Browse entries in the PDBbind-CN Database
HEADER 4YOZ_COMPLEX COMPND 4YOZ_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 206 GLU PHE THR GLN SER VAL SER ARG LEU GLN SER ILE VAL SEQRES 2 A 206 ALA GLY LEU LYS ASN ALA PRO SER ASP GLN LEU ILE ASN SEQRES 3 A 206 ILE PHE GLU SER CYS VAL ARG ASN PRO VAL GLU ASN ILE SEQRES 4 A 206 MET LYS ILE LEU LYS GLY ILE GLY GLU THR PHE CYS GLN SEQRES 5 A 206 HIS TYR THR GLN SER THR ASP GLU GLN PRO GLY SER HIS SEQRES 6 A 206 ILE ASP PHE ALA VAL ASN ARG LEU LYS LEU ALA GLU ILE SEQRES 7 A 206 LEU TYR TYR LYS ILE LEU GLU THR VAL MET VAL GLN GLU SEQRES 8 A 206 THR ARG ARG LEU HIS GLY MET ASP MET SER VAL LEU LEU SEQRES 9 A 206 GLU GLN ASP ILE PHE HIS ARG SER LEU MET ALA CYS CYS SEQRES 10 A 206 LEU GLU ILE VAL LEU PHE ALA TYR SER SER PRO ARG THR SEQRES 11 A 206 PHE PRO TRP ILE ILE GLU VAL LEU ASN LEU GLN PRO PHE SEQRES 12 A 206 TYR PHE TYR LYS VAL ILE GLU VAL VAL ILE ARG SER GLU SEQRES 13 A 206 GLU GLY LEU SER ARG ASP MET VAL LYS HIS LEU ASN SER SEQRES 14 A 206 ILE GLU GLU GLN ILE LEU GLU SER LEU ALA TRP SER HIS SEQRES 15 A 206 ASP SER ALA LEU TRP GLU ALA LEU GLN VAL SER ALA ASN SEQRES 16 A 206 LYS VAL PRO THR CYS GLU GLU VAL ILE PHE PRO SEQRES 1 A 106 ASN ARG PRO LYS ARG THR GLY SER LEU ALA LEU PHE TYR SEQRES 2 A 106 ARG LYS VAL TYR HIS LEU ALA SER VAL ARG LEU ARG ASP SEQRES 3 A 106 LEU CYS LEU LYS LEU ASP VAL SER ASN GLU LEU ARG ARG SEQRES 4 A 106 LYS ILE TRP THR CYS PHE GLU PHE THR LEU VAL HIS CYS SEQRES 5 A 106 PRO ASP LEU MET LYS ASP ARG HIS LEU ASP GLN LEU LEU SEQRES 6 A 106 LEU CYS ALA PHE TYR ILE MET ALA LYS VAL THR LYS GLU SEQRES 7 A 106 GLU ARG THR PHE GLN GLU ILE MET LYS SER TYR ARG ASN SEQRES 8 A 106 GLN PRO GLN ALA ASN SER HIS VAL TYR ARG SER VAL LEU SEQRES 9 A 106 LEU LYS SEQRES 1 A 24 GLU ARG GLY ASP LEU ILE LYS PHE TYR ASN THR ILE TYR SEQRES 2 A 24 VAL GLY ARG VAL LYS SER PHE ALA LEU LYS TYR SEQRES 1 A 6 PRO LEU SER PRO PHE PRO HET ASP A 454 152 ATOM 1 N GLU A 389 42.228 23.863 -3.248 1.00 66.88 N ATOM 2 CA GLU A 389 41.826 23.156 -2.037 1.00 60.62 C ATOM 3 C GLU A 389 40.317 23.194 -1.838 1.00 48.00 C ATOM 4 O GLU A 389 39.708 24.260 -1.855 1.00 49.89 O ATOM 5 CB GLU A 389 42.520 23.751 -0.812 1.00 67.79 C ATOM 6 CG GLU A 389 42.371 22.911 0.445 1.00 74.84 C ATOM 7 CD GLU A 389 42.297 23.751 1.708 1.00 83.43 C ATOM 8 OE1 GLU A 389 42.156 24.988 1.598 1.00 84.42 O ATOM 9 OE2 GLU A 389 42.383 23.171 2.812 1.00 87.77 O ATOM 10 HN3 GLU A 389 41.931 24.857 -3.182 1.00 0.00 H ATOM 11 HN2 GLU A 389 41.777 23.419 -4.073 1.00 0.00 H ATOM 12 HN1 GLU A 389 43.262 23.815 -3.349 1.00 0.00 H ATOM 13 N PHE A 390 39.714 22.025 -1.658 1.00 43.96 N ATOM 14 CA PHE A 390 38.293 21.942 -1.359 1.00 37.32 C ATOM 15 C PHE A 390 38.045 22.255 0.105 1.00 38.24 C ATOM 16 O PHE A 390 38.939 22.105 0.941 1.00 37.82 O ATOM 17 CB PHE A 390 37.742 20.556 -1.702 1.00 35.51 C ATOM 18 CG PHE A 390 37.805 20.233 -3.162 1.00 43.42 C ATOM 19 CD1 PHE A 390 36.811 20.671 -4.022 1.00 41.41 C ATOM 20 CD2 PHE A 390 38.867 19.507 -3.680 1.00 53.23 C ATOM 21 CE1 PHE A 390 36.868 20.386 -5.368 1.00 45.25 C ATOM 22 CE2 PHE A 390 38.931 19.216 -5.028 1.00 53.57 C ATOM 23 CZ PHE A 390 37.931 19.657 -5.874 1.00 53.79 C ATOM 24 H PHE A 390 40.270 21.149 -1.732 1.00 0.00 H ATOM 25 N THR A 391 36.833 22.704 0.410 1.00 35.39 N ATOM 26 CA THR A 391 36.421 22.870 1.794 1.00 33.93 C ATOM 27 C THR A 391 36.308 21.489 2.425 1.00 38.60 C ATOM 28 O THR A 391 36.226 20.484 1.714 1.00 36.52 O ATOM 29 CB THR A 391 35.082 23.605 1.914 1.00 37.75 C ATOM 30 OG1 THR A 391 34.037 22.767 1.412 1.00 29.60 O ATOM 31 CG2 THR A 391 35.113 24.908 1.128 1.00 39.50 C ATOM 32 HG1 THR A 391 33.171 23.240 1.489 1.00 0.00 H ATOM 33 H THR A 391 36.168 22.941 -0.354 1.00 0.00 H ATOM 34 N GLN A 392 36.318 21.437 3.752 1.00 38.01 N ATOM 35 CA GLN A 392 36.310 20.162 4.458 1.00 36.75 C ATOM 36 C GLN A 392 35.077 19.332 4.114 1.00 37.94 C ATOM 37 O GLN A 392 35.170 18.119 3.912 1.00 28.57 O ATOM 38 CB GLN A 392 36.399 20.396 5.968 1.00 38.34 C ATOM 39 CG GLN A 392 37.411 21.464 6.374 1.00 53.79 C ATOM 40 CD GLN A 392 38.824 21.188 5.868 1.00 68.32 C ATOM 41 OE1 GLN A 392 39.183 20.049 5.559 1.00 71.05 O ATOM 42 NE2 GLN A 392 39.636 22.240 5.786 1.00 72.10 N ATOM 43 HE22 GLN A 392 39.293 23.184 6.057 1.00 0.00 H ATOM 44 HE21 GLN A 392 40.613 22.118 5.451 1.00 0.00 H ATOM 45 H GLN A 392 36.332 22.322 4.297 1.00 0.00 H ATOM 46 N SER A 393 33.927 19.991 4.025 1.00 32.01 N ATOM 47 CA SER A 393 32.680 19.312 3.677 1.00 26.36 C ATOM 48 C SER A 393 32.684 18.718 2.270 1.00 27.47 C ATOM 49 O SER A 393 32.225 17.592 2.071 1.00 28.27 O ATOM 50 CB SER A 393 31.496 20.273 3.820 1.00 28.84 C ATOM 51 OG SER A 393 30.929 20.199 5.118 1.00 43.53 O ATOM 52 HG SER A 393 30.168 20.829 5.181 1.00 0.00 H ATOM 53 H SER A 393 33.913 21.015 4.207 1.00 0.00 H ATOM 54 N VAL A 394 33.189 19.465 1.293 1.00 25.16 N ATOM 55 CA VAL A 394 33.191 18.971 -0.082 1.00 27.77 C ATOM 56 C VAL A 394 34.247 17.875 -0.263 1.00 27.30 C ATOM 57 O VAL A 394 34.018 16.901 -0.987 1.00 26.93 O ATOM 58 CB VAL A 394 33.417 20.110 -1.102 1.00 27.55 C ATOM 59 CG1 VAL A 394 33.629 19.552 -2.506 1.00 27.61 C ATOM 60 CG2 VAL A 394 32.227 21.059 -1.100 1.00 24.02 C ATOM 61 H VAL A 394 33.583 20.403 1.508 1.00 0.00 H ATOM 62 N SER A 395 35.381 18.002 0.418 1.00 27.30 N ATOM 63 CA SER A 395 36.405 16.964 0.327 1.00 28.54 C ATOM 64 C SER A 395 35.922 15.686 1.011 1.00 27.87 C ATOM 65 O SER A 395 36.163 14.588 0.518 1.00 32.46 O ATOM 66 CB SER A 395 37.736 17.435 0.931 1.00 38.95 C ATOM 67 OG SER A 395 37.693 17.449 2.346 1.00 46.33 O ATOM 68 HG SER A 395 36.978 18.064 2.647 1.00 0.00 H ATOM 69 H SER A 395 35.539 18.839 1.015 1.00 0.00 H ATOM 70 N ARG A 396 35.231 15.832 2.139 1.00 32.49 N ATOM 71 CA ARG A 396 34.628 14.687 2.816 1.00 33.52 C ATOM 72 C ARG A 396 33.623 13.997 1.905 1.00 31.37 C ATOM 73 O ARG A 396 33.616 12.772 1.776 1.00 31.27 O ATOM 74 CB ARG A 396 33.940 15.111 4.114 1.00 31.46 C ATOM 75 CG ARG A 396 33.181 13.978 4.791 1.00 32.18 C ATOM 76 CD ARG A 396 34.107 12.790 5.068 1.00 38.68 C ATOM 77 NE ARG A 396 35.176 13.148 5.997 1.00 43.67 N ATOM 78 CZ ARG A 396 35.045 13.131 7.320 1.00 42.85 C ATOM 79 NH1 ARG A 396 33.890 12.767 7.865 1.00 42.33 N ATOM 80 NH2 ARG A 396 36.064 13.474 8.097 1.00 40.26 N ATOM 81 HE ARG A 396 36.094 13.433 5.600 1.00 0.00 H ATOM 82 HH12 ARG A 396 33.785 12.753 8.900 1.00 0.00 H ATOM 83 HH11 ARG A 396 33.091 12.496 7.257 1.00 0.00 H ATOM 84 HH22 ARG A 396 35.957 13.459 9.131 1.00 0.00 H ATOM 85 HH21 ARG A 396 36.970 13.758 7.672 1.00 0.00 H ATOM 86 H ARG A 396 35.118 16.782 2.547 1.00 0.00 H ATOM 87 N LEU A 397 32.775 14.801 1.278 1.00 27.78 N ATOM 88 CA LEU A 397 31.825 14.301 0.295 1.00 26.88 C ATOM 89 C LEU A 397 32.543 13.517 -0.798 1.00 30.32 C ATOM 90 O LEU A 397 32.128 12.411 -1.153 1.00 30.04 O ATOM 91 CB LEU A 397 31.037 15.459 -0.311 1.00 31.14 C ATOM 92 CG LEU A 397 29.681 15.133 -0.916 1.00 40.69 C ATOM 93 CD1 LEU A 397 28.832 14.388 0.096 1.00 50.82 C ATOM 94 CD2 LEU A 397 29.000 16.419 -1.343 1.00 39.75 C ATOM 95 H LEU A 397 32.789 15.818 1.495 1.00 0.00 H ATOM 96 N GLN A 398 33.627 14.095 -1.315 1.00 24.09 N ATOM 97 CA GLN A 398 34.445 13.456 -2.343 1.00 28.05 C ATOM 98 C GLN A 398 35.044 12.127 -1.882 1.00 35.09 C ATOM 99 O GLN A 