.872 0.801 16.022 1.00 22.50 O ATOM 1760 OE2 GLU A 806 11.879 -1.059 16.647 1.00 26.74 O ATOM 1761 H GLU A 806 11.506 2.872 12.042 1.00 0.00 H ATOM 1762 N ILE A 807 8.775 3.216 14.038 1.00 18.86 N ATOM 1763 CA ILE A 807 7.615 3.777 14.744 1.00 19.49 C ATOM 1764 C ILE A 807 6.439 3.924 13.764 1.00 25.16 C ATOM 1765 O ILE A 807 5.305 3.531 14.087 1.00 24.31 O ATOM 1766 CB ILE A 807 7.965 5.126 15.427 1.00 22.24 C ATOM 1767 CG1 ILE A 807 8.940 4.922 16.624 1.00 22.29 C ATOM 1768 CG2 ILE A 807 6.697 5.844 15.861 1.00 23.00 C ATOM 1769 CD1 ILE A 807 9.696 6.198 17.060 1.00 22.02 C ATOM 1770 H ILE A 807 9.615 3.815 13.904 1.00 0.00 H ATOM 1771 N CYS A 808 6.711 4.495 12.576 1.00 24.01 N ATOM 1772 CA CYS A 808 5.693 4.656 11.533 1.00 24.84 C ATOM 1773 C CYS A 808 5.061 3.309 11.187 1.00 26.68 C ATOM 1774 O CYS A 808 3.842 3.226 11.061 1.00 26.14 O ATOM 1775 CB CYS A 808 6.285 5.324 10.300 1.00 26.37 C ATOM 1776 SG CYS A 808 6.704 7.065 10.538 1.00 30.88 S ATOM 1777 H CYS A 808 7.677 4.834 12.391 1.00 0.00 H ATOM 1778 N PHE A 809 5.875 2.245 11.108 1.00 23.49 N ATOM 1779 CA PHE A 809 5.390 0.901 10.783 1.00 23.94 C ATOM 1780 C PHE A 809 4.922 0.096 12.005 1.00 24.72 C ATOM 1781 O PHE A 809 4.897 -1.126 11.940 1.00 23.24 O ATOM 1782 CB PHE A 809 6.448 0.114 9.972 1.00 26.97 C ATOM 1783 CG PHE A 809 6.890 0.765 8.672 1.00 29.98 C ATOM 1784 CD1 PHE A 809 5.962 1.352 7.816 1.00 34.68 C ATOM 1785 CD2 PHE A 809 8.213 0.699 8.259 1.00 32.91 C ATOM 1786 CE1 PHE A 809 6.366 1.944 6.618 1.00 36.22 C ATOM 1787 CE2 PHE A 809 8.615 1.292 7.058 1.00 36.72 C ATOM 1788 CZ PHE A 809 7.688 1.916 6.250 1.00 34.63 C ATOM 1789 H PHE A 809 6.891 2.380 11.285 1.00 0.00 H ATOM 1790 N ASP A 810 4.526 0.770 13.102 1.00 21.14 N ATOM 1791 CA ASP A 810 4.030 0.118 14.338 1.00 20.10 C ATOM 1792 C ASP A 810 4.965 -0.994 14.874 1.00 22.48 C ATOM 1793 O ASP A 810 4.507 -2.085 15.242 1.00 20.41 O ATOM 1794 CB ASP A 810 2.584 -0.398 14.151 1.00 20.30 C ATOM 1795 CG ASP A 810 1.547 0.698 14.004 1.00 29.70 C ATOM 1796 OD1 ASP A 810 1.832 1.842 14.403 1.00 29.77 O ATOM 1797 OD2 ASP A 810 0.443 0.406 13.525 1.00 30.67 O ATOM 1798 H ASP A 810 4.571 1.809 13.081 1.00 0.00 H ATOM 1799 N GLY A 811 6.265 -0.689 14.936 1.00 20.24 N ATOM 1800 CA GLY A 811 7.261 -1.613 15.474 1.00 20.63 C ATOM 1801 C GLY A 811 7.714 -2.704 14.525 1.00 28.70 C ATOM 1802 O GLY A 811 8.362 -3.650 14.951 1.00 29.29 O ATOM 1803 H GLY A 811 6.579 0.240 14.589 1.00 0.00 H ATOM 1804 N GLU A 812 7.381 -2.591 13.237 1.00 28.23 N ATOM 1805 CA GLU A 812 7.827 -3.550 12.235 1.00 29.43 C ATOM 1806 C GLU A 812 8.915 -2.861 11.399 1.00 34.69 C ATOM 1807 O GLU A 812 8.616 -2.206 10.404 1.00 35.34 O ATOM 1808 CB GLU A 812 6.654 -4.037 11.369 1.00 31.43 C ATOM 1809 CG GLU A 812 5.810 -5.099 12.053 1.00 46.78 C ATOM 1810 H GLU A 812 6.784 -1.793 12.939 1.00 0.00 H ATOM 1811 N ALA A 813 10.175 -2.980 11.821 1.00 31.53 N ATOM 1812 CA ALA A 813 11.270 -2.327 11.094 1.00 30.82 C ATOM 1813 C ALA A 813 11.556 -2.997 9.745 1.00 33.49 C ATOM 1814 O ALA A 813 11.471 -4.222 9.648 1.00 33.73 O ATOM 1815 CB ALA A 813 12.520 -2.297 11.934 1.00 31.14 C ATOM 1816 H ALA A 813 10.383 -3.540 12.672 1.00 0.00 H ATOM 1817 N PRO A 814 11.919 -2.225 8.689 1.00 30.46 N ATOM 1818 CA PRO A 814 12.257 -2.867 7.397 1.00 29.24 C ATOM 1819 C PRO A 814 13.452 -3.797 7.551 1.00 28.68 C ATOM 1820 O PRO A 814 14.269 -3.605 8.466 1.00 26.03 O ATOM 1821 CB PRO A 814 12.629 -1.684 6.501 1.00 32.05 C ATOM 1822 CG PRO A 814 12.070 -0.476 7.165 1.00 37.30 C ATOM 1823 CD PRO A 814 12.108 -0.759 8.627 1.00 32.69 C ATOM 1824 N LEU A 815 13.531 -4.843 6.699 1.00 24.96 N ATOM 1825 CA LEU A 815 14.605 -5.849 6.713 1.00 33.57 C ATOM 1826 C LEU A 815 14.592 -6.710 7.964 1.00 59.98 C ATOM 1827 O LEU A 815 15.304 -7.705 8.006 1.00 40.54 O ATOM 1828 CB LEU A 815 16.007 -5.231 6.494 1.00 33.26 C ATOM 1829 CG LEU A 815 16.173 -4.238 5.350 1.00 37.29 C ATOM 1830 CD1 LEU A 815 17.549 -3.610 5.394 1.00 37.45 C ATOM 1831 CD2 LEU A 815 15.939 -4.904 4.002 1.00 38.53 C ATOM 1832 H LEU A 815 12.782 -4.944 5.985 1.00 0.00 H TER 1833 LEU A 815 ATOM 1834 N ARG A 818 14.504 -10.749 7.758 1.00 43.23 N ATOM 1835 CA ARG A 818 15.404 -11.194 6.696 1.00 42.27 C ATOM 1836 C ARG A 818 16.667 -11.833 7.283 1.00 44.27 C ATOM 1837 O ARG A 818 16.990 -11.616 8.454 1.00 44.24 O ATOM 1838 CB ARG A 818 15.742 -10.045 5.723 1.00 40.20 C ATOM 1839 HN3 ARG A 818 14.990 -10.047 8.351 1.00 0.00 H ATOM 1840 HN2 ARG A 818 14.227 -11.565 8.341 1.00 0.00 H ATOM 1841 HN1 ARG A 818 13.656 -10.320 7.335 1.00 0.00 H ATOM 1842 N SER A 819 17.350 -12.655 6.479 1.00 39.49 N ATOM 1843 CA SER A 819 18.569 -13.364 6.882 1.00 38.55 C ATOM 1844 C SER A 819 19.759 -12.391 7.028 1.00 41.71 C ATOM 1845 O SER A 819 19.755 -11.345 6.372 1.00 39.26 O ATOM 1846 CB SER A 819 18.910 -14.439 5.856 1.00 39.47 C ATOM 1847 OG SER A 819 19.503 -13.853 4.710 1.00 39.13 O ATOM 1848 HG SER A 819 20.333 -13.382 4.974 1.00 0.00 H ATOM 1849 H SER A 819 16.996 -12.800 5.512 1.00 0.00 H ATOM 1850 N PRO A 820 20.815 -12.734 7.811 1.00 38.94 N ATOM 1851 CA PRO A 820 21.971 -11.823 7.920 1.00 38.24 C ATOM 1852 C PRO A 820 22.635 -11.509 6.578 1.00 39.54 C ATOM 1853 O PRO A 820 23.089 -10.386 6.367 1.00 37.56 O ATOM 1854 CB PRO A 820 22.920 -12.579 8.868 1.00 39.92 C ATOM 1855 CG PRO A 820 22.029 -13.442 9.669 1.00 44.37 C ATOM 1856 CD PRO A 820 20.997 -13.912 8.688 1.00 40.22 C ATOM 1857 N SER A 821 22.659 -12.494 5.655 1.00 36.57 N ATOM 1858 CA SER A 821 23.248 -12.328 4.328 1.00 35.74 C ATOM 1859 C SER A 821 22.472 -11.314 3.481 1.00 36.08 C ATOM 1860 O SER A 821 23.086 -10.473 2.832 1.00 35.75 O ATOM 1861 CB SER A 821 23.337 -13.669 3.609 1.00 39.80 C ATOM 1862 OG SER A 821 24.260 -13.534 2.543 1.00 54.53 O ATOM 1863 HG SER A 821 23.943 -12.832 1.921 1.00 0.00 H ATOM 1864 H SER A 821 22.239 -13.413 5.900 1.00 0.00 H ATOM 1865 N GLU A 822 21.137 -11.359 3.532 1.00 32.20 N ATOM 1866 CA GLU A 822 20.265 -10.420 2.812 1.00 32.09 C ATOM 1867 C GLU A 822 20.423 -8.981 3.358 1.00 35.04 C ATOM 1868 O GLU A 822 20.497 -8.042 2.576 1.00 33.74 O ATOM 1869 CB GLU A 822 18.807 -10.877 2.895 1.00 33.87 C ATOM 1870 CG GLU A 822 18.506 -12.092 2.030 1.00 49.65 C ATOM 1871 H GLU A 822 20.691 -12.098 4.112 1.00 0.00 H ATOM 1872 N LYS A 823 20.531 -8.829 4.707 1.00 31.29 N ATOM 1873 CA LYS A 823 20.721 -7.529 5.362 1.00 30.45 C ATOM 1874 C LYS A 823 22.068 -6.915 4.998 1.00 32.23 C ATOM 1875 O LYS A 823 22.134 -5.738 4.639 1.00 30.65 O ATOM 1876 CB LYS A 823 20.601 -7.671 6.887 1.00 31.20 C ATOM 1877 CG LYS A 823 19.182 -7.926 7.368 1.00 32.47 C ATOM 1878 CD LYS A 823 19.018 -7.593 8.850 1.00 43.59 C ATOM 1879 CE LYS A 823 19.199 -8.776 9.757 1.00 48.81 C ATOM 1880 NZ LYS A 823 18.818 -8.442 11.155 1.00 61.48 N ATOM 1881 HZ1 LYS A 823 19.416 -7.664 11.499 1.00 0.00 H ATOM 1882 HZ2 LYS A 823 17.820 -8.152 11.181 1.00 0.00 H ATOM 1883 HZ3 LYS A 823 18.953 -9.278 11.759 1.00 0.00 H ATOM 1884 H LYS A 823 20.476 -9.678 5.305 1.00 0.00 H ATOM 1885 N GLU A 824 23.147 -7.721 5.080 1.00 29.96 N ATOM 1886 CA GLU A 824 24.486 -7.267 4.733 1.00 29.96 C ATOM 1887 C GLU A 824 24.544 -6.899 3.238 1.00 34.92 C ATOM 1888 O GLU A 824 25.129 -5.866 2.896 1.00 33.14 O ATOM 1889 CB GLU A 824 25.500 -8.372 5.052 1.00 31.86 C ATOM 1890 CG GLU A 824 26.949 -7.942 4.933 1.00 48.30 C ATOM 1891 CD GLU A 824 27.949 -9.030 5.275 1.00 68.74 C ATOM 1892 OE1 GLU A 824 27.522 -10.160 5.608 1.00 57.96 O ATOM 1893 OE2 GLU A 824 29.167 -8.753 5.196 1.00 72.20 O ATOM 1894 H GLU A 824 23.018 -8.701 5.402 1.00 0.00 H ATOM 1895 N HIS A 825 23.929 -7.742 2.353 1.00 33.37 N ATOM 1896 CA HIS A 825 23.898 -7.474 0.900 1.00 34.93 C ATOM 1897 C HIS A 825 23.174 -6.156 0.602 1.00 35.33 C ATOM 1898 O HIS A 825 23.617 -5.392 -0.263 1.00 34.87 O ATOM 1899 CB HIS A 825 23.244 -8.633 0.121 1.00 37.84 C ATOM 1900 CG HIS A 825 24.050 -9.902 0.029 1.00 42.98 C ATOM 1901 ND1 HIS A 825 25.421 -9.928 0.279 1.00 45.70 N ATOM 1902 CD2 HIS A 825 23.646 -11.151 -0.307 1.00 45.97 C ATOM 1903 CE1 HIS A 825 25.795 -11.187 0.099 1.00 45.60 C ATOM 1904 NE2 HIS A 825 24.763 -11.960 -0.257 1.00 45.93 N ATOM 1905 H HIS A 825 23.468 -8.601 2.715 1.00 0.00 H ATOM 1906 N PHE A 826 22.078 -5.867 1.350 1.00 29.49 N ATOM 1907 CA PHE A 826 21.329 -4.602 1.211 1.00 27.57 C ATOM 1908 C PHE A 826 22.240 -3.378 1.355 1.00 29.79 C ATOM 1909 O PHE A 826 22.161 -2.470 0.536 1.00 29.29 O ATOM 1910 CB PHE A 826 20.177 -4.547 2.238 1.00 28.60 C ATOM 1911 CG PHE A 826 19.122 -3.505 1.967 1.00 28.06 C ATOM 1912 CD1 PHE A 826 19.234 -2.226 2.493 1.00 28.54 C ATOM 1913 CD2 PHE A 826 17.993 -3.813 1.211 1.00 29.18 C ATOM 1914 CE1 PHE A 826 18.231 -1.266 2.270 1.00 28.65 C ATOM 1915 CE2 PHE A 826 16.992 -2.855 0.995 1.00 30.16 C ATOM 1916 CZ PHE A 826 17.117 -1.593 1.535 1.00 26.84 C ATOM 1917 H PHE A 826 21.753 -6.565 2.049 1.00 0.00 H ATOM 1918 N TYR A 827 23.098 -3.332 2.410 1.00 25.83 N ATOM 1919 CA TYR A 827 24.024 -2.214 2.645 1.00 24.56 C ATOM 1920 C TYR A 827 25.166 -2.226 1.627 1.00 27.67 C ATOM 1921 O TYR A 827 25.572 -1.162 1.171 1.00 26.27 O ATOM 1922 CB TYR A 827 24.614 -2.274 4.080 1.00 25.74 C ATOM 1923 CG TYR A 827 23.750 -1.648 5.166 1.00 24.94 C ATOM 1924 CD1 TYR A 827 22.385 -1.423 4.964 1.00 26.99 C ATOM 1925 CD2 TYR A 827 24.294 -1.287 6.399 1.00 24.78 C ATOM 1926 CE1 TYR A 827 21.592 -0.828 5.949 1.00 26.31 C ATOM 1927 CE2 TYR A 827 23.509 -0.700 7.395 1.00 24.64 C ATOM 1928 CZ TYR A 827 22.155 -0.493 7.173 1.00 28.87 C ATOM 1929 OH TYR A 827 21.368 0.036 8.165 1.00 27.15 O ATOM 1930 HH TYR A 827 21.709 0.932 8.413 1.00 0.00 H ATOM 1931 H TYR A 827 23.099 -4.125 3.082 