398 35.220 11.208 -2.685 1.00 33.82 O ATOM 100 CB GLN A 398 35.572 14.393 -2.788 1.00 34.96 C ATOM 101 CG GLN A 398 35.105 15.548 -3.659 1.00 45.70 C ATOM 102 CD GLN A 398 36.233 16.489 -4.045 1.00 52.88 C ATOM 103 OE1 GLN A 398 37.323 16.449 -3.470 1.00 49.23 O ATOM 104 NE2 GLN A 398 35.975 17.341 -5.031 1.00 57.59 N ATOM 105 HE22 GLN A 398 35.041 17.340 -5.488 1.00 0.00 H ATOM 106 HE21 GLN A 398 36.707 18.009 -5.346 1.00 0.00 H ATOM 107 H GLN A 398 33.901 15.038 -0.973 1.00 0.00 H ATOM 108 N SER A 399 35.371 12.036 -0.596 1.00 34.07 N ATOM 109 CA SER A 399 35.904 10.802 -0.032 1.00 36.38 C ATOM 110 C SER A 399 34.827 9.722 0.013 1.00 28.28 C ATOM 111 O SER A 399 35.094 8.557 -0.265 1.00 32.64 O ATOM 112 CB SER A 399 36.466 11.037 1.374 1.00 38.75 C ATOM 113 OG SER A 399 37.592 11.896 1.341 1.00 51.86 O ATOM 114 HG SER A 399 37.328 12.769 0.957 1.00 0.00 H ATOM 115 H SER A 399 35.244 12.864 0.021 1.00 0.00 H ATOM 116 N ILE A 400 33.612 10.120 0.366 1.00 25.99 N ATOM 117 CA ILE A 400 32.506 9.184 0.489 1.00 31.54 C ATOM 118 C ILE A 400 32.156 8.547 -0.858 1.00 36.59 C ATOM 119 O ILE A 400 31.887 7.348 -0.938 1.00 32.83 O ATOM 120 CB ILE A 400 31.260 9.876 1.076 1.00 29.30 C ATOM 121 CG1 ILE A 400 31.550 10.360 2.500 1.00 31.81 C ATOM 122 CG2 ILE A 400 30.064 8.934 1.074 1.00 21.38 C ATOM 123 CD1 ILE A 400 30.386 11.097 3.150 1.00 27.05 C ATOM 124 H ILE A 400 33.446 11.128 0.560 1.00 0.00 H ATOM 125 N VAL A 401 32.192 9.350 -1.916 1.00 31.42 N ATOM 126 CA VAL A 401 31.754 8.906 -3.233 1.00 27.57 C ATOM 127 C VAL A 401 32.878 8.346 -4.101 1.00 35.02 C ATOM 128 O VAL A 401 32.648 7.987 -5.258 1.00 37.38 O ATOM 129 CB VAL A 401 31.092 10.056 -4.004 1.00 22.46 C ATOM 130 CG1 VAL A 401 29.983 10.670 -3.172 1.00 22.01 C ATOM 131 CG2 VAL A 401 32.131 11.108 -4.379 1.00 24.35 C ATOM 132 H VAL A 401 32.543 10.322 -1.801 1.00 0.00 H ATOM 133 N ALA A 402 34.085 8.269 -3.545 1.00 30.48 N ATOM 134 CA ALA A 402 35.257 7.880 -4.320 1.00 31.78 C ATOM 135 C ALA A 402 35.177 6.436 -4.812 1.00 44.34 C ATOM 136 O ALA A 402 34.945 5.513 -4.032 1.00 44.39 O ATOM 137 CB ALA A 402 36.523 8.086 -3.496 1.00 33.34 C ATOM 138 H ALA A 402 34.194 8.491 -2.535 1.00 0.00 H ATOM 139 N GLY A 403 35.374 6.256 -6.114 1.00 29.91 N ATOM 140 CA GLY A 403 35.393 4.939 -6.718 1.00 31.76 C ATOM 141 C GLY A 403 34.013 4.360 -6.962 1.00 34.09 C ATOM 142 O GLY A 403 33.880 3.179 -7.270 1.00 40.78 O ATOM 143 H GLY A 403 35.519 7.089 -6.720 1.00 0.00 H ATOM 144 N LEU A 404 32.986 5.194 -6.849 1.00 32.29 N ATOM 145 CA LEU A 404 31.611 4.723 -6.953 1.00 30.32 C ATOM 146 C LEU A 404 30.872 5.368 -8.113 1.00 34.53 C ATOM 147 O LEU A 404 31.290 6.395 -8.639 1.00 43.13 O ATOM 148 CB LEU A 404 30.846 4.985 -5.657 1.00 26.54 C ATOM 149 CG LEU A 404 31.319 4.239 -4.411 1.00 27.26 C ATOM 150 CD1 LEU A 404 30.340 4.478 -3.271 1.00 26.26 C ATOM 151 CD2 LEU A 404 31.487 2.751 -4.692 1.00 26.90 C ATOM 152 H LEU A 404 33.167 6.205 -6.683 1.00 0.00 H ATOM 153 N LYS A 405 29.757 4.752 -8.488 1.00 37.72 N ATOM 154 CA LYS A 405 28.982 5.148 -9.656 1.00 32.23 C ATOM 155 C LYS A 405 27.607 5.662 -9.257 1.00 27.83 C ATOM 156 O LYS A 405 27.118 5.384 -8.163 1.00 29.99 O ATOM 157 CB LYS A 405 28.815 3.973 -10.625 1.00 38.73 C ATOM 158 CG LYS A 405 30.104 3.384 -11.162 1.00 44.70 C ATOM 159 CD LYS A 405 29.802 2.324 -12.212 1.00 50.12 C ATOM 160 CE LYS A 405 28.879 1.242 -11.661 1.00 46.74 C ATOM 161 NZ LYS A 405 28.289 0.396 -12.734 1.00 43.58 N ATOM 162 HZ1 LYS A 405 27.734 0.994 -13.379 1.00 0.00 H ATOM 163 HZ2 LYS A 405 29.052 -0.072 -13.264 1.00 0.00 H ATOM 164 HZ3 LYS A 405 27.671 -0.323 -12.307 1.00 0.00 H ATOM 165 H LYS A 405 29.421 3.948 -7.920 1.00 0.00 H ATOM 166 N ASN A 406 26.991 6.407 -10.166 1.00 28.82 N ATOM 167 CA ASN A 406 25.631 6.910 -10.003 1.00 29.69 C ATOM 168 C ASN A 406 24.632 5.851 -10.496 1.00 29.48 C ATOM 169 O ASN A 406 23.500 6.158 -10.855 1.00 37.33 O ATOM 170 CB ASN A 406 25.429 8.266 -10.704 1.00 32.09 C ATOM 171 CG ASN A 406 25.788 8.239 -12.176 1.00 34.06 C ATOM 172 OD1 ASN A 406 26.781 7.637 -12.579 1.00 38.08 O ATOM 173 ND2 ASN A 406 24.979 8.909 -12.987 1.00 34.50 N ATOM 174 HD22 ASN A 406 24.150 9.404 -12.602 1.00 0.00 H ATOM 175 HD21 ASN A 406 25.174 8.939 -14.008 1.00 0.00 H ATOM 176 H ASN A 406 27.504 6.645 -11.039 1.00 0.00 H ATOM 177 N ALA A 407 25.118 4.620 -10.605 1.00 31.82 N ATOM 178 CA ALA A 407 24.299 3.444 -10.898 1.00 33.45 C ATOM 179 C ALA A 407 24.370 2.436 -9.733 1.00 28.97 C ATOM 180 O ALA A 407 25.250 2.539 -8.880 1.00 26.27 O ATOM 181 CB ALA A 407 24.764 2.799 -12.205 1.00 23.56 C ATOM 182 H ALA A 407 26.141 4.484 -10.474 1.00 0.00 H ATOM 183 N PRO A 408 23.422 1.481 -9.666 1.00 25.13 N ATOM 184 CA PRO A 408 23.524 0.443 -8.627 1.00 22.54 C ATOM 185 C PRO A 408 24.796 -0.391 -8.755 1.00 28.54 C ATOM 186 O PRO A 408 25.215 -0.682 -9.874 1.00 26.49 O ATOM 187 CB PRO A 408 22.299 -0.449 -8.876 1.00 25.10 C ATOM 188 CG PRO A 408 21.392 0.335 -9.738 1.00 33.86 C ATOM 189 CD PRO A 408 22.232 1.300 -10.516 1.00 27.46 C ATOM 190 N SER A 409 25.394 -0.761 -7.626 1.00 24.92 N ATOM 191 CA SER A 409 26.511 -1.701 -7.607 1.00 32.07 C ATOM 192 C SER A 409 26.027 -3.114 -7.907 1.00 34.94 C ATOM 193 O SER A 409 24.826 -3.393 -7.831 1.00 30.95 O ATOM 194 CB SER A 409 27.218 -1.678 -6.254 1.00 40.80 C ATOM 195 OG SER A 409 26.444 -2.352 -5.278 1.00 26.96 O ATOM 196 HG SER A 409 26.917 -2.327 -4.409 1.00 0.00 H ATOM 197 H SER A 409 25.054 -0.367 -6.726 1.00 0.00 H ATOM 198 N ASP A 410 26.962 -3.991 -8.271 1.00 36.63 N ATOM 199 CA ASP A 410 26.659 -5.402 -8.521 1.00 32.85 C ATOM 200 C ASP A 410 25.952 -6.048 -7.331 1.00 35.92 C ATOM 201 O ASP A 410 25.013 -6.822 -7.508 1.00 37.96 O ATOM 202 CB ASP A 410 27.940 -6.182 -8.846 1.00 39.35 C ATOM 203 CG ASP A 410 28.321 -6.104 -10.318 1.00 44.11 C ATOM 204 OD1 ASP A 410 27.953 -5.113 -10.983 1.00 44.90 O ATOM 205 OD2 ASP A 410 28.991 -7.038 -10.811 1.00 52.46 O ATOM 206 H ASP A 410 27.942 -3.662 -8.382 1.00 0.00 H ATOM 207 N GLN A 411 26.410 -5.726 -6.123 1.00 34.55 N ATOM 208 CA GLN A 411 25.787 -6.226 -4.903 1.00 40.56 C ATOM 209 C GLN A 411 24.326 -5.806 -4.779 1.00 41.29 C ATOM 210 O GLN A 411 23.465 -6.616 -4.432 1.00 40.84 O ATOM 211 CB GLN A 411 26.553 -5.744 -3.672 1.00 50.89 C ATOM 212 CG GLN A 411 27.586 -6.725 -3.146 1.00 59.07 C ATOM 213 CD GLN A 411 27.893 -6.490 -1.681 1.00 66.64 C ATOM 214 OE1 GLN A 411 27.012 -6.107 -0.907 1.00 67.81 O ATOM 215 NE2 GLN A 411 29.147 -6.708 -1.291 1.00 66.69 N ATOM 216 HE22 GLN A 411 29.857 -7.031 -1.979 1.00 0.00 H ATOM 217 HE21 GLN A 411 29.417 -6.556 -0.298 1.00 0.00 H ATOM 218 H GLN A 411 27.237 -5.099 -6.047 1.00 0.00 H ATOM 219 N LEU A 412 24.052 -4.534 -5.054 1.00 33.92 N ATOM 220 CA LEU A 412 22.694 -4.015 -4.946 1.00 27.19 C ATOM 221 C LEU A 412 21.797 -4.632 -6.014 1.00 26.45 C ATOM 222 O LEU A 412 20.659 -5.009 -5.741 1.00 31.80 O ATOM 223 CB LEU A 412 22.693 -2.488 -5.057 1.00 31.74 C ATOM 224 CG LEU A 412 21.359 -1.775 -4.819 1.00 30.89 C ATOM 225 CD1 LEU A 412 20.730 -2.197 -3.503 1.00 25.78 C ATOM 226 CD2 LEU A 412 21.549 -0.270 -4.850 1.00 26.99 C ATOM 227 H LEU A 412 24.820 -3.899 -5.351 1.00 0.00 H ATOM 228 N ILE A 413 22.322 -4.733 -7.230 1.00 35.34 N ATOM 229 CA ILE A 413 21.606 -5.341 -8.346 1.00 30.71 C ATOM 230 C ILE A 413 21.152 -6.755 -8.000 1.00 33.16 C ATOM 231 O ILE A 413 20.018 -7.139 -8.290 1.00 37.06 O ATOM 232 CB ILE A 413 22.484 -5.364 -9.617 1.00 33.73 C ATOM 233 CG1 ILE A 413 22.552 -3.961 -10.231 1.00 33.58 C ATOM 234 CG2 ILE A 413 21.962 -6.380 -10.632 1.00 33.47 C ATOM 235 CD1 ILE A 413 23.573 -3.830 -11.352 1.00 34.43 C ATOM 236 H ILE A 413 23.281 -4.364 -7.393 1.00 0.00 H ATOM 237 N ASN A 414 22.035 -7.517 -7.362 1.00 33.79 N ATOM 238 CA ASN A 414 21.710 -8.875 -6.933 1.00 46.16 C ATOM 239 C ASN A 414 20.549 -8.900 -5.947 1.00 43.21 C ATOM 240 O ASN A 414 19.692 -9.783 -6.001 1.00 37.49 O ATOM 241 CB ASN A 414 22.933 -9.546 -6.309 1.00 54.50 C ATOM 242 CG ASN A 414 23.854 -10.154 -7.345 1.00 61.79 C ATOM 243 OD1 ASN A 414 23.404 -10.834 -8.267 1.00 66.01 O ATOM 244 ND2 ASN A 414 25.152 -9.909 -7.201 1.00 59.72 N ATOM 245 HD22 ASN A 414 25.486 -9.328 -6.406 1.00 0.00 H ATOM 246 HD21 ASN A 414 25.833 -10.298 -7.884 1.00 0.00 H ATOM 247 H ASN A 414 22.982 -7.136 -7.163 1.00 0.00 H ATOM 248 N ILE A 415 20.530 -7.928 -5.043 1.00 37.13 N ATOM 249 CA ILE A 415 19.433 -7.806 -4.096 1.00 33.76 C ATOM 250 C ILE A 415 18.149 -7.463 -4.848 1.00 36.98 C ATOM 251 O ILE A 415 17.100 -8.058 -4.594 1.00 38.42 O ATOM 252 CB ILE A 415 19.739 -6.749 -3.025 1.00 36.56 C ATOM 253 CG1 ILE A 415 20.709 -7.327 -1.991 1.00 32.95 C ATOM 254 CG2 ILE A 415 18.460 -6.262 -2.353 1.00 26.22 C ATOM 255 CD1 ILE A 415 21.133 -6.337 -0.934 1.00 34.12 C ATOM 256 H ILE A 415 21.312 -7.243 -5.012 1.00 0.00 H ATOM 257 N PHE A 416 18.250 -6.520 -5.784 1.00 33.51 N ATOM 258 CA PHE A 416 17.135 -6.154 -6.654 1.00 32.16 C ATOM 259 C PHE A 416 16.544 -7.376 -7.364 1.00 33.19 C ATOM 260 O PHE A 416 15.327 -7.527 -7.464 1.00 32.95 O ATOM 261 CB PHE A 416 17.581 -5.129 -7.706 1.00 25.67 C ATOM 262 CG PHE A 416 17.794 -3.739 -7.169 1.00 28.95 C ATOM 263 CD1 PHE A 416 17.445 -3.412 -5.868 1.00 22.68 C ATOM 264 CD2 PHE A 416 18.345 -2.754 -7.978 1.00 25.33 C ATOM 265 CE1 PHE A 416 17.646 -2.123 -5.386 1.00 23.88 C ATOM 266 CE2 PHE A 416 18.542 -1.472 -7.506 1.00 21.79 C ATOM 267 CZ PHE A 416 18.192 -1.155 -6.207 1.00 26.44 C ATOM 268 H PHE A 416 19.158 -6.026 -5.900 1.00 0.00 H ATOM 269 N GLU A 417 17.413 -8.247 -7.858 1.00 30.51 N ATOM 270 CA GLU A 417 16.971 -9.375 -8.671 1.00 40.14 C ATOM 271 C GLU A 417 16.465 -10.564 -7.858 1.00 39.09 C ATOM 272 O GLU A 417 15.838 -11.466 -8.409 1.00 43.57 O ATOM 273 CB GLU A 417 18.103 -9.815 -9.598 1.00 40.79 C ATOM 274 CG GLU A 417 18.346 -8.815 -10.713 1.00 44.14 C ATOM 275 CD GLU A 417 19.573 -9.122 -11.534 1.00 52.35 C ATOM 276 OE1 GLU A 417 19.638 -8.650 -12.688 1.00 51.40 O ATOM 277 OE2 GLU A 417 20.473 -9.823 -11.023 1.00 61.17 O ATOM 278 H GLU A 417 18.427 -8.124 -7.663 1.00 0.00 H ATOM 279 N SER A 418 16.717 -10.563 -6.553 1.00 41.03 N ATOM 280 CA SER A 418 16.191 -11.621 -5.693 1.00 40.86 C ATOM 281 C SER A 418 14.753 -11.297 -5.281 1.00 46.08 C ATOM 282 O SER A 418 14.090 -12.095 -4.621 1.00 53.16 O ATOM 283 CB SER A 418 17.071 -11.815 -4.455 1.00 39.71 C ATOM 284 OG SER A 418 16.898 -10.762 -3.522 1.00 45.93 O ATOM 285 HG SER A 418 17.142 -9.902 -3.948 1.00 0.00 H ATOM 286 H SER A 418 17.294 -9.802 -6.140 1.00 0.00 H ATOM 287 N CYS A 419 14.280 -10.120 -5.676 1.00 41.19 N ATOM 288 CA CYS A 419 12.905 -9.715 -5.402 1.00 38.51 C ATOM 289 C CYS A 419 11.934 -10.271 -6.432 1.00 38.28 C ATOM 290 O CYS A 419 12.232 -10.288 -7.628 1.00 36.96 O ATOM 291 CB CYS A 419 12.786 -8.192 -5.376 1.00 34.76 C ATOM 292 SG CYS A 419 13.674 -7.387 -4.039 1.00 43.57 S ATOM 293 H CYS A 419 14.906 -9.470 -6.194 1.00 0.00 H ATOM 294 N VAL A 420 10.772 -10.716 -5.960 1.00 37.96 N ATOM 295 CA VAL A 420 9.671 -11.086 -6.842 1.00 39.82 C ATOM 296 C VAL A 420 9.398 -9.951 -7.826 1.00 37.39 C ATOM 297 O VAL A 420 9.224 -10.178 -9.020 1.00 40.88 O ATOM 298 CB VAL A 420 8.386 -11.407 -6.048 1.00 43.18 C ATOM 299 CG1 VAL A 420 7.201 -11.572 -6.986 1.00 48.19 C ATOM 300 CG2 VAL A 420 8.581 -12.658 -5.205 1.00 47.67 C ATOM 301 H VAL A 420 10.645 -10.803 -4.931 1.00 0.00 H ATOM 302 N ARG A 421 9.367 -8.724 -7.318 1.00 36.68 N ATOM 303 CA ARG A 421 9.284 -7.558 -8.189 1.00 41.03 C ATOM 304 C ARG A 421 10.560 -6.723 -8.068 1.00 35.67 C ATOM 305 O ARG A 421 10.783 -6.059 -7.059 1.00 31.58 O ATOM 306 CB ARG A 421 8.037 -6.729 -7.855 1.00 27.63 C ATOM 307 CG ARG A 421 6.746 -7.531 -7.993 1.00 29.32 C ATOM 308 CD ARG A 421 5.497 -6.727 -7.655 1.00 28.49 C ATOM 309 NE ARG A 421 5.431 -6.359 -6.243 1.00 30.52 N ATOM 310 CZ ARG A 421 5.098 -7.195 -5.262 1.00 35.18 C ATOM 311 NH1 ARG A 421 4.806 -8.465 -5.528 1.00 37.44 N ATOM 312 NH2 ARG A 421 5.063 -6.762 -4.009 1.00 32.36 N ATOM 313 HE ARG A 421 5.660 -5.377 -5.987 1.00 0.00 H ATOM 314 HH12 ARG A 421 4.547 -9.112 -4.756 1.00 0.00 H ATOM 315 HH11 ARG A 421 4.837 -8.811 -6.508 1.00 0.00 H ATOM 316 HH22 ARG A 421 4.803 -7.413 -3.241 1.00 0.00 H ATOM 317 HH21 ARG A 421 5.295 -5.771 -3.795 1.00 0.00 H ATOM 318 H ARG A 421 9.402 -8.594 -6.287 1.00 0.00 H ATOM 319 N ASN A 422 11.383 -6.762 -9.114 1.00 37.30 N ATOM 320 CA ASN A 422 12.658 -6.049 -9.154 1.00 34.42 C ATOM 321 C ASN A 422 12.434 -4.549 -9.324 1.00 32.38 C ATOM 322 O ASN A 422 11.943 -4.114 -10.360 1.00 33.46 O ATOM 323 CB ASN A 422 13.527 -6.594 -10.297 1.00 37.53 C ATOM 324 CG ASN A 422 14.920 -5.974 -10.342 1.00 38.35 C ATOM 325 OD1 ASN A 422 15.178 -4.939 -9.741 1.00 35.81 O ATOM 326 ND2 ASN A 422 15.823 -6.616 -11.071 1.00 45.33 N ATOM 327 HD22 ASN A 422 15.563 -7.493 -11.566 1.00 0.00 H ATOM 328 HD21 ASN A 422 16.791 -6.243 -11.147 1.00 0.00 H ATOM 329 H ASN A 422 11.105 -7.327 -9.942 1.00 0.00 H ATOM 330 N PRO A 423 12.803 -3.759 -8.300 1.00 23.14 N ATOM 331 CA PRO A 423 12.615 -2.302 -8.231 1.00 21.65 C ATOM 332 C PRO A 423 13.511 -1.466 -9.153 1.00 26.87 C ATOM 333 O PRO A 423 13.241 -0.270 -9.287 1.00 30.98 O ATOM 334 CB PRO A 423 12.933 -1.986 -6.770 1.00 20.83 C ATOM 335 CG PRO A 423 13.957 -3.012 -6.402 1.00 21.46 C ATOM 336 CD PRO A 423 13.515 -4.271 -7.113 1.00 23.30 C ATOM 337 N VAL A 424 14.560 -2.055 -9.732 1.00 29.51 N ATOM 338 CA VAL A 424 15.624 -1.275 -10.381 1.00 32.96 C ATOM 339 C VAL A 424 15.135 -0.255 -11.424 1.00 29.75 C ATOM 340 O VAL A 424 15.688 0.837 -11.530 1.00 28.58 O ATOM 341 CB VAL A 424 16.683 -2.202 -11.049 1.00 30.48 C ATOM 342 CG1 VAL A 424 16.081 -3.034 -12.179 1.00 25.24 C ATOM 343 CG2 VAL A 424 17.882 -1.383 -11.549 1.00 23.29 C ATOM 344 H VAL A 424 14.626 -3.093 -9.724 1.00 0.00 H ATOM 345 N GLU A 425 14.090 -0.589 -12.170 1.00 28.43 N ATOM 346 CA GLU A 425 13.592 0.313 -13.203 1.00 27.39 C ATOM 347 C GLU A 425 12.770 1.451 -12.617 1.00 22.31 C ATOM 348 O GLU A 425 12.891 2.596 -13.046 1.00 26.71 O ATOM 349 CB GLU A 425 12.760 -0.453 -14.233 1.00 36.01 C ATOM 350 CG GLU A 425 13.591 -1.259 -15.216 1.00 54.46 C ATOM 351 CD GLU A 425 14.407 -0.378 -16.142 1.00 68.35 C ATOM 352 OE1 GLU A 425 13.919 -0.071 -17.252 1.00 77.05 O ATOM 353 OE2 GLU A 425 15.534 0.011 -15.762 1.00 67.87 O ATOM 354 H GLU A 425 13.620 -1.504 -12.017 1.00 0.00 H ATOM 355 N ASN A 426 11.930 1.139 -11.639 1.00 22.67 N ATOM 356 CA ASN A 426 11.116 2.167 -11.014 1.00 24.20 C ATOM 357 C ASN A 426 11.969 3.125 -10.194 1.00 26.45 C ATOM 358 O ASN A 426 11.648 4.309 -10.083 1.00 25.82 O ATOM 359 CB ASN A 426 10.030 