1.00 0.00 H ATOM 1932 N GLN A 828 25.723 -3.423 1.327 1.00 26.76 N ATOM 1933 CA GLN A 828 26.849 -3.564 0.379 1.00 27.93 C ATOM 1934 C GLN A 828 26.458 -3.080 -1.016 1.00 35.15 C ATOM 1935 O GLN A 828 27.241 -2.394 -1.663 1.00 36.41 O ATOM 1936 CB GLN A 828 27.382 -5.003 0.349 1.00 29.14 C ATOM 1937 CG GLN A 828 28.225 -5.320 1.598 1.00 39.01 C ATOM 1938 CD GLN A 828 28.734 -6.738 1.657 1.00 54.34 C ATOM 1939 OE1 GLN A 828 28.124 -7.683 1.131 1.00 47.39 O ATOM 1940 NE2 GLN A 828 29.857 -6.915 2.336 1.00 46.91 N ATOM 1941 HE22 GLN A 828 30.341 -6.099 2.763 1.00 0.00 H ATOM 1942 HE21 GLN A 828 30.255 -7.870 2.442 1.00 0.00 H ATOM 1943 H GLN A 828 25.344 -4.278 1.782 1.00 0.00 H ATOM 1944 N ARG A 829 25.202 -3.325 -1.410 1.00 31.88 N ATOM 1945 CA ARG A 829 24.665 -2.884 -2.700 1.00 30.60 C ATOM 1946 C ARG A 829 24.110 -1.468 -2.621 1.00 32.51 C ATOM 1947 O ARG A 829 23.618 -0.960 -3.620 1.00 32.86 O ATOM 1948 CB ARG A 829 23.651 -3.902 -3.246 1.00 31.27 C ATOM 1949 CG ARG A 829 24.290 -5.257 -3.531 1.00 37.90 C ATOM 1950 CD ARG A 829 23.275 -6.373 -3.554 1.00 46.31 C ATOM 1951 NE ARG A 829 23.928 -7.678 -3.463 1.00 48.10 N ATOM 1952 CZ ARG A 829 23.283 -8.839 -3.509 1.00 65.75 C ATOM 1953 NH1 ARG A 829 21.964 -8.870 -3.662 1.00 52.26 N ATOM 1954 NH2 ARG A 829 23.952 -9.980 -3.402 1.00 55.51 N ATOM 1955 HE ARG A 829 24.962 -7.699 -3.356 1.00 0.00 H ATOM 1956 HH12 ARG A 829 21.466 -9.782 -3.697 1.00 0.00 H ATOM 1957 HH11 ARG A 829 21.429 -7.982 -3.747 1.00 0.00 H ATOM 1958 HH22 ARG A 829 23.443 -10.886 -3.439 1.00 0.00 H ATOM 1959 HH21 ARG A 829 24.985 -9.968 -3.282 1.00 0.00 H ATOM 1960 H ARG A 829 24.577 -3.854 -0.769 1.00 0.00 H ATOM 1961 N GLN A 830 24.239 -0.792 -1.437 1.00 27.52 N ATOM 1962 CA GLN A 830 23.845 0.615 -1.193 1.00 26.03 C ATOM 1963 C GLN A 830 22.328 0.911 -1.337 1.00 27.84 C ATOM 1964 O GLN A 830 21.942 2.065 -1.551 1.00 25.10 O ATOM 1965 CB GLN A 830 24.658 1.578 -2.089 1.00 27.62 C ATOM 1966 CG GLN A 830 26.181 1.324 -2.130 1.00 43.92 C ATOM 1967 CD GLN A 830 26.882 1.784 -0.886 1.00 57.73 C ATOM 1968 OE1 GLN A 830 27.276 0.976 -0.046 1.00 62.81 O ATOM 1969 NE2 GLN A 830 27.054 3.093 -0.739 1.00 42.76 N ATOM 1970 HE22 GLN A 830 26.708 3.748 -1.469 1.00 0.00 H ATOM 1971 HE21 GLN A 830 27.534 3.463 0.106 1.00 0.00 H ATOM 1972 H GLN A 830 24.651 -1.314 -0.637 1.00 0.00 H ATOM 1973 N HIS A 831 21.477 -0.117 -1.209 1.00 25.78 N ATOM 1974 CA HIS A 831 20.024 0.068 -1.311 1.00 26.52 C ATOM 1975 C HIS A 831 19.492 0.948 -0.190 1.00 29.62 C ATOM 1976 O HIS A 831 20.056 0.977 0.914 1.00 26.35 O ATOM 1977 CB HIS A 831 19.300 -1.274 -1.323 1.00 28.71 C ATOM 1978 CG HIS A 831 19.657 -2.151 -2.479 1.00 33.35 C ATOM 1979 ND1 HIS A 831 20.081 -1.622 -3.688 1.00 36.13 N ATOM 1980 CD2 HIS A 831 19.619 -3.496 -2.583 1.00 35.67 C ATOM 1981 CE1 HIS A 831 20.308 -2.662 -4.473 1.00 35.48 C ATOM 1982 NE2 HIS A 831 20.041 -3.806 -3.856 1.00 35.88 N ATOM 1983 H HIS A 831 21.856 -1.070 -1.033 1.00 0.00 H ATOM 1984 N ARG A 832 18.432 1.697 -0.484 1.00 26.42 N ATOM 1985 CA ARG A 832 17.834 2.617 0.470 1.00 25.83 C ATOM 1986 C ARG A 832 16.565 2.049 1.101 1.00 28.71 C ATOM 1987 O ARG A 832 15.834 1.269 0.475 1.00 26.32 O ATOM 1988 CB ARG A 832 17.553 3.956 -0.192 1.00 28.15 C ATOM 1989 CG ARG A 832 18.818 4.676 -0.614 1.00 37.81 C ATOM 1990 CD ARG A 832 18.472 6.092 -0.935 1.00 45.85 C ATOM 1991 NE ARG A 832 18.583 6.860 0.279 1.00 44.01 N ATOM 1992 CZ ARG A 832 18.041 8.048 0.486 1.00 51.70 C ATOM 1993 NH1 ARG A 832 17.333 8.643 -0.470 1.00 34.57 N ATOM 1994 NH2 ARG A 832 18.186 8.647 1.656 1.00 33.05 N ATOM 1995 HE ARG A 832 19.135 6.446 1.057 1.00 0.00 H ATOM 1996 HH12 ARG A 832 16.910 9.578 -0.299 1.00 0.00 H ATOM 1997 HH11 ARG A 832 17.202 8.174 -1.389 1.00 0.00 H ATOM 1998 HH22 ARG A 832 17.759 9.582 1.818 1.00 0.00 H ATOM 1999 HH21 ARG A 832 18.727 8.184 2.414 1.00 0.00 H ATOM 2000 H ARG A 832 18.015 1.621 -1.434 1.00 0.00 H ATOM 2001 N LEU A 833 16.327 2.432 2.362 1.00 26.19 N ATOM 2002 CA LEU A 833 15.186 1.927 3.127 1.00 26.04 C ATOM 2003 C LEU A 833 13.828 2.402 2.591 1.00 29.61 C ATOM 2004 O LEU A 833 13.776 3.469 1.963 1.00 27.45 O ATOM 2005 CB LEU A 833 15.366 2.269 4.620 1.00 25.21 C ATOM 2006 CG LEU A 833 16.521 1.552 5.333 1.00 28.40 C ATOM 2007 CD1 LEU A 833 16.811 2.193 6.692 1.00 27.24 C ATOM 2008 CD2 LEU A 833 16.258 0.040 5.450 1.00 32.03 C ATOM 2009 H LEU A 833 16.974 3.110 2.812 1.00 0.00 H ATOM 2010 N PRO A 834 12.714 1.653 2.834 1.00 27.14 N ATOM 2011 CA PRO A 834 11.403 2.132 2.371 1.00 26.97 C ATOM 2012 C PRO A 834 11.034 3.497 2.913 1.00 30.62 C ATOM 2013 O PRO A 834 11.492 3.908 3.984 1.00 29.79 O ATOM 2014 CB PRO A 834 10.419 1.063 2.876 1.00 28.47 C ATOM 2015 CG PRO A 834 11.234 -0.141 3.117 1.00 33.22 C ATOM 2016 CD PRO A 834 12.588 0.353 3.527 1.00 28.75 C ATOM 