1.539 -10.147 1.00 22.08 C ATOM 360 CG ASN A 426 9.072 0.687 -10.955 1.00 37.39 C ATOM 361 OD1 ASN A 426 8.980 0.825 -12.174 1.00 37.30 O ATOM 362 ND2 ASN A 426 8.353 -0.202 -10.279 1.00 40.84 N ATOM 363 HD22 ASN A 426 8.463 -0.284 -9.248 1.00 0.00 H ATOM 364 HD21 ASN A 426 7.680 -0.816 -10.781 1.00 0.00 H ATOM 365 H ASN A 426 11.854 0.153 -11.318 1.00 0.00 H ATOM 366 N ILE A 427 13.059 2.614 -9.630 1.00 25.75 N ATOM 367 CA ILE A 427 13.993 3.455 -8.886 1.00 19.79 C ATOM 368 C ILE A 427 14.684 4.430 -9.838 1.00 24.70 C ATOM 369 O ILE A 427 14.753 5.627 -9.557 1.00 25.13 O ATOM 370 CB ILE A 427 15.039 2.611 -8.134 1.00 19.28 C ATOM 371 CG1 ILE A 427 14.380 1.868 -6.972 1.00 18.50 C ATOM 372 CG2 ILE A 427 16.185 3.476 -7.627 1.00 17.57 C ATOM 373 CD1 ILE A 427 15.300 0.867 -6.289 1.00 17.41 C ATOM 374 H ILE A 427 13.250 1.596 -9.720 1.00 0.00 H ATOM 375 N MET A 428 15.172 3.920 -10.970 1.00 17.83 N ATOM 376 CA MET A 428 15.750 4.773 -12.010 1.00 19.99 C ATOM 377 C MET A 428 14.791 5.879 -12.449 1.00 23.74 C ATOM 378 O MET A 428 15.197 7.027 -12.631 1.00 24.24 O ATOM 379 CB MET A 428 16.153 3.943 -13.231 1.00 28.87 C ATOM 380 CG MET A 428 17.401 3.097 -13.034 1.00 41.42 C ATOM 381 SD MET A 428 17.719 1.981 -14.422 1.00 85.18 S ATOM 382 CE MET A 428 17.940 3.158 -15.756 1.00 68.67 C ATOM 383 H MET A 428 15.141 2.891 -11.117 1.00 0.00 H ATOM 384 N LYS A 429 13.523 5.525 -12.627 1.00 25.30 N ATOM 385 CA LYS A 429 12.508 6.486 -13.053 1.00 21.28 C ATOM 386 C LYS A 429 12.307 7.600 -12.025 1.00 20.83 C ATOM 387 O LYS A 429 12.196 8.767 -12.389 1.00 20.65 O ATOM 388 CB LYS A 429 11.182 5.773 -13.325 1.00 21.41 C ATOM 389 CG LYS A 429 11.147 5.032 -14.648 1.00 19.39 C ATOM 390 CD LYS A 429 9.806 4.347 -14.876 1.00 27.63 C ATOM 391 CE LYS A 429 9.791 3.606 -16.210 1.00 26.14 C ATOM 392 NZ LYS A 429 8.505 2.886 -16.441 1.00 37.01 N ATOM 393 HZ1 LYS A 429 8.358 2.190 -15.683 1.00 0.00 H ATOM 394 HZ2 LYS A 429 7.722 3.570 -16.442 1.00 0.00 H ATOM 395 HZ3 LYS A 429 8.542 2.398 -17.359 1.00 0.00 H ATOM 396 H LYS A 429 13.245 4.537 -12.459 1.00 0.00 H ATOM 397 N ILE A 430 12.264 7.239 -10.747 1.00 15.00 N ATOM 398 CA ILE A 430 12.180 8.226 -9.675 1.00 16.26 C ATOM 399 C ILE A 430 13.381 9.190 -9.706 1.00 23.55 C ATOM 400 O ILE A 430 13.203 10.411 -9.654 1.00 21.68 O ATOM 401 CB ILE A 430 12.082 7.542 -8.292 1.00 15.26 C ATOM 402 CG1 ILE A 430 10.718 6.856 -8.129 1.00 17.44 C ATOM 403 CG2 ILE A 430 12.291 8.551 -7.177 1.00 19.56 C ATOM 404 CD1 ILE A 430 10.582 5.987 -6.878 1.00 14.06 C ATOM 405 H ILE A 430 12.291 6.228 -10.504 1.00 0.00 H ATOM 406 N LEU A 431 14.597 8.654 -9.816 1.00 25.66 N ATOM 407 CA LEU A 431 15.788 9.510 -9.885 1.00 25.92 C ATOM 408 C LEU A 431 15.767 10.404 -11.125 1.00 26.72 C ATOM 409 O LEU A 431 16.209 11.555 -11.084 1.00 13.96 O ATOM 410 CB LEU A 431 17.070 8.679 -9.881 1.00 22.38 C ATOM 411 CG LEU A 431 17.368 7.817 -8.653 1.00 31.91 C ATOM 412 CD1 LEU A 431 18.846 7.441 -8.621 1.00 42.11 C ATOM 413 CD2 LEU A 431 16.953 8.504 -7.366 1.00 26.15 C ATOM 414 H LEU A 431 14.703 7.620 -9.853 1.00 0.00 H ATOM 415 N LYS A 432 15.242 9.870 -12.222 1.00 19.98 N ATOM 416 CA LYS A 432 15.115 10.637 -13.453 1.00 23.23 C ATOM 417 C LYS A 432 14.096 11.777 -13.291 1.00 22.16 C ATOM 418 O LYS A 432 14.330 12.895 -13.739 1.00 22.34 O ATOM 419 CB LYS A 432 14.710 9.721 -14.610 1.00 26.24 C ATOM 420 CG LYS A 432 14.830 10.371 -15.979 1.00 35.73 C ATOM 421 CD LYS A 432 14.396 9.432 -17.098 1.00 40.46 C ATOM 422 CE LYS A 432 14.487 10.123 -18.453 1.00 48.94 C ATOM 423 NZ LYS A 432 14.028 9.255 -19.576 1.00 53.02 N ATOM 424 HZ1 LYS A 432 14.618 8.399 -19.615 1.00 0.00 H ATOM 425 HZ2 LYS A 432 13.035 8.986 -19.422 1.00 0.00 H ATOM 426 HZ3 LYS A 432 14.112 9.776 -20.472 1.00 0.00 H ATOM 427 H LYS A 432 14.915 8.883 -12.201 1.00 0.00 H ATOM 428 N GLY A 433 12.966 11.484 -12.656 1.00 16.15 N ATOM 429 CA GLY A 433 11.951 12.490 -12.404 1.00 18.92 C ATOM 430 C GLY A 433 12.453 13.573 -11.458 1.00 24.48 C ATOM 431 O GLY A 433 12.283 14.764 -11.719 1.00 20.25 O ATOM 432 H GLY A 433 12.805 10.509 -12.331 1.00 0.00 H ATOM 433 N ILE A 434 13.073 13.146 -10.359 1.00 18.02 N ATOM 434 CA ILE A 434 13.632 14.049 -9.357 1.00 13.29 C ATOM 435 C ILE A 434 14.733 14.907 -9.951 1.00 18.16 C ATOM 436 O ILE A 434 14.796 16.109 -9.707 1.00 20.53 O ATOM 437 CB ILE A 434 14.202 13.268 -8.152 1.00 12.59 C ATOM 438 CG1 ILE A 434 13.070 12.693 -7.299 1.00 15.43 C ATOM 439 CG2 ILE A 434 15.119 14.146 -7.323 1.00 12.05 C ATOM 440 CD1 ILE A 434 13.558 12.002 -6.028 1.00 11.72 C ATOM 441 H ILE A 434 13.163 12.121 -10.208 1.00 0.00 H ATOM 442 N GLY A 435 15.585 14.278 -10.752 1.00 22.74 N ATOM 443 CA GLY A 435 16.666 14.972 -11.421 1.00 20.44 C ATOM 444 C GLY A 435 16.203 16.072 -12.357 1.00 23.85 C ATOM 445 O GLY A 435 16.800 17.150 -12.396 1.00 26.24 O ATOM 446 H GLY A 435 15.473 13.255 -10.904 1.00 0.00 H ATOM 447 N GLU A 436 15.153 15.802 -13.127 1.00 21.59 N ATOM 448 CA GLU A 436 14.646 16.789 -14.077 1.00 21.14 C ATOM 449 C GLU A 436 14.007 17.968 -13.350 1.00 18.16 C ATOM 450 O GLU A 436 14.275 19.119 -13.681 1.00 24.08 O ATOM 451 CB GLU A 436 13.637 16.162 -15.040 1.00 21.54 C ATOM 452 CG GLU A 436 13.000 17.171 -15.992 1.00 42.80 C ATOM 453 CD GLU A 436 12.100 16.527 -17.035 1.00 54.42 C ATOM 454 OE1 GLU A 436 11.987 15.282 -17.044 1.00 62.11 O ATOM 455 OE2 GLU A 436 11.509 17.267 -17.851 1.00 53.47 O ATOM 456 H GLU A 436 14.686 14.876 -13.052 1.00 0.00 H ATOM 457 N THR A 437 13.163 17.676 -12.363 1.00 17.25 N ATOM 458 CA THR A 437 12.490 18.723 -11.595 1.00 21.75 C ATOM 459 C THR A 437 13.499 19.599 -10.840 1.00 19.66 C ATOM 460 O THR A 437 13.352 20.829 -10.787 1.00 15.82 O ATOM 461 CB THR A 437 11.478 18.118 -10.597 1.00 14.77 C ATOM 462 OG1 THR A 437 10.486 17.385 -11.319 1.00 22.88 O ATOM 463 CG2 THR A 437 10.798 19.201 -9.774 1.00 15.04 C ATOM 464 HG1 THR A 437 9.836 16.996 -10.682 1.00 0.00 H ATOM 465 H THR A 437 12.978 16.679 -12.132 1.00 0.00 H ATOM 466 N PHE A 438 14.519 18.954 -10.272 1.00 19.86 N ATOM 467 CA PHE A 438 15.606 19.654 -9.579 1.00 21.39 C ATOM 468 C PHE A 438 16.319 20.627 -10.513 1.00 21.48 C ATOM 469 O PHE A 438 16.531 21.788 -10.168 1.00 22.16 O ATOM 470 CB PHE A 438 16.619 18.656 -8.996 1.00 14.38 C ATOM 471 CG PHE A 438 17.912 19.299 -8.529 1.00 16.54 C ATOM 472 CD1 PHE A 438 17.957 20.033 -7.349 1.00 17.43 C ATOM 473 CD2 PHE A 438 19.082 19.158 -9.266 1.00 16.91 C ATOM 474 CE1 PHE A 438 19.148 20.627 -6.914 1.00 19.90 C ATOM 475 CE2 PHE A 438 20.275 19.748 -8.838 1.00 22.41 C ATOM 476 CZ PHE A 438 20.308 20.485 -7.664 1.00 17.17 C ATOM 477 H PHE A 438 14.545 17.916 -10.322 1.00 0.00 H ATOM 478 N CYS A 439 16.690 20.148 -11.697 1.00 19.08 N ATOM 479 CA CYS A 439 17.365 20.993 -12.678 1.00 18.61 C ATOM 480 C CYS A 439 16.507 22.162 -13.150 1.00 19.24 C ATOM 481 O CYS A 439 17.012 23.268 -13.347 1.00 27.92 O ATOM 482 CB CYS A 439 17.811 20.153 -13.876 1.00 21.49 C ATOM 483 SG CYS A 439 19.277 19.136 -13.531 1.00 33.02 S ATOM 484 H CYS A 439 16.496 19.153 -11.928 1.00 0.00 H ATOM 485 N GLN A 440 15.211 21.923 -13.329 1.00 18.64 N ATOM 486 CA GLN A 440 14.295 22.975 -13.770 1.00 19.01 C ATOM 487 C GLN A 440 14.212 24.121 -12.762 1.00 19.19 C ATOM 488 O GLN A 440 14.255 25.288 -13.135 1.00 24.18 O ATOM 489 