2017 N GLU A 835 10.217 4.218 2.162 1.00 27.45 N ATOM 2018 CA GLU A 835 9.719 5.522 2.596 1.00 27.92 C ATOM 2019 C GLU A 835 8.657 5.285 3.713 1.00 33.99 C ATOM 2020 O GLU A 835 7.967 4.262 3.678 1.00 34.90 O ATOM 2021 CB GLU A 835 9.058 6.235 1.413 1.00 29.70 C ATOM 2022 CG GLU A 835 10.021 6.478 0.269 1.00 38.02 C ATOM 2023 CD GLU A 835 9.330 6.872 -1.016 1.00 46.46 C ATOM 2024 OE1 GLU A 835 9.111 8.084 -1.211 1.00 43.23 O ATOM 2025 OE2 GLU A 835 8.942 5.970 -1.790 1.00 36.20 O ATOM 2026 H GLU A 835 9.921 3.846 1.237 1.00 0.00 H ATOM 2027 N PRO A 836 8.514 6.180 4.706 1.00 29.87 N ATOM 2028 CA PRO A 836 7.479 5.962 5.725 1.00 31.08 C ATOM 2029 C PRO A 836 6.066 6.093 5.164 1.00 38.22 C ATOM 2030 O PRO A 836 5.847 6.812 4.181 1.00 36.20 O ATOM 2031 CB PRO A 836 7.760 7.052 6.756 1.00 32.65 C ATOM 2032 CG PRO A 836 8.419 8.129 5.988 1.00 35.69 C ATOM 2033 CD PRO A 836 9.208 7.466 4.907 1.00 31.24 C ATOM 2034 N SER A 837 5.110 5.394 5.809 1.00 37.14 N ATOM 2035 CA SER A 837 3.691 5.416 5.458 1.00 62.64 C ATOM 2036 C SER A 837 3.041 6.600 6.164 1.00 85.88 C ATOM 2037 O SER A 837 2.167 7.251 5.602 1.00 54.78 O ATOM 2038 CB SER A 837 3.016 4.121 5.898 1.00 65.62 C ATOM 2039 H SER A 837 5.402 4.799 6.610 1.00 0.00 H TER 2040 SER A 837 ATOM 2041 N LEU A 841 6.772 12.431 7.408 1.00 39.01 N ATOM 2042 CA LEU A 841 8.129 12.068 7.805 1.00 38.60 C ATOM 2043 C LEU A 841 9.038 11.655 6.636 1.00 41.50 C ATOM 2044 O LEU A 841 10.208 11.331 6.873 1.00 39.98 O ATOM 2045 CB LEU A 841 8.097 10.967 8.893 1.00 38.55 C ATOM 2046 CG LEU A 841 7.639 11.398 10.299 1.00 41.93 C ATOM 2047 CD1 LEU A 841 7.548 10.226 11.212 1.00 41.28 C ATOM 2048 CD2 LEU A 841 8.572 12.431 10.919 1.00 43.63 C ATOM 2049 HN3 LEU A 841 6.320 11.619 6.941 1.00 0.00 H ATOM 2050 HN2 LEU A 841 6.808 13.235 6.750 1.00 0.00 H ATOM 2051 HN1 LEU A 841 6.225 12.696 8.252 1.00 0.00 H ATOM 2052 N ALA A 842 8.502 11.647 5.385 1.00 36.93 N ATOM 2053 CA ALA A 842 9.220 11.252 4.157 1.00 36.72 C ATOM 2054 C ALA A 842 10.534 12.020 3.885 1.00 38.57 C ATOM 2055 O ALA A 842 11.561 11.380 3.625 1.00 36.03 O ATOM 2056 CB ALA A 842 8.296 11.341 2.937 1.00 37.59 C ATOM 2057 H ALA A 842 7.510 11.942 5.286 1.00 0.00 H ATOM 2058 N THR A 843 10.509 13.370 3.933 1.00 36.09 N ATOM 2059 CA THR A 843 11.720 14.179 3.682 1.00 36.05 C ATOM 2060 C THR A 843 12.764 13.951 4.771 1.00 39.30 C ATOM 2061 O THR A 843 13.937 13.748 4.460 1.00 38.61 O ATOM 2062 CB THR A 843 11.386 15.680 3.505 1.00 48.55 C ATOM 2063 OG1 THR A 843 10.340 15.821 2.539 1.00 47.39 O ATOM 2064 CG2 THR A 843 12.603 16.505 3.075 1.00 46.74 C ATOM 2065 HG1 THR A 843 10.125 16.781 2.425 1.00 0.00 H ATOM 2066 H THR A 843 9.614 13.852 4.152 1.00 0.00 H ATOM 2067 N LEU A 844 12.332 13.966 6.039 1.00 37.34 N ATOM 2068 CA LEU A 844 13.213 13.753 7.182 1.00 37.79 C ATOM 2069 C LEU A 844 13.924 12.393 7.123 1.00 38.29 C ATOM 2070 O LEU A 844 15.147 12.371 7.219 1.00 37.69 O ATOM 2071 CB LEU A 844 12.445 13.935 8.497 1.00 38.28 C ATOM 2072 CG LEU A 844 13.251 14.009 9.780 1.00 43.19 C ATOM 2073 CD1 LEU A 844 14.345 15.078 9.688 1.00 44.15 C ATOM 2074 CD2 LEU A 844 12.335 14.270 10.954 1.00 45.08 C ATOM 2075 H LEU A 844 11.322 14.137 6.217 1.00 0.00 H ATOM 2076 N THR A 845 13.186 11.281 6.902 1.00 33.13 N ATOM 2077 CA THR A 845 13.825 9.960 6.799 1.00 31.95 C ATOM 2078 C THR A 845 14.759 9.897 5.591 1.00 32.36 C ATOM 2079 O THR A 845 15.842 9.337 5.697 1.00 31.00 O ATOM 2080 CB THR A 845 12.807 8.820 6.839 1.00 32.42 C ATOM 2081 OG1 THR A 845 11.885 9.000 5.770 1.00 32.46 O ATOM 2082 CG2 THR A 845 12.086 8.722 8.197 1.00 29.95 C ATOM 2083 HG1 THR A 845 11.424 9.869 5.876 1.00 0.00 H ATOM 2084 H THR A 845 12.154 11.361 6.804 1.00 0.00 H ATOM 2085 N SER A 846 14.368 10.504 4.460 1.00 29.42 N ATOM 2086 CA SER A 846 15.220 10.538 3.264 1.00 30.12 C ATOM 2087 C SER A 846 16.561 11.255 3.552 1.00 32.77 C ATOM 2088 O SER A 846 17.611 10.766 3.132 1.00 32.77 O ATOM 2089 CB SER A 846 14.490 11.196 2.092 1.00 35.88 C ATOM 2090 OG SER A 846 15.277 11.201 0.911 1.00 46.45 O ATOM 2091 HG SER A 846 14.770 11.634 0.180 1.00 0.00 H ATOM 2092 H SER A 846 13.435 10.963 4.429 1.00 0.00 H ATOM 2093 N GLN A 847 16.534 12.345 4.328 1.00 29.95 N ATOM 2094 CA GLN A 847 17.745 13.111 4.687 1.00 29.56 C ATOM 2095 C GLN A 847 18.608 12.372 5.719 1.00 31.55 C ATOM 2096 O GLN A 847 19.830 12.432 5.618 1.00 27.99 O ATOM 2097 CB GLN A 847 17.379 14.501 5.232 1.00 30.66 C ATOM 2098 CG GLN A 847 16.792 15.443 4.181 1.00 44.55 C ATOM 2099 CD GLN A 847 16.102 16.646 4.777 1.00 59.84 C ATOM 2100 OE1 GLN A 847 15.506 16.601 5.864 1.00 55.42 O ATOM 2101 NE2 GLN A 847 16.113 17.738 4.036 1.00 54.67 N ATOM 2102 HE22 GLN A 847 16.622 17.746 3.129 1.00 0.00 H ATOM 2103 HE21 GLN A 847 15.613 18.591 4.359 1.00 0.00 H ATOM 2104 H GLN A 847 15.617 12.668 