CB GLN A 440 12.901 22.403 -14.008 1.00 36.32 C ATOM 490 CG GLN A 440 12.787 21.454 -15.185 1.00 29.80 C ATOM 491 CD GLN A 440 11.405 20.833 -15.278 1.00 36.51 C ATOM 492 OE1 GLN A 440 10.711 20.685 -14.273 1.00 43.16 O ATOM 493 NE2 GLN A 440 10.995 20.477 -16.486 1.00 41.97 N ATOM 494 HE22 GLN A 440 11.615 20.620 -17.309 1.00 0.00 H ATOM 495 HE21 GLN A 440 10.053 20.054 -16.612 1.00 0.00 H ATOM 496 H GLN A 440 14.841 20.967 -13.152 1.00 0.00 H ATOM 497 N HIS A 441 14.094 23.780 -11.483 1.00 20.51 N ATOM 498 CA HIS A 441 14.021 24.783 -10.426 1.00 23.40 C ATOM 499 C HIS A 441 15.379 25.439 -10.166 1.00 18.87 C ATOM 500 O HIS A 441 15.459 26.639 -9.909 1.00 20.90 O ATOM 501 CB HIS A 441 13.480 24.152 -9.136 1.00 23.57 C ATOM 502 CG HIS A 441 11.994 23.963 -9.138 1.00 25.65 C ATOM 503 ND1 HIS A 441 11.125 24.905 -8.631 1.00 26.05 N ATOM 504 CD2 HIS A 441 11.223 22.946 -9.595 1.00 19.39 C ATOM 505 CE1 HIS A 441 9.883 24.474 -8.767 1.00 26.62 C ATOM 506 NE2 HIS A 441 9.914 23.289 -9.351 1.00 19.09 N ATOM 507 H HIS A 441 14.053 22.772 -11.229 1.00 0.00 H ATOM 508 N TYR A 442 16.442 24.644 -10.241 1.00 18.14 N ATOM 509 CA TYR A 442 17.796 25.129 -9.997 1.00 18.56 C ATOM 510 C TYR A 442 18.185 26.218 -10.998 1.00 24.12 C ATOM 511 O TYR A 442 18.761 27.238 -10.629 1.00 21.77 O ATOM 512 CB TYR A 442 18.778 23.959 -10.064 1.00 19.24 C ATOM 513 CG TYR A 442 20.204 24.273 -9.696 1.00 26.67 C ATOM 514 CD1 TYR A 442 20.682 24.025 -8.416 1.00 17.70 C ATOM 515 CD2 TYR A 442 21.087 24.789 -10.638 1.00 27.09 C ATOM 516 CE1 TYR A 442 21.997 24.291 -8.084 1.00 24.06 C ATOM 517 CE2 TYR A 442 22.402 25.056 -10.315 1.00 25.41 C ATOM 518 CZ TYR A 442 22.852 24.815 -9.037 1.00 24.93 C ATOM 519 OH TYR A 442 24.164 25.090 -8.718 1.00 27.32 O ATOM 520 HH TYR A 442 24.326 24.863 -7.768 1.00 0.00 H ATOM 521 H TYR A 442 16.303 23.642 -10.482 1.00 0.00 H ATOM 522 N THR A 443 17.840 26.004 -12.263 1.00 20.55 N ATOM 523 CA THR A 443 18.264 26.891 -13.340 1.00 28.97 C ATOM 524 C THR A 443 17.303 28.053 -13.600 1.00 30.15 C ATOM 525 O THR A 443 17.553 28.873 -14.480 1.00 38.10 O ATOM 526 CB THR A 443 18.454 26.097 -14.654 1.00 25.13 C ATOM 527 OG1 THR A 443 17.253 25.376 -14.955 1.00 27.07 O ATOM 528 CG2 THR A 443 19.592 25.097 -14.510 1.00 21.69 C ATOM 529 HG1 THR A 443 17.052 24.749 -14.216 1.00 0.00 H ATOM 530 H THR A 443 17.250 25.179 -12.492 1.00 0.00 H ATOM 531 N GLN A 444 16.215 28.130 -12.836 1.00 37.49 N ATOM 532 CA GLN A 444 15.230 29.209 -13.012 1.00 40.78 C ATOM 533 C GLN A 444 15.128 30.111 -11.775 1.00 41.20 C ATOM 534 O GLN A 444 15.173 29.629 -10.645 1.00 40.78 O ATOM 535 CB GLN A 444 13.857 28.619 -13.356 1.00 43.31 C ATOM 536 CG GLN A 444 13.806 27.982 -14.746 1.00 53.82 C ATOM 537 CD GLN A 444 12.493 27.273 -15.040 1.00 60.89 C ATOM 538 OE1 GLN A 444 11.424 27.709 -14.610 1.00 68.43 O ATOM 539 NE2 GLN A 444 12.571 26.171 -15.782 1.00 55.98 N ATOM 540 HE22 GLN A 444 13.495 25.839 -16.124 1.00 0.00 H ATOM 541 HE21 GLN A 444 11.708 25.642 -16.020 1.00 0.00 H ATOM 542 H GLN A 444 16.058 27.413 -12.100 1.00 0.00 H ATOM 543 N SER A 445 14.985 31.418 -11.997 1.00 51.63 N ATOM 544 CA SER A 445 14.993 32.404 -10.908 1.00 55.15 C ATOM 545 C SER A 445 13.595 32.789 -10.406 1.00 56.26 C ATOM 546 O SER A 445 12.719 33.145 -11.191 1.00 57.94 O ATOM 547 CB SER A 445 15.744 33.661 -11.353 1.00 56.82 C ATOM 548 OG SER A 445 15.330 34.068 -12.644 1.00 60.51 O ATOM 549 HG SER A 445 14.360 34.265 -12.631 1.00 0.00 H ATOM 550 H SER A 445 14.864 31.751 -12.975 1.00 0.00 H ATOM 551 N THR A 446 13.406 32.702 -9.089 1.00 58.14 N ATOM 552 CA THR A 446 12.111 32.934 -8.436 1.00 69.86 C ATOM 553 C THR A 446 11.903 34.319 -7.820 1.00 78.83 C ATOM 554 O THR A 446 10.885 34.542 -7.156 1.00 87.89 O ATOM 555 CB THR A 446 11.871 31.911 -7.315 1.00 69.85 C ATOM 556 OG1 THR A 446 13.016 31.866 -6.454 1.00 74.49 O ATOM 557 CG2 THR A 446 11.620 30.538 -7.899 1.00 60.86 C ATOM 558 HG1 THR A 446 12.859 31.206 -5.733 1.00 0.00 H ATOM 559 H THR A 446 14.221 32.456 -8.491 1.00 0.00 H ATOM 560 N ASP A 447 12.874 35.208 -8.028 1.00 72.15 N ATOM 561 CA ASP A 447 12.989 36.532 -7.395 1.00 74.07 C ATOM 562 C ASP A 447 13.542 36.498 -5.970 1.00 72.53 C ATOM 563 O ASP A 447 14.039 37.513 -5.480 1.00 77.60 O ATOM 564 CB ASP A 447 11.630 37.249 -7.354 1.00 75.95 C ATOM 565 CG ASP A 447 11.468 38.271 -8.447 1.00 78.74 C ATOM 566 OD1 ASP A 447 12.329 38.325 -9.348 1.00 80.26 O ATOM 567 OD2 ASP A 447 10.465 39.014 -8.404 1.00 80.95 O ATOM 568 H ASP A 447 13.621 34.941 -8.701 1.00 0.00 H ATOM 569 N GLU A 448 13.459 35.354 -5.299 1.00 65.39 N ATOM 570 CA GLU A 448 14.172 35.178 -4.037 1.00 62.52 C ATOM 571 C GLU A 448 15.467 34.381 -4.213 1.00 57.96 C ATOM 572 O GLU A 448 16.327 34.358 -3.333 1.00 55.98 O ATOM 573 CB GLU A 448 13.261 34.493 -3.018 1.00 60.45 C ATOM 574 CG GLU A 448 11.878 35.119 -2.936 1.00 67.80 C ATOM 575 CD GLU A 448 10.974 34.429 -1.932 1.00 75.48 C ATOM 576 OE1 GLU A 448 11.354 33.349 -1.428 1.00 75.95 O ATOM 577 OE2 GLU A 448 9.880 34.969 -1.650 1.00 76.16 O ATOM 578 H GLU A 448 12.881 34.576 -5.676 1.00 0.00 H ATOM 579 N GLN A 449 15.582 33.728 -5.364 1.00 55.85 N ATOM 580 CA GLN A 449 16.658 32.780 -5.628 1.00 57.69 C ATOM 581 C GLN A 449 17.157 32.858 -7.069 1.00 61.00 C ATOM 582 O GLN A 449 16.584 32.210 -7.946 1.00 67.76 O ATOM 583 CB GLN A 449 16.208 31.354 -5.304 1.00 59.10 C ATOM 584 CG GLN A 449 17.319 30.326 -5.434 1.00 59.84 C ATOM 585 CD GLN A 449 18.598 30.768 -4.751 1.00 58.65 C ATOM 586 OE1 GLN A 449 18.605 31.066 -3.557 1.00 61.80 O ATOM 587 NE2 GLN A 449 19.689 30.819 -5.509 1.00 55.04 N ATOM 588 HE22 GLN A 449 19.636 30.558 -6.514 1.00 0.00 H ATOM 589 HE21 GLN A 449 20.595 31.120 -5.097 1.00 0.00 H ATOM 590 H GLN A 449 14.875 33.900 -6.108 1.00 0.00 H ATOM 591 N PRO A 450 18.180 33.689 -7.332 1.00 59.81 N ATOM 592 CA PRO A 450 18.749 33.763 -8.685 1.00 55.43 C ATOM 593 C PRO A 450 19.064 32.374 -9.250 1.00 53.76 C ATOM 594 O PRO A 450 19.632 31.540 -8.542 1.00 53.86 O ATOM 595 CB PRO A 450 20.035 34.571 -8.486 1.00 52.92 C ATOM 596 CG PRO A 450 19.805 35.356 -7.232 1.00 58.92 C ATOM 597 CD PRO A 450 18.945 34.489 -6.359 1.00 60.20 C ATOM 598 N GLY A 451 18.679 32.131 -10.500 1.00 51.10 N ATOM 599 CA GLY A 451 18.910 30.847 -11.143 1.00 51.02 C ATOM 600 C GLY A 451 20.379 30.608 -11.434 1.00 54.70 C ATOM 601 O GLY A 451 21.165 31.553 -11.513 1.00 56.58 O ATOM 602 H GLY A 451 18.198 32.883 -11.034 1.00 0.00 H ATOM 603 N SER A 452 20.754 29.343 -11.601 1.00 50.19 N ATOM 604 CA SER A 452 22.159 28.988 -11.752 1.00 39.23 C ATOM 605 C SER A 452 22.383 28.024 -12.915 1.00 37.51 C ATOM 606 O SER A 452 21.457 27.342 -13.349 1.00 37.63 O ATOM 607 CB SER A 452 22.680 28.382 -10.453 1.00 42.15 C ATOM 608 OG SER A 452 22.137 29.058 -9.333 1.00 48.71 O ATOM 609 HG SER A 452 22.487 28.650 -8.501 1.00 0.00 H ATOM 610 H SER A 452 20.032 28.595 -11.624 1.00 0.00 H ATOM 611 N HIS A 453 23.618 27.969 -13.406 1.00 37.58 N ATOM 612 CA HIS A 453 23.936 27.237 -14.630 1.00 39.27 C ATOM 613 C HIS A 453 23.680 25.737 -14.499 1.00 39.31 C ATOM 614 O HIS A 453 23.878 25.145 -13.436 1.00 36.63 O ATOM 615 CB HIS A 453 25.391 27.481 -15.033 1.00 40.58 C ATOM 616 CG HIS A 453 25.691 27.125 -16.458 1.00 50.94 C ATOM 617 ND1 HIS A 453 26.148 25.880 -16.837 1.00 