4.696 1.00 0.00 H ATOM 2105 N CYS A 848 17.975 11.710 6.736 1.00 27.82 N ATOM 2106 CA CYS A 848 18.714 10.974 7.775 1.00 27.70 C ATOM 2107 C CYS A 848 19.288 9.687 7.228 1.00 29.26 C ATOM 2108 O CYS A 848 20.353 9.274 7.657 1.00 28.00 O ATOM 2109 CB CYS A 848 17.821 10.687 8.984 1.00 28.30 C ATOM 2110 SG CYS A 848 17.343 12.150 9.924 1.00 32.37 S ATOM 2111 H CYS A 848 16.936 11.728 6.776 1.00 0.00 H ATOM 2112 N LEU A 849 18.558 9.022 6.322 1.00 24.57 N ATOM 2113 CA LEU A 849 18.953 7.707 5.830 1.00 22.54 C ATOM 2114 C LEU A 849 19.728 7.762 4.494 1.00 28.85 C ATOM 2115 O LEU A 849 19.518 6.935 3.596 1.00 27.54 O ATOM 2116 CB LEU A 849 17.745 6.763 5.770 1.00 21.63 C ATOM 2117 CG LEU A 849 17.043 6.530 7.123 1.00 25.27 C ATOM 2118 CD1 LEU A 849 15.694 5.870 6.935 1.00 25.15 C ATOM 2119 CD2 LEU A 849 17.924 5.742 8.084 1.00 24.92 C ATOM 2120 H LEU A 849 17.685 9.456 5.959 1.00 0.00 H ATOM 2121 N THR A 850 20.708 8.677 4.438 1.00 26.61 N ATOM 2122 CA THR A 850 21.637 8.785 3.317 1.00 26.68 C ATOM 2123 C THR A 850 22.939 8.093 3.710 1.00 30.58 C ATOM 2124 O THR A 850 23.388 8.226 4.856 1.00 28.00 O ATOM 2125 CB THR A 850 21.859 10.263 2.863 1.00 33.27 C ATOM 2126 OG1 THR A 850 22.895 10.264 1.881 1.00 39.69 O ATOM 2127 CG2 THR A 850 22.282 11.192 3.990 1.00 28.80 C ATOM 2128 HG1 THR A 850 23.057 11.191 1.575 1.00 0.00 H ATOM 2129 H THR A 850 20.811 9.341 5.232 1.00 0.00 H ATOM 2130 N TYR A 851 23.563 7.395 2.748 1.00 28.46 N ATOM 2131 CA TYR A 851 24.838 6.712 2.962 1.00 28.90 C ATOM 2132 C TYR A 851 26.018 7.679 3.195 1.00 35.83 C ATOM 2133 O TYR A 851 27.048 7.236 3.699 1.00 37.45 O ATOM 2134 CB TYR A 851 25.137 5.746 1.816 1.00 29.14 C ATOM 2135 CG TYR A 851 24.405 4.429 1.916 1.00 29.61 C ATOM 2136 CD1 TYR A 851 23.036 4.351 1.686 1.00 30.40 C ATOM 2137 CD2 TYR A 851 25.096 3.243 2.139 1.00 30.35 C ATOM 2138 CE1 TYR A 851 22.358 3.137 1.782 1.00 29.97 C ATOM 2139 CE2 TYR A 851 24.435 2.021 2.203 1.00 30.77 C ATOM 2140 CZ TYR A 851 23.062 1.976 2.041 1.00 32.70 C ATOM 2141 OH TYR A 851 22.419 0.767 2.086 1.00 30.30 O ATOM 2142 HH TYR A 851 21.448 0.906 1.954 1.00 0.00 H ATOM 2143 H TYR A 851 23.120 7.337 1.809 1.00 0.00 H ATOM 2144 N GLU A 852 25.876 8.976 2.844 1.00 31.95 N ATOM 2145 CA GLU A 852 26.927 9.989 3.048 1.00 31.51 C ATOM 2146 C GLU A 852 26.728 10.575 4.455 1.00 33.28 C ATOM 2147 O GLU A 852 25.787 11.343 4.651 1.00 32.89 O ATOM 2148 CB GLU A 852 26.871 11.096 1.965 1.00 33.19 C ATOM 2149 H GLU A 852 24.980 9.275 2.408 1.00 0.00 H ATOM 2150 N PRO A 853 27.578 10.224 5.454 1.00 31.25 N ATOM 2151 CA PRO A 853 27.329 10.708 6.830 1.00 31.63 C ATOM 2152 C PRO A 853 27.263 12.215 6.999 1.00 37.09 C ATOM 2153 O PRO A 853 26.416 12.697 7.746 1.00 36.22 O ATOM 2154 CB PRO A 853 28.464 10.093 7.653 1.00 33.10 C ATOM 2155 CG PRO A 853 28.961 8.947 6.847 1.00 37.19 C ATOM 2156 CD PRO A 853 28.737 9.312 5.405 1.00 32.88 C ATOM 2157 N THR A 854 28.130 12.966 6.288 1.00 34.26 N ATOM 2158 CA THR A 854 28.193 14.431 6.403 1.00 34.18 C ATOM 2159 C THR A 854 26.951 15.159 5.860 1.00 37.08 C ATOM 2160 O THR A 854 26.734 16.323 6.208 1.00 38.17 O ATOM 2161 CB THR A 854 29.487 14.962 5.751 1.00 42.73 C ATOM 2162 OG1 THR A 854 29.563 14.486 4.406 1.00 43.11 O ATOM 2163 CG2 THR A 854 30.732 14.553 6.512 1.00 42.23 C ATOM 2164 HG1 THR A 854 30.392 14.824 3.984 1.00 0.00 H ATOM 2165 H THR A 854 28.781 12.489 5.632 1.00 0.00 H ATOM 2166 N GLN A 855 26.150 14.486 5.015 1.00 31.31 N ATOM 2167 CA GLN A 855 24.915 15.038 4.439 1.00 31.57 C ATOM 2168 C GLN A 855 23.701 14.896 5.376 1.00 37.23 C ATOM 2169 O GLN A 855 22.649 15.466 5.092 1.00 36.67 O ATOM 2170 CB GLN A 855 24.626 14.368 3.089 1.00 32.99 C ATOM 2171 H GLN A 855 26.420 13.517 4.753 1.00 0.00 H ATOM 2172 N ARG A 856 23.842 14.149 6.499 1.00 33.59 N ATOM 2173 CA ARG A 856 22.721 13.968 7.433 1.00 32.89 C ATOM 2174 C ARG A 856 22.486 15.266 8.218 1.00 35.97 C ATOM 2175 O ARG A 856 23.451 15.901 8.644 1.00 34.96 O ATOM 2176 CB ARG A 856 22.950 12.756 8.361 1.00 29.24 C ATOM 2177 CG ARG A 856 23.031 11.453 7.590 1.00 33.90 C ATOM 2178 CD ARG A 856 23.307 10.242 8.458 1.00 28.00 C ATOM 2179 NE ARG A 856 23.786 9.143 7.627 1.00 27.40 N ATOM 2180 CZ ARG A 856 24.737 8.294 7.985 1.00 27.72 C ATOM 2181 NH1 ARG A 856 25.278 8.363 9.197 1.00 23.61 N ATOM 2182 NH2 ARG A 856 25.134 7.353 7.153 1.00 22.56 N ATOM 2183 HE ARG A 856 23.351 9.018 6.690 1.00 0.00 H ATOM 2184 HH12 ARG A 856 26.025 7.693 9.472 1.00 0.00 H ATOM 2185 HH11 ARG A 856 24.955 9.087 9.870 1.00 0.00 H ATOM 2186 HH22 ARG A 856 25.881 6.688 7.438 1.00 0.00 H ATOM 2187 HH21 ARG A 856 24.700 7.275 6.211 1.00 0.00 H ATOM 2188 H ARG A 856 24.757 13.698 6.703 1.00 0.00 H ATOM 2189 N PRO A 857 21.225 15.717 8.379 1.00 33.82 N ATOM 2190 CA PRO A 857 20.997 16.975 9.111 1.00 33.56 C ATOM 2191 C PRO A 857 21.326 16.872 10.600 1.00 37.65 C ATOM 2192 O PRO A 857 21.310 15.773 11.151 1.00 35.87 O ATOM 2193 CB PRO A 857 19.513 17.251 8.883 1.00 34.88 C ATOM 2194 CG PRO A 857 18.898 15.922 8.664 1.00 39.63 C ATOM 2195 CD PRO A 857 19.950 15.103 7.945 1.00 35.45 C ATOM 2196 N SER A 858 21.609 18.020 11.252 1.00 34.30 N ATOM 2197 CA SER A 858 21.887 18.063 12.687 1.00 34.61 C ATOM 2198 C SER A 858 20.580 17.879 13.459 1.00 36.40 C ATOM 2199 O SER A 858 19.502 18.091 12.892 1.00 36.35 O ATOM 2200 CB SER A 858 22.544 19.390 13.074 1.00 38.68 C ATOM 2201 OG SER A 858 21.652 20.471 12.862 1.00 44.13 O ATOM 2202 HG SER A 858 21.399 20.506 11.906 1.00 0.00 H ATOM 2203 H SER A 858 21.630 18.909 10.712 1.00 0.00 H ATOM 2204 N PHE A 859 20.661 17.526 14.752 1.00 31.63 N ATOM 2205 CA PHE A 859 19.452 17.363 15.559 1.00 30.95 C ATOM 2206 C PHE A 859 18.777 18.706 15.831 1.00 38.25 C ATOM 2207 O PHE A 859 17.568 18.736 16.031 1.00 37.29 O ATOM 2208 CB PHE A 859 19.697 16.532 16.826 1.00 31.30 C ATOM 2209 CG PHE A 859 19.691 15.053 16.533 1.00 31.25 C ATOM 2210 CD1 PHE A 859 18.497 14.378 16.292 1.00 33.10 C ATOM 2211 CD2 PHE A 859 20.882 14.347 16.416 1.00 31.66 C ATOM 2212 CE1 PHE A 859 18.500 13.024 15.948 1.00 32.75 C ATOM 2213 CE2 PHE A 859 20.881 12.987 16.092 1.00 33.73 C ATOM 2214 CZ PHE A 859 19.691 12.337 15.860 1.00 31.54 C ATOM 2215 H PHE A 859 21.593 17.367 15.184 1.00 0.00 H ATOM 2216 N ARG A 860 19.533 19.820 15.725 1.00 38.30 N ATOM 2217 CA ARG A 860 18.991 21.182 15.813 1.00 38.38 C ATOM 2218 C ARG A 860 17.996 21.370 14.648 1.00 41.67 C ATOM 2219 O ARG A 860 16.861 21.781 14.872 1.00 42.41 O ATOM 2220 CB ARG A 860 20.119 22.217 15.687 1.00 40.10 C ATOM 2221 H ARG A 860 20.556 19.707 15.573 1.00 0.00 H ATOM 2222 N THR A 861 18.408 21.004 13.420 1.00 39.17 N ATOM 2223 CA THR A 861 17.590 21.081 12.203 1.00 39.34 C ATOM 2224 C THR A 861 16.426 20.075 12.270 1.00 44.65 C ATOM 2225 O THR A 861 15.298 20.427 11.922 1.00 46.93 O ATOM 2226 CB THR A 861 18.467 20.861 10.954 1.00 48.27 C ATOM 2227 OG1 THR A 861 19.525 21.821 10.942 1.00 51.58 O ATOM 2228 CG2 THR A 861 17.683 20.966 9.637 1.00 44.93 C ATOM 2229 HG1 THR A 861 20.076 21.713 11.757 1.00 0.00 H ATOM 2230 H THR A 861 19.378 20.640 13.326 1.00 0.00 H ATOM 2231 N ILE A 862 16.706 18.823 12.687 1.00 37.59 N ATOM 2232 CA ILE A 862 15.682 17.774 12.808 1.00 34.99 C ATOM 2233 C ILE A 862 14.571 18.248 13.761 1.00 39.76 C ATOM 2234 O ILE A 862 13.403 18.224 13.381 1.00 38.90 O ATOM 2235 CB ILE A 862 16.303 16.416 13.234 1.00 35.95 C ATOM 2236 CG1 ILE A 862 17.185 15.838 12.095 1.00 35.00 C ATOM 2237 CG2 ILE A 862 15.201 15.413 13.678 1.00 35.30 C ATOM 2238 CD1 ILE A 862 18.151 14.676 12.494 1.00 36.42 C ATOM 2239 H ILE A 862 17.689 18.589 12.934 1.00 0.00 H ATOM 2240 N LEU A 863 14.944 18.712 14.970 1.00 39.79 N ATOM 2241 CA LEU A 863 14.005 19.197 15.985 1.00 41.62 C ATOM 2242 C LEU A 863 13.147 20.378 15.472 1.00 51.57 C ATOM 2243 O LEU A 863 11.968 20.461 15.823 1.00 53.57 O ATOM 2244 CB LEU A 863 14.724 19.506 17.312 1.00 41.89 C ATOM 2245 H LEU A 863 15.959 18.727 15.196 1.00 0.00 H ATOM 2246 N ARG A 864 13.704 21.218 14.570 1.00 49.70 N ATOM 2247 CA ARG A 864 12.990 22.330 13.940 1.00 49.72 C ATOM 2248 C ARG A 864 12.019 21.795 12.865 1.00 51.10 C ATOM 2249 O ARG A 864 10.856 22.189 12.831 1.00 50.09 O ATOM 2250 CB ARG A 864 13.995 23.328 13.330 1.00 51.15 C ATOM 2251 H ARG A 864 14.699 21.065 14.308 1.00 0.00 H ATOM 2252 N ASP A 865 12.500 20.880 12.004 1.00 46.38 N ATOM 2253 CA ASP A 865 11.707 20.257 10.942 1.00 45.88 C ATOM 2254 C ASP A 865 10.527 19.466 11.481 1.00 49.20 C ATOM 2255 O ASP A 865 9.482 19.454 10.834 1.00 49.03 O ATOM 2256 CB ASP A 865 12.580 19.383 10.042 1.00 47.82 C ATOM 2257 H ASP A 865 13.496 20.598 12.098 1.00 0.00 H ATOM 2258 N LEU A 866 10.679 18.827 12.667 1.00 44.94 N ATOM 2259 CA LEU A 866 9.606 18.083 13.341 1.00 38.47 C ATOM 2260 C LEU A 866 8.564 19.063 13.854 1.00 78.72 C ATOM 2261 O LEU A 866 7.667 19.426 13.107 1.00 48.80 O ATOM 2262 CB LEU A 866 10.137 17.261 14.534 1.00 37.39 C ATOM 2263 CG LEU A 866 10.843 15.961 14.195 1.00 40.99 C ATOM 2264 CD1 LEU A 866 11.608 15.457 15.380 1.00 40.58 C ATOM 2265 CD2 LEU A 866 9.851 14.901 13.713 1.00 42.30 C ATOM 2266 H LEU A 866 11.611 18.866 13.127 1.00 0.00 H TER 2267 LEU A 866 HETATM 2268 O HOH 1 24.961 -3.144 22.739 1.00 28.64 O HETATM 2269 O HOH 2 11.265 -3.491 16.025 1.00 33.43 O HETATM 2270 O HOH 3 9.380 -8.847 29.535 1.00 32.26 O HETATM 2271 O HOH 4 26.548 5.686 38.077 1.00 35.71 O HETATM 2272 O HOH 5 21.927 -13.686 33.692 1.00 36.86 O HETATM 2273 O HOH 6 16.710 -6.309 23.633 1.00 25.84 O HETATM 2274 O HOH 7 13.974 -2.009 17.980 1.00 21.00 O HETATM 2275 O HOH 8 15.507 9.538 33.846 1.00 32.72 O HETATM 2276 O HOH 9 -1.443 11.157 23.758 1.00 34.61 O HETATM 