43.72 N ATOM 618 CD2 HIS A 453 25.596 27.853 -17.597 1.00 53.29 C ATOM 619 CE1 HIS A 453 26.323 25.857 -18.147 1.00 46.01 C ATOM 620 NE2 HIS A 453 25.994 27.041 -18.631 1.00 53.88 N ATOM 621 H HIS A 453 24.382 28.463 -12.902 1.00 0.00 H ATOM 622 N ILE A 454 23.245 25.134 -15.599 1.00 30.10 N ATOM 623 CA ILE A 454 22.840 23.735 -15.612 1.00 36.21 C ATOM 624 C ILE A 454 24.012 22.784 -15.320 1.00 32.74 C ATOM 625 O ILE A 454 23.816 21.716 -14.741 1.00 30.38 O ATOM 626 CB ILE A 454 22.176 23.373 -16.967 1.00 30.01 C ATOM 627 CG1 ILE A 454 21.582 21.963 -16.925 1.00 33.95 C ATOM 628 CG2 ILE A 454 23.162 23.527 -18.127 1.00 28.47 C ATOM 629 CD1 ILE A 454 20.647 21.733 -15.773 1.00 29.61 C ATOM 630 H ILE A 454 23.192 25.680 -16.483 1.00 0.00 H ATOM 631 N ASP A 455 25.228 23.181 -15.683 1.00 30.83 N ATOM 632 CA ASP A 455 26.393 22.331 -15.453 1.00 30.77 C ATOM 633 C ASP A 455 26.641 22.092 -13.962 1.00 30.83 C ATOM 634 O ASP A 455 27.101 21.023 -13.571 1.00 32.41 O ATOM 635 CB ASP A 455 27.638 22.934 -16.101 1.00 36.74 C ATOM 636 CG ASP A 455 27.588 22.884 -17.617 1.00 41.86 C ATOM 637 OD1 ASP A 455 26.690 22.212 -18.163 1.00 39.67 O ATOM 638 OD2 ASP A 455 28.453 23.511 -18.265 1.00 50.28 O ATOM 639 H ASP A 455 25.351 24.109 -16.137 1.00 0.00 H ATOM 640 N PHE A 456 26.325 23.075 -13.128 1.00 29.31 N ATOM 641 CA PHE A 456 26.471 22.892 -11.690 1.00 32.61 C ATOM 642 C PHE A 456 25.342 22.029 -11.134 1.00 26.23 C ATOM 643 O PHE A 456 25.579 21.167 -10.291 1.00 31.08 O ATOM 644 CB PHE A 456 26.530 24.239 -10.971 1.00 31.45 C ATOM 645 CG PHE A 456 27.844 24.942 -11.131 1.00 33.01 C ATOM 646 CD1 PHE A 456 28.981 24.456 -10.507 1.00 32.63 C ATOM 647 CD2 PHE A 456 27.948 26.081 -11.912 1.00 35.89 C ATOM 648 CE1 PHE A 456 30.201 25.095 -10.657 1.00 32.62 C ATOM 649 CE2 PHE A 456 29.162 26.726 -12.064 1.00 38.69 C ATOM 650 CZ PHE A 456 30.291 26.229 -11.436 1.00 35.65 C ATOM 651 H PHE A 456 25.972 23.979 -13.502 1.00 0.00 H ATOM 652 N ALA A 457 24.125 22.250 -11.623 1.00 18.53 N ATOM 653 CA ALA A 457 22.976 21.429 -11.242 1.00 22.82 C ATOM 654 C ALA A 457 23.262 19.951 -11.459 1.00 26.05 C ATOM 655 O ALA A 457 23.049 19.123 -10.572 1.00 14.62 O ATOM 656 CB ALA A 457 21.749 21.834 -12.030 1.00 21.15 C ATOM 657 H ALA A 457 23.986 23.030 -12.297 1.00 0.00 H ATOM 658 N VAL A 458 23.754 19.639 -12.652 1.00 19.60 N ATOM 659 CA VAL A 458 24.045 18.270 -13.040 1.00 25.99 C ATOM 660 C VAL A 458 25.138 17.666 -12.162 1.00 29.02 C ATOM 661 O VAL A 458 25.049 16.505 -11.759 1.00 29.63 O ATOM 662 CB VAL A 458 24.453 18.203 -14.522 1.00 28.53 C ATOM 663 CG1 VAL A 458 25.007 16.825 -14.874 1.00 24.25 C ATOM 664 CG2 VAL A 458 23.255 18.572 -15.408 1.00 23.38 C ATOM 665 H VAL A 458 23.938 20.403 -13.334 1.00 0.00 H ATOM 666 N ASN A 459 26.158 18.461 -11.854 1.00 30.59 N ATOM 667 CA ASN A 459 27.210 18.010 -10.955 1.00 27.75 C ATOM 668 C ASN A 459 26.676 17.760 -9.545 1.00 30.76 C ATOM 669 O ASN A 459 27.032 16.765 -8.915 1.00 25.43 O ATOM 670 CB ASN A 459 28.351 19.016 -10.899 1.00 31.23 C ATOM 671 CG ASN A 459 29.277 18.764 -9.731 1.00 42.68 C ATOM 672 OD1 ASN A 459 29.312 19.536 -8.771 1.00 48.11 O ATOM 673 ND2 ASN A 459 30.014 17.660 -9.791 1.00 40.25 N ATOM 674 HD22 ASN A 459 29.952 17.038 -10.622 1.00 0.00 H ATOM 675 HD21 ASN A 459 30.653 17.418 -9.007 1.00 0.00 H ATOM 676 H ASN A 459 26.205 19.417 -12.261 1.00 0.00 H ATOM 677 N ARG A 460 25.834 18.662 -9.048 1.00 15.44 N ATOM 678 CA ARG A 460 25.153 18.426 -7.773 1.00 31.11 C ATOM 679 C ARG A 460 24.377 17.111 -7.837 1.00 22.61 C ATOM 680 O ARG A 460 24.482 16.257 -6.956 1.00 19.48 O ATOM 681 CB ARG A 460 24.189 19.571 -7.430 1.00 26.08 C ATOM 682 CG ARG A 460 24.827 20.951 -7.290 1.00 22.90 C ATOM 683 CD ARG A 460 25.792 21.020 -6.118 1.00 23.64 C ATOM 684 NE ARG A 460 26.257 22.384 -5.873 1.00 22.43 N ATOM 685 CZ ARG A 460 27.369 22.900 -6.389 1.00 31.45 C ATOM 686 NH1 ARG A 460 28.135 22.165 -7.186 1.00 32.03 N ATOM 687 NH2 ARG A 460 27.717 24.152 -6.111 1.00 28.17 N ATOM 688 HE ARG A 460 25.681 22.990 -5.255 1.00 0.00 H ATOM 689 HH12 ARG A 460 29.004 22.569 -7.589 1.00 0.00 H ATOM 690 HH11 ARG A 460 27.866 21.185 -7.407 1.00 0.00 H ATOM 691 HH22 ARG A 460 28.587 24.552 -6.516 1.00 0.00 H ATOM 692 HH21 ARG A 460 27.119 24.732 -5.488 1.00 0.00 H ATOM 693 H ARG A 460 25.657 19.544 -9.570 1.00 0.00 H ATOM 694 N LEU A 461 23.600 16.965 -8.904 1.00 17.71 N ATOM 695 CA LEU A 461 22.714 15.830 -9.069 1.00 17.47 C ATOM 696 C LEU A 461 23.492 14.522 -9.114 1.00 21.93 C ATOM 697 O LEU A 461 23.182 13.579 -8.385 1.00 30.98 O ATOM 698 CB LEU A 461 21.877 15.993 -10.337 1.00 23.82 C ATOM 699 CG LEU A 461 20.906 14.840 -10.580 1.00 32.86 C ATOM 700 CD1 LEU A 461 19.932 14.736 -9.418 1.00 25.14 C ATOM 701 CD2 LEU A 461 20.174 15.029 -11.896 1.00 42.52 C ATOM 702 H LEU A 461 23.628 17.691 -9.648 1.00 0.00 H ATOM 703 N LYS A 462 24.508 14.488 -9.970 1.00 15.10 N ATOM 704 CA LYS A 462 25.390 13.335 -10.113 1.00 24.99 C ATOM 705 C LYS A 462 25.950 12.870 -8.773 1.00 24.39 C ATOM 706 O LYS A 462 25.936 11.679 -8.461 1.00 24.56 O ATOM 707 CB LYS A 462 26.538 13.667 -11.069 1.00 24.00 C ATOM 708 CG LYS A 462 27.382 12.461 -11.456 1.00 42.95 C ATOM 709 CD LYS A 462 27.608 12.405 -12.960 1.00 54.55 C ATOM 710 CE LYS A 462 28.261 11.091 -13.383 1.00 55.00 C ATOM 711 NZ LYS A 462 29.607 10.912 -12.775 1.00 56.01 N ATOM 712 HZ1 LYS A 462 30.227 11.692 -13.072 1.00 0.00 H ATOM 713 HZ2 LYS A 462 29.521 10.912 -11.739 1.00 0.00 H ATOM 714 HZ3 LYS A 462 30.011 10.007 -13.090 1.00 0.00 H ATOM 715 H LYS A 462 24.682 15.322 -10.566 1.00 0.00 H ATOM 716 N LEU A 463 26.435 13.820 -7.983 1.00 22.45 N ATOM 717 CA LEU A 463 26.991 13.517 -6.671 1.00 27.35 C ATOM 718 C LEU A 463 25.927 12.927 -5.741 1.00 21.34 C ATOM 719 O LEU A 463 26.188 11.989 -4.997 1.00 17.54 O ATOM 720 CB LEU A 463 27.600 14.775 -6.054 1.00 29.71 C ATOM 721 CG LEU A 463 28.992 14.628 -5.455 1.00 40.14 C ATOM 722 CD1 LEU A 463 29.937 14.038 -6.482 1.00 44.68 C ATOM 723 CD2 LEU A 463 29.490 15.982 -4.976 1.00 43.99 C ATOM 724 H LEU A 463 26.418 14.807 -8.309 1.00 0.00 H ATOM 725 N ALA A 464 24.724 13.481 -5.788 1.00 20.06 N ATOM 726 CA ALA A 464 23.649 12.993 -4.936 1.00 21.03 C ATOM 727 C ALA A 464 23.219 11.583 -5.353 1.00 17.91 C ATOM 728 O ALA A 464 22.876 10.759 -4.508 1.00 21.69 O ATOM 729 CB ALA A 464 22.459 13.956 -4.973 1.00 13.31 C ATOM 730 H ALA A 464 24.546 14.272 -6.440 1.00 0.00 H ATOM 731 N GLU A 465 23.247 11.311 -6.653 1.00 16.85 N ATOM 732 CA GLU A 465 22.888 9.990 -7.161 1.00 14.36 C ATOM 733 C GLU A 465 23.905 8.934 -6.730 1.00 15.03 C ATOM 734 O GLU A 465 23.534 7.803 -6.411 1.00 20.41 O ATOM 735 CB GLU A 465 22.761 10.011 -8.684 1.00 30.49 C ATOM 736 CG GLU A 465 21.538 10.759 -9.177 1.00 32.73 C ATOM 737 CD GLU A 465 21.370 10.704 -10.685 1.00 37.77 C ATOM 738 OE1 GLU A 465 22.389 10.660 -11.412 1.00 33.59 O ATOM 739 OE2 GLU A 465 20.206 10.703 -11.141 1.00 50.89 O ATOM 740 H GLU A 465 23.531 12.054 -7.323 1.00 0.00 H ATOM 741 N ILE A 466 25.183 9.305 -6.715 1.00 26.27 N ATOM 742 CA ILE A 466 26.213 8.395 -6.235 1.00 27.57 C ATOM 743 C ILE A 466 25.960 8.085 -4.763 1.00 27.10 C ATOM 744 O ILE A 466 26.010 6.930 -4.352 1.00 30.31 O ATOM 745 CB ILE A 466 27.630 8.964 -6.415 1.00 26.55 C ATOM 746 CG1 ILE A 466 27.945 9.178 -7.897 1.00 25.89 C ATOM 747 CG2 ILE A 466 28.661 8.014 -5.826 1.00 26.81 C ATOM 748 CD1 ILE A 466 29.362 9.693 -8.157 1.00 26.37 C ATOM 749 H ILE A 466 25.448 10.253 -7.049 1.00 0.00 H ATOM 750 N LEU A 467 25.665 9.119 -3.978 1.00 22.53 N ATOM 751 CA LEU A 467 25.349 8.942 -2.560 1.00 17.29 C ATOM 752 C LEU A 467 24.106 8.079 -2.349 1.00 19.87 C ATOM 753 O LEU A 467 24.054 7.265 -1.428 1.00 18.32 O ATOM 754 CB LEU A 467 25.140 10.295 -1.890 1.00 21.44 C ATOM 755 CG LEU A 467 26.245 10.905 -1.043 1.00 29.85 C ATOM 756 CD1 LEU A 467 25.761 12.241 -0.523 1.00 28.58 C ATOM 757 CD2 LEU A 467 26.609 9.977 0.102 1.00 31.48 C ATOM 758 H LEU A 467 25.659 10.077 -4.383 1.00 0.00 H ATOM 759 N TYR A 468 23.101 8.278 -3.199 1.00 14.35 N ATOM 760 CA TYR A 468 21.848 7.549 -3.079 1.00 14.00 C ATOM 761 C TYR A 468 22.052 6.036 -3.162 1.00 19.53 C ATOM 762 O TYR A 468 21.630 5.311 -2.270 1.00 17.98 O ATOM 763 CB TYR A 468 20.857 8.010 -4.153 1.00 16.03 C ATOM 764 CG TYR A 468 19.649 7.113 -4.282 1.00 20.70 C ATOM 765 CD1 TYR A 468 18.527 7.301 -3.483 1.00 19.91 C ATOM 766 CD2 TYR A 468 19.631 6.074 -5.203 1.00 13.92 C ATOM 767 CE1 TYR A 468 17.420 6.473 -3.602 1.00 16.28 C ATOM 768 CE2 TYR A 468 18.539 5.244 -5.322 1.00 21.92 C ATOM 769 CZ TYR A 468 17.437 5.445 -4.526 1.00 19.43 C ATOM 770 OH TYR A 468 16.356 4.605 -4.659 1.00 20.22 O ATOM 771 HH TYR A 468 15.648 4.877 -4.022 1.00 0.00 H ATOM 772 H TYR A 468 23.214 8.971 -3.966 1.00 0.00 H ATOM 773 N TYR A 469 22.690 5.567 -4.232 1.00 15.24 N ATOM 774 CA TYR A 469 22.903 4.139 -4.423 1.00 22.59 C ATOM 775 C TYR A 469 23.835 3.549 -3.367 1.00 25.90 C ATOM 776 O TYR A 469 23.720 2.378 -3.018 1.00 27.68 O ATOM 777 CB TYR A 469 23.453 3.859 -5.822 1.00 22.64 C ATOM 778 CG TYR A 469 22.408 3.977 -6.902 1.00 16.29 C ATOM 779 CD1 TYR A 469 21.361 3.066 -6.982 1.00 19.33 C ATOM 780 CD2 TYR A 469 22.467 4.994 -7.842 1.00 16.07 C ATOM 781 CE1 TYR A 469 20.399 3.170 -7.967 1.00 16.13 C ATOM 782 CE2 TYR A 469 21.510 5.107 -8.829 1.00 18.19 C ATOM 783 CZ TYR A 469 20.480 4.192 -8.888 1.00 19.61 C ATOM 784 OH TYR A 469 19.533 4.303 -9.878 1.00 28.52 O ATOM 785 HH TYR A 469 19.972 4.234 -10.763 1.00 0.00 H ATOM 786 H TYR A 469 23.044 6.234 -4.947 1.00 0.00 H ATOM 787 N LYS A 470 24.750 4.363 -2.855 1.00 22.57 N ATOM 788 CA LYS A 470 25.631 3.918 -1.783 1.00 22.56 C ATOM 789 C LYS A 470 24.844 3.665 -0.501 1.00 26.44 C ATOM 790 O LYS A 470 24.970 2.611 0.118 1.00 26.65 O ATOM 791 CB LYS A 470 26.732 4.947 -1.521 1.00 19.64 C ATOM 792 CG LYS A 470 27.798 4.463 -0.538 1.00 21.48 C ATOM 793 CD LYS A 470 28.760 5.597 -0.172 1.00 26.84 C ATOM 794 CE LYS A 470 30.020 5.069 0.517 1.00 32.85 C ATOM 795 NZ LYS A 470 29.725 4.499 1.861 1.00 25.15 N ATOM 796 HZ1 LYS A 470 29.309 5.236 2.465 1.00 0.00 H ATOM 797 HZ2 LYS A 470 29.054 3.711 1.762 1.00 0.00 H ATOM 798 HZ3 LYS A 470 30.607 4.154 2.291 1.00 0.00 H ATOM 799 H LYS A 470 24.839 5.331 -3.224 1.00 0.00 H ATOM 800 N ILE A 471 24.031 4.640 -0.106 1.00 20.79 N ATOM 801 CA ILE A 471 23.278 4.538 1.140 1.00 21.62 C ATOM 802 C ILE A 471 22.187 3.478 1.018 1.00 22.58 C ATOM 803 O ILE A 471 21.954 2.711 1.951 1.00 17.84 O ATOM 804 CB ILE A 471 22.655 5.897 1.534 1.00 19.01 C ATOM 805 CG1 ILE A 471 23.760 6.926 1.795 1.00 21.42 C ATOM 806 CG2 ILE A 471 21.754 5.762 2.766 1.00 16.15 C ATOM 807 CD1 ILE A 471 23.251 8.335 2.003 1.00 17.85 C ATOM 808 H ILE A 471 23.930 5.491 -0.696 1.00 0.00 H ATOM 809 N LEU A 472 21.530 3.433 -0.139 1.00 21.03 N ATOM 810 CA LEU A 472 20.507 2.427 -0.398 1.00 15.53 C ATOM 811 C LEU A 472 21.089 1.011 -0.287 1.00 17.68 C ATOM 812 O LEU A 472 20.456 0.118 0.269 1.00 23.13 O ATOM 813 CB LEU A 472 19.884 2.640 -1.778 1.00 16.62 C ATOM 814 CG LEU A 472 18.884 1.571 -2.229 1.00 26.13 C ATOM 815 CD1 LEU A 472 17.702 1.494 -1.268 1.00 20.88 C ATOM 816 CD2 LEU A 472 18.413 1.812 -3.669 1.00 17.32 C ATOM 817 H LEU A 472 21.752 4.132 -0.876 1.00 0.00 H ATOM 818 N GLU A 473 22.297 0.809 -0.804 1.00 22.45 N ATOM 819 CA GLU A 473 22.926 -0.502 -0.715 1.00 23.54 C ATOM 820 C GLU A 473 23.200 -0.856 0.742 1.00 24.45 C ATOM 821 O GLU A 473 22.931 -1.972 1.171 1.00 23.63 O ATOM 822 CB GLU A 473 24.220 -0.560 -1.524 1.00 27.89 C ATOM 823 CG GLU A 473 24.919 -1.926 -1.429 1.00 34.47 C ATOM 824 CD GLU A 473 26.173 -2.019 -2.278 1.00 38.49 C ATOM 825 OE1 GLU A 473 26.360 -1.164 -3.167 1.00 44.02 O ATOM 826 OE2 GLU A 473 26.975 -2.952 -2.059 1.00 44.69 O ATOM 827 H GLU A 473 22.796 1.591 -1.274 1.00 0.00 H ATOM 828 N THR A 474 23.724 0.104 1.500 1.00 21.90 N ATOM 829 CA THR A 474 23.981 -0.097 2.922 1.00 23.48 C ATOM 830 C THR A 474 22.693 -0.433 3.671 1.00 19.84 C ATOM 831 O THR A 474 22.662 -1.345 4.496 1.00 22.59 O ATOM 832 CB THR A 474 24.635 1.146 3.564 1.00 27.64 C ATOM 833 OG1 THR A 474 25.899 1.400 2.939 1.00 26.42 O ATOM 834 CG2 THR A 474 24.846 0.927 5.061 1.00 25.29 C ATOM 835 HG1 THR A 474 25.761 1.562 1.972 1.00 0.00 H ATOM 836 H THR A 474 23.956 1.021 1.068 1.00 0.00 H ATOM 837 N VAL A 475 21.627 0.300 3.371 1.00 24.10 N ATOM 838 CA VAL A 475 20.343 0.053 4.013 1.00 23.70 C ATOM 839 C VAL A 475 19.811 -1.341 3.684 1.00 19.99 C ATOM 840 O VAL A 475 19.364 -2.060 4.574 1.00 22.32 O ATOM 841 CB VAL A 475 19.299 1.117 3.608 1.00 23.56 C ATOM 842 CG1 VAL A 475 17.933 0.750 4.140 1.00 15.83 C ATOM 843 CG2 VAL A 475 19.720 2.481 4.125 1.00 18.82 C ATOM 844 H VAL A 475 21.710 1.061 2.667 1.00 0.00 H ATOM 845 N MET A 476 19.877 -1.728 2.415 1.00 27.24 N ATOM 846 CA MET A 476 19.319 -3.008 1.982 1.00 32.52 C ATOM 847 C MET A 476 20.085 -4.199 2.548 1.00 33.35 C ATOM 848 O MET A 476 19.485 -5.199 2.935 1.00 36.78 O ATOM 849 CB MET A 476 19.286 -3.089 0.455 1.00 37.93 C ATOM 850 CG MET A 476 18.234 -2.199 -0.182 1.00 37.29 C ATOM 851 SD MET A 476 16.589 -2.500 0.494 1.00 47.24 S ATOM 852 CE MET A 476 16.338 -1.057 1.504 1.00 31.35 C ATOM 853 H MET A 476 20.334 -1.108 1.716 1.00 0.00 H ATOM 854 N VAL A 477 21.407 -4.084 2.596 1.00 28.91 N ATOM 855 CA VAL A 477 22.255 -5.152 3.105 1.00 31.96 C ATOM 856 C VAL A 477 21.983 -5.447 4.584 1.00 32.98 C ATOM 857 O VAL A 477 21.892 -6.608 4.988 1.00 30.09 O ATOM 858 CB VAL A 477 23.745 -4.807 2.906 1.00 34.87 C ATOM 859 CG1 VAL A 477 24.634 -5.742 3.702 1.00 39.26 C ATOM 860 CG2 VAL A 477 24.099 -4.861 1.428 1.00 38.24 C ATOM 861 H VAL A 477 21.850 -3.205 2.260 1.00 0.00 H ATOM 862 N GLN A 478 21.827 -4.390 5.378 1.00 26.14 N ATOM 863 CA GLN A 478 21.659 -4.520 6.822 1.00 30.36 C ATOM 864 C GLN A 478 20.212 -4.800 7.222 1.00 31.16 C ATOM 865 O GLN A 478 19.912 -4.966 8.400 1.00 41.52 O ATOM 866 CB GLN A 478 22.156 -3.250 7.518 1.00 30.36 C ATOM 867 CG GLN A 478 23.609 -2.929 7.216 1.00 44.68 C ATOM 868 CD GLN A 478 24.078 -1.630 7.844 1.00 54.33 C ATOM 869 OE1 GLN A 478 23.270 -0.799 8.262 1.00 59.77 O ATOM 870 NE2 GLN A 478 25.394 -1.450 7.911 1.00 55.82 N ATOM 871 HE22 GLN A 478 26.038 -2.180 7.545 1.00 0.00 H ATOM 872 HE21 GLN A 478 25.779 -0.579 8.330 1.00 0.00 H ATOM 873 H GLN A 478 21.825 -3.440 4.955 1.00 0.00 H ATOM 874 N GLU A 479 19.319 -4.847 6.240 1.00 25.45 N ATOM 875 CA GLU A 479 17.905 -5.076 6.508 1.00 34.21 C ATOM 876 C GLU A 479 17.647 -6.465 7.099 1.00 39.41 C ATOM 877 O GLU A 479 18.296 -7.446 6.726 1.00 35.95 O ATOM 878 CB GLU A 479 17.086 -4.890 5.230 1.00 38.84 