2277 O HOH 10 6.478 2.206 2.799 1.00 45.06 O HETATM 2278 O HOH 11 24.752 -15.082 39.077 1.00 30.32 O HETATM 2279 O HOH 12 34.969 -10.181 39.755 1.00 27.84 O HETATM 2280 O HOH 13 22.688 4.651 -1.573 1.00 37.07 O HETATM 2281 O HOH 14 30.371 -4.223 42.934 1.00 29.78 O HETATM 2282 O HOH 15 23.828 -12.416 31.327 1.00 30.58 O HETATM 2283 O HOH 16 30.613 -10.017 32.657 1.00 30.49 O HETATM 2284 O HOH 17 16.844 1.282 32.084 1.00 22.79 O HETATM 2285 O HOH 18 25.740 -0.308 21.586 1.00 27.14 O HETATM 2286 O HOH 19 36.498 -2.037 24.408 1.00 27.28 O HETATM 2287 O HOH 20 22.972 4.030 14.076 1.00 31.12 O HETATM 2288 O HOH 21 19.298 2.553 30.987 1.00 25.25 O HETATM 2289 O HOH 22 22.374 8.618 34.959 1.00 20.59 O HETATM 2290 O HOH 23 10.073 -9.302 39.163 1.00 42.05 O HETATM 2291 O HOH 24 23.761 19.477 25.225 1.00 35.28 O HETATM 2292 O HOH 25 13.107 -4.562 18.069 1.00 41.20 O HETATM 2293 O HOH 26 21.047 -1.652 27.537 1.00 41.04 O HETATM 2294 O HOH 27 3.214 -4.165 14.041 1.00 30.20 O HETATM 2295 O HOH 28 23.028 -14.363 27.346 1.00 52.58 O HETATM 2296 O HOH 29 10.577 10.097 -0.091 1.00 39.75 O HETATM 2297 O HOH 30 6.665 -2.546 26.268 1.00 21.92 O HETATM 2298 O HOH 31 -3.492 -4.033 17.704 1.00 33.47 O HETATM 2299 O HOH 32 -8.402 7.837 24.833 1.00 34.81 O HETATM 2300 O HOH 33 31.251 1.596 24.915 1.00 41.73 O HETATM 2301 O HOH 34 7.074 -4.300 39.359 1.00 40.41 O HETATM 2302 O HOH 35 -1.184 -0.499 26.313 1.00 41.94 O HETATM 2303 O HOH 36 25.606 5.139 -1.852 1.00 43.19 O HETATM 2304 O HOH 37 19.139 18.076 30.013 1.00 33.04 O HETATM 2305 O HOH 38 30.487 -11.428 25.771 1.00 33.95 O HETATM 2306 O HOH 39 14.736 2.861 38.855 1.00 28.02 O HETATM 2307 O HOH 40 4.287 -6.987 21.220 1.00 25.27 O HETATM 2308 O HOH 41 24.534 7.541 39.054 1.00 41.81 O HETATM 2309 O HOH 42 8.994 -6.141 29.572 1.00 35.31 O HETATM 2310 O HOH 43 22.279 4.932 16.886 1.00 29.10 O HETATM 2311 O HOH 44 12.752 16.469 33.625 1.00 39.13 O HETATM 2312 O HOH 45 24.392 -4.640 25.881 1.00 25.89 O HETATM 2313 O HOH 46 24.154 -11.319 11.674 1.00 37.78 O HETATM 2314 O HOH 47 31.749 2.033 20.861 1.00 45.15 O HETATM 2315 O HOH 48 17.931 -2.955 27.739 1.00 42.66 O HETATM 2316 O HOH 49 20.978 9.560 32.153 1.00 31.76 O HETATM 2317 O HOH 50 21.858 -12.396 25.872 1.00 37.33 O HETATM 2318 O HOH 51 -0.200 6.261 12.762 1.00 39.24 O HETATM 2319 O HOH 52 27.187 2.258 21.294 1.00 36.46 O HETATM 2320 O HOH 53 -1.092 2.735 14.121 1.00 27.63 O HETATM 2321 O HOH 54 8.568 4.948 34.697 1.00 29.70 O HETATM 2322 O HOH 55 31.281 4.488 43.950 1.00 43.22 O HETATM 2323 O HOH 56 29.496 7.699 11.627 1.00 42.90 O HETATM 2324 O HOH 57 29.384 3.570 25.010 1.00 40.76 O HETATM 2325 O HOH 58 19.375 -11.647 44.168 1.00 40.74 O HETATM 2326 O HOH 59 1.792 15.706 17.900 1.00 39.07 O HETATM 2327 O HOH 60 9.715 17.193 26.878 1.00 45.93 O HETATM 2328 O HOH 61 19.009 11.383 32.509 1.00 31.14 O HETATM 2329 O HOH 62 -9.524 8.966 28.806 1.00 43.31 O HETATM 2330 O HOH 63 0.401 13.706 29.981 1.00 36.73 O HETATM 2331 O HOH 64 18.435 4.172 3.457 1.00 31.79 O HETATM 2332 O HOH 65 31.255 -11.900 13.284 1.00 34.75 O HETATM 2333 O HOH 66 14.306 -10.551 24.863 1.00 32.12 O HETATM 2334 O HOH 67 25.347 2.788 13.939 1.00 37.42 O HETATM 2335 O HOH 68 20.779 -4.289 21.634 1.00 49.57 O HETATM 2336 O HOH 69 28.903 -13.631 25.581 1.00 41.27 O HETATM 2337 O HOH 70 33.380 -12.096 25.399 1.00 28.42 O HETATM 2338 O HOH 71 -6.985 11.588 31.675 1.00 33.41 O HETATM 2339 O HOH 72 23.180 12.580 18.633 1.00 41.17 O HETATM 2340 O HOH 73 24.630 18.621 30.808 1.00 42.74 O HETATM 2341 O HOH 74 12.416 -15.182 35.439 1.00 44.20 O HETATM 2342 O HOH 75 9.675 15.139 6.849 1.00 35.11 O HETATM 2343 O HOH 76 25.815 16.761 32.930 1.00 49.67 O HETATM 2344 O HOH 77 6.510 -8.265 20.395 1.00 39.00 O HETATM 2345 O HOH 78 30.789 9.366 23.040 1.00 45.00 O HETATM 2346 O HOH 79 2.441 5.409 33.542 1.00 41.02 O HETATM 2347 O HOH 80 3.416 12.655 30.152 1.00 40.17 O HETATM 2348 O HOH 81 21.457 -3.827 24.375 1.00 40.60 O HETATM 2349 O HOH 82 2.326 -3.465 11.116 1.00 46.22 O HETATM 2350 O HOH 83 2.396 -8.214 19.687 1.00 32.51 O HETATM 2351 O HOH 84 -0.637 12.878 21.793 1.00 57.80 O HETATM 2352 O HOH 85 2.195 -1.781 29.604 1.00 58.05 O HETATM 2353 O HOH 86 26.372 -12.293 9.807 1.00 44.99 O HETATM 2354 C13 UNN A 87 11.720 -6.262 27.268 1.00 -0.05 C HETATM 2355 C12 UNN A 87 12.380 -5.715 28.364 1.00 0.05 C HETATM 2356 C17 UNN A 87 13.773 -5.752 28.413 1.00 -0.05 C HETATM 2357 C16 UNN A 87 14.509 -6.295 27.367 1.00 -0.06 C HETATM 2358 C18 UNN A 87 16.016 -6.199 27.347 1.00 -0.04 C HETATM 2359 H2 UNN A 87 16.366 -5.734 28.280 1.00 0.04 H HETATM 2360 H3 UNN A 87 16.333 -5.586 26.491 1.00 0.04 H HETATM 2361 H4 UNN A 87 16.447 -7.207 27.256 1.00 0.04 H HETATM 2362 C15 UNN A 87 13.819 -6.848 26.297 1.00 -0.07 C HETATM 2363 C14 UNN A 87 12.433 -6.847 26.229 1.00 -0.06 C HETATM 2364 C19 UNN A 87 11.716 -7.451 25.043 1.00 -0.04 C HETATM 2365 H7 UNN A 87 10.629 -7.350 25.181 1.00 0.04 H HETATM 2366 H8 UNN A 87 11.977 -8.516 24.960 1.00 0.04 H HETATM 2367 H9 UNN A 87 12.020 -6.926 24.125 1.00 0.04 H HETATM 2368 H6 UNN A 87 14.382 -7.296 25.486 1.00 0.04 H HETATM 2369 H5 UNN A 87 14.289 -5.352 29.279 1.00 0.04 H HETATM 2370 N10 UNN A 87 11.583 -5.162 29.395 1.00 -0.26 N HETATM 2371 C4 UNN A 87 11.726 -4.021 30.183 1.00 0.14 C HETATM 2372 N3 UNN A 87 12.866 -3.421 30.040 1.00 -0.17 N HETATM 2373 N2 UNN A 87 13.024 -2.302 30.835 1.00 -0.14 N HETATM 2374 C1 UNN A 87 12.091 -1.808 31.733 1.00 0.19 C HETATM 2375 C6 UNN A 87 10.838 -2.490 31.834 1.00 0.11 C HETATM 2376 C5 UNN A 87 10.689 -3.602 31.051 1.00 0.01 C HETATM 2377 H13 UNN A 87 9.762 -4.171 31.096 1.00 0.05 H HETATM 2378 N20 UNN A 87 9.897 -2.003 32.665 1.00 -0.31 N HETATM 2379 C21 UNN A 87 8.585 -2.607 32.816 1.00 0.02 C HETATM 2380 H10 UNN A 87 7.998 -2.032 33.547 1.00 0.05 H HETATM 2381 H11 UNN A 87 8.697 -3.643 33.169 1.00 0.05 H HETATM 2382 H12 UNN A 87 8.066 -2.604 31.846 1.00 0.05 H HETATM 2383 H16 UNN A 87 10.118 -1.163 33.219 1.00 0.18 H HETATM 2384 N7 UNN A 87 12.552 -0.720 32.336 1.00 -0.32 N HETATM 2385 C8 UNN A 87 13.795 -0.511 31.794 1.00 -0.00 C HETATM 2386 C9 UNN A 87 14.138 -1.461 30.861 1.00 0.17 C HETATM 2387 C11 UNN A 87 15.383 -1.530 30.057 1.00 0.22 C HETATM 2388 N22 UNN A 87 15.548 -2.482 29.142 1.00 -0.30 N HETATM 2389 H17 UNN A 87 16.391 -2.519 28.606 1.00 0.18 H HETATM 2390 H18 UNN A 87 14.829 -3.160 28.991 1.00 0.18 H HETATM 2391 O23 UNN A 87 16.260 -0.675 30.278 1.00 -0.39 O HETATM 2392 H14 UNN A 87 14.442 0.320 32.073 1.00 0.06 H HETATM 2393 H15 UNN A 87 10.734 -5.707 29.603 1.00 0.21 H HETATM 2394 H1 UNN A 87 10.637 -6.231 27.224 1.00 0.04 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 283 284 288 289 290 CONECT 288 283 CONECT 289 283 CONECT 290 283 CONECT 1629 1630 1636 1637 1638 CONECT 1636 1629 CONECT 1637 1629 CONECT 1638 1629 CONECT 1834 1835 1839 1840 1841 CONECT 1839 1834 CONECT 1840 1834 CONECT 1841 1834 CONECT 2041 2042 2049 2050 2051 CONECT 2049 2041 CONECT 2050 2041 CONECT 2051 2041 CONECT 2354 2355 2363 2394 CONECT 2355 2354 2356 2370 CONECT 2356 2355 2357 2369 CONECT 2357 2356 2358 2362 CONECT 2358 2357 2359 2360 2361 CONECT 2359 2358 CONECT 2360 2358 CONECT 2361 2358 CONECT 2362 2357 2363 2368 CONECT 2363 2354 2362 2364 CONECT 2364 2363 2365 2366 2367 CONECT 2365 2364 CONECT 2366 2364 CONECT 2367 2364 CONECT 2368 2362 CONECT 2369 2356 CONECT 2370 2355 2371 2393 CONECT 2371 2370 2372 2376 CONECT 2372 2371 2373 CONECT 2373 2372 2374 2386 CONECT 2374 2373 2375 2384 CONECT 2375 2374 2376 2378 CONECT 2376 2371 2375 2377 CONECT 2377 2376 CONECT 2378 2375 2379 2383 CONECT 2379 2378 2380 2381 2382 CONECT 2380 2379 CONECT 2381 2379 CONECT 2382 2379 CONECT 2383 2378 CONECT 2384 2374 2385 CONECT 2385 2384 2386 2392 CONECT 2386 2373 2385 2387 CONECT 2387 2386 2388 2391 CONECT 2388 2387 2389 2390 CONECT 2389 2388 CONECT 2390 2388 CONECT 2391 2387 CONECT 2392 2385 CONECT 2393 2370 CONECT 2394 2354 MASTER 0 0 0 0 0 0 0 0 2389 5 61 21 END
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Structure:
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Related entries of code: 5tkd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4wov
RCSB PDB
PDBbind
317aa, >4WOV_1|Chains... *
6nzr
RCSB PDB
PDBbind
317aa, >6NZR_1|Chains... at 99%
6nzq
RCSB PDB
PDBbind
317aa, >6NZQ_1|Chains... at 100%
6nzp
RCSB PDB
PDBbind
317aa, >6NZP_1|Chains... at 100%
6nzh
RCSB PDB
PDBbind
317aa, >6NZH_1|Chains... at 100%
6nzf
RCSB PDB
PDBbind
317aa, >6NZF_1|Chains... at 100%
6nze
RCSB PDB
PDBbind
317aa, >6NZE_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5tkd
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Non-receptor tyrosine-protein kinase TYK2 JH2 (pseudo kinase domain)
Ligand Name
7GL
EC.Number
E.C.2.7.10.2
Resolution
1.92(Å)
Affinity (Kd/Ki/IC50)
IC50=0.007uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Medchemcomm Vol. 8 : pp. 700-712
Ligand Properties
Formula
C
1
6
H
1
8
N
6
O
Molecular Weight
310.354
Exact Mass
310.154
No. of atoms
41
No. of bonds
43
Polar Surface Area
97.34
LOGP Value
2.12 (
Computed with XLOGP3
)
3.08 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 3
Canonical SMILES
CNc1cc(Nc2cc(C)cc(c2)C)nn2c1ncc2C(=O)N
InChI String
InChI=1S/C16H18N6O/c1-9-4-10(2)6-11(5-9)20-14-7-12(18-3)16-19-8-13(15(17)23)22(16)21-14/h4-8,18H,1-3H3,(H2,17,23)(H,20,21)
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
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UniProtKB AC
UniProt accession number (AC):
P29597
Entrez Gene ID
NCBI Entrez Gene ID:
7297
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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