C ATOM 879 CG GLU A 479 15.592 -4.821 5.471 1.00 45.20 C ATOM 880 CD GLU A 479 15.215 -3.718 6.445 1.00 50.32 C ATOM 881 OE1 GLU A 479 15.277 -2.530 6.059 1.00 41.02 O ATOM 882 OE2 GLU A 479 14.863 -4.045 7.601 1.00 55.53 O ATOM 883 H GLU A 479 19.636 -4.717 5.258 1.00 0.00 H ATOM 884 N THR A 480 16.690 -6.532 8.021 1.00 35.42 N ATOM 885 CA THR A 480 16.342 -7.776 8.700 1.00 35.23 C ATOM 886 C THR A 480 15.854 -8.849 7.729 1.00 31.08 C ATOM 887 O THR A 480 16.266 -10.009 7.813 1.00 35.54 O ATOM 888 CB THR A 480 15.263 -7.530 9.776 1.00 42.72 C ATOM 889 OG1 THR A 480 15.850 -6.837 10.882 1.00 49.69 O ATOM 890 CG2 THR A 480 14.676 -8.846 10.272 1.00 45.73 C ATOM 891 HG1 THR A 480 16.214 -5.970 10.571 1.00 0.00 H ATOM 892 H THR A 480 16.170 -5.665 8.267 1.00 0.00 H ATOM 893 N ARG A 481 14.985 -8.459 6.803 1.00 29.62 N ATOM 894 CA ARG A 481 14.438 -9.407 5.841 1.00 34.76 C ATOM 895 C ARG A 481 15.533 -9.988 4.948 1.00 30.23 C ATOM 896 O ARG A 481 15.480 -11.158 4.576 1.00 29.83 O ATOM 897 CB ARG A 481 13.348 -8.748 4.990 1.00 38.90 C ATOM 898 CG ARG A 481 12.016 -8.575 5.716 1.00 42.07 C ATOM 899 CD ARG A 481 10.940 -7.989 4.800 1.00 52.45 C ATOM 900 NE ARG A 481 10.468 -8.950 3.804 1.00 52.71 N ATOM 901 CZ ARG A 481 9.360 -9.676 3.929 1.00 47.33 C ATOM 902 NH1 ARG A 481 8.600 -9.554 5.010 1.00 48.78 N ATOM 903 NH2 ARG A 481 9.011 -10.526 2.972 1.00 37.98 N ATOM 904 HE ARG A 481 11.036 -9.074 2.941 1.00 0.00 H ATOM 905 HH12 ARG A 481 7.735 -10.123 5.104 1.00 0.00 H ATOM 906 HH11 ARG A 481 8.870 -8.889 5.763 1.00 0.00 H ATOM 907 HH22 ARG A 481 8.145 -11.093 3.071 1.00 0.00 H ATOM 908 HH21 ARG A 481 9.604 -10.625 2.123 1.00 0.00 H ATOM 909 H ARG A 481 14.691 -7.462 6.764 1.00 0.00 H ATOM 910 N ARG A 482 16.524 -9.168 4.616 1.00 29.64 N ATOM 911 CA ARG A 482 17.647 -9.608 3.792 1.00 31.24 C ATOM 912 C ARG A 482 18.446 -10.678 4.531 1.00 27.35 C ATOM 913 O ARG A 482 18.804 -11.709 3.959 1.00 30.42 O ATOM 914 CB ARG A 482 18.543 -8.416 3.420 1.00 30.27 C ATOM 915 CG ARG A 482 19.342 -8.576 2.121 1.00 25.29 C ATOM 916 CD ARG A 482 20.517 -9.525 2.255 1.00 28.50 C ATOM 917 NE ARG A 482 21.479 -9.083 3.259 1.00 31.88 N ATOM 918 CZ ARG A 482 22.436 -9.855 3.764 1.00 33.01 C ATOM 919 NH1 ARG A 482 22.556 -11.112 3.361 1.00 34.44 N ATOM 920 NH2 ARG A 482 23.271 -9.375 4.676 1.00 30.45 N ATOM 921 HE ARG A 482 21.412 -8.103 3.601 1.00 0.00 H ATOM 922 HH12 ARG A 482 23.305 -11.716 3.756 1.00 0.00 H ATOM 923 HH11 ARG A 482 21.901 -11.495 2.649 1.00 0.00 H ATOM 924 HH22 ARG A 482 24.018 -9.983 5.068 1.00 0.00 H ATOM 925 HH21 ARG A 482 23.179 -8.391 4.999 1.00 0.00 H ATOM 926 H ARG A 482 16.500 -8.184 4.953 1.00 0.00 H ATOM 927 N LEU A 483 18.710 -10.430 5.809 1.00 31.14 N ATOM 928 CA LEU A 483 19.489 -11.351 6.632 1.00 30.29 C ATOM 929 C LEU A 483 18.756 -12.664 6.876 1.00 33.53 C ATOM 930 O LEU A 483 19.387 -13.700 7.082 1.00 29.25 O ATOM 931 CB LEU A 483 19.849 -10.689 7.963 1.00 35.99 C ATOM 932 CG LEU A 483 20.871 -9.558 7.828 1.00 39.62 C ATOM 933 CD1 LEU A 483 20.789 -8.593 8.997 1.00 41.71 C ATOM 934 CD2 LEU A 483 22.275 -10.146 7.717 1.00 37.82 C ATOM 935 H LEU A 483 18.351 -9.553 6.237 1.00 0.00 H ATOM 936 N HIS A 484 17.426 -12.622 6.852 1.00 32.72 N ATOM 937 CA HIS A 484 16.624 -13.834 7.013 1.00 34.18 C ATOM 938 C HIS A 484 16.254 -14.448 5.666 1.00 28.57 C ATOM 939 O HIS A 484 15.543 -15.443 5.613 1.00 29.49 O ATOM 940 CB HIS A 484 15.352 -13.543 7.815 1.00 35.52 C ATOM 941 CG HIS A 484 15.573 -13.459 9.292 1.00 36.69 C ATOM 942 ND1 HIS A 484 15.641 -12.260 9.969 1.00 41.88 N ATOM 943 CD2 HIS A 484 15.743 -14.426 10.224 1.00 37.04 C ATOM 944 CE1 HIS A 484 15.842 -12.492 11.253 1.00 43.72 C ATOM 945 NE2 HIS A 484 15.906 -13.799 11.435 1.00 42.71 N ATOM 946 H HIS A 484 16.947 -11.709 6.716 1.00 0.00 H ATOM 947 N GLY A 485 16.725 -13.841 4.582 1.00 28.25 N ATOM 948 CA GLY A 485 16.500 -14.373 3.247 1.00 31.69 C ATOM 949 C GLY A 485 15.067 -14.232 2.770 1.00 34.42 C ATOM 950 O GLY A 485 14.562 -15.068 2.020 1.00 37.52 O ATOM 951 H GLY A 485 17.269 -12.962 4.691 1.00 0.00 H ATOM 952 N MET A 486 14.405 -13.168 3.206 1.00 30.96 N ATOM 953 CA MET A 486 13.012 -12.946 2.840 1.00 32.14 C ATOM 954 C MET A 486 12.869 -11.888 1.760 1.00 28.38 C ATOM 955 O MET A 486 13.644 -10.935 1.698 1.00 29.02 O ATOM 956 CB MET A 486 12.196 -12.565 4.070 1.00 25.18 C ATOM 957 CG MET A 486 12.083 -13.702 5.066 1.00 26.52 C ATOM 958 SD MET A 486 11.386 -13.163 6.626 1.00 52.94 S ATOM 959 CE MET A 486 9.795 -12.553 6.070 1.00 59.95 C ATOM 960 H MET A 486 14.888 -12.481 3.819 1.00 0.00 H ATOM 961 N ASP A 487 11.874 -12.082 0.902 1.00 33.55 N ATOM 962 CA ASP A 487 11.635 -11.204 -0.235 1.00 33.49 C ATOM 963 C ASP A 487 11.399 -9.765 0.214 1.00 29.62 C ATOM 964 O ASP A 487 10.574 -9.497 1.085 1.00 31.59 O ATOM 965 CB ASP A 487 10.446 -11.715 -1.046 1.00 33.01 C ATOM 966 CG ASP A 487 10.315 -11.024 -2.381 1.00 36.79 C ATOM 967 OD1 ASP A 487 11.041 -11.399 -3.326 1.00 35.83 O ATOM 968 OD2 ASP A 487 9.478 -10.107 -2.483 1.00 39.13 O ATOM 969 H ASP A 487 11.240 -12.893 1.048 1.00 0.00 H ATOM 970 N MET A 488 12.170 -8.854 -0.361 1.00 26.66 N ATOM 971 CA MET A 488 12.128 -7.442 0.003 1.00 29.54 C ATOM 972 C MET A 488 11.291 -6.556 -0.923 1.00 27.76 C ATOM 973 O MET A 488 11.395 -5.329 -0.852 1.00 25.23 O ATOM 974 CB MET A 488 13.546 -6.898 0.123 1.00 31.25 C ATOM 975 CG MET A 488 14.086 -7.060 1.543 1.00 43.20 C ATOM 976 SD MET A 488 15.793 -6.546 1.740 1.00 45.91 S ATOM 977 CE MET A 488 16.508 -7.480 0.395 1.00 22.89 C ATOM 978 H MET A 488 12.833 -9.158 -1.103 1.00 0.00 H ATOM 979 N SER A 489 10.532 -7.172 -1.829 1.00 27.95 N ATOM 980 CA SER A 489 9.751 -6.436 -2.827 1.00 29.50 C ATOM 981 C SER A 489 8.938 -5.289 -2.233 1.00 29.24 C ATOM 982 O SER A 489 9.017 -4.159 -2.711 1.00 28.60 O ATOM 983 CB SER A 489 8.800 -7.378 -3.571 1.00 31.38 C ATOM 984 OG SER A 489 9.509 -8.347 -4.323 1.00 27.43 O ATOM 985 HG SER A 489 10.073 -8.887 -3.715 1.00 0.00 H ATOM 986 H SER A 489 10.493 -8.211 -1.828 1.00 0.00 H ATOM 987 N VAL A 490 8.173 -5.578 -1.186 1.00 31.76 N ATOM 988 CA VAL A 490 7.308 -4.574 -0.579 1.00 34.95 C ATOM 989 C VAL A 490 8.141 -3.455 0.048 1.00 37.74 C ATOM 990 O VAL A 490 7.770 -2.278 -0.005 1.00 31.79 O ATOM 991 CB VAL A 490 6.373 -5.199 0.478 1.00 25.96 C ATOM 992 CG1 VAL A 490 5.505 -4.128 1.122 1.00 31.29 C ATOM 993 CG2 VAL A 490 5.495 -6.269 -0.164 1.00 18.61 C ATOM 994 H VAL A 490 8.192 -6.540 -0.791 1.00 0.00 H ATOM 995 N LEU A 491 9.279 -3.828 0.623 1.00 32.34 N ATOM 996 CA LEU A 491 10.186 -2.852 1.211 1.00 27.94 C ATOM 997 C LEU A 491 10.703 -1.888 0.145 1.00 22.53 C ATOM 998 O LEU A 491 10.648 -0.667 0.307 1.00 18.89 O ATOM 999 CB LEU A 491 11.356 -3.554 1.892 1.00 25.95 C ATOM 1000 CG LEU A 491 12.050 -2.758 2.992 1.00 38.02 C ATOM 1001 CD1 LEU A 491 11.318 -2.944 4.317 1.00 45.28 C ATOM 1002 CD2 LEU A 491 13.501 -3.172 3.106 1.00 37.54 C ATOM 1003 H LEU A 491 9.527 -4.837 0.654 1.00 0.00 H ATOM 1004 N LEU A 492 11.174 -2.452 -0.961 1.00 24.80 N ATOM 1005 CA LEU A 492 11.850 -1.676 -1.993 1.00 25.81 C ATOM 1006 C LEU A 492 10.912 -0.914 -2.927 1.00 26.17 C ATOM 1007 O LEU A 492 11.365 -0.087 -3.710 1.00 24.21 O ATOM 1008 CB LEU A 492 12.747 -2.595 -2.815 1.00 26.90 C ATOM 1009 CG LEU A 492 14.153 -2.781 -2.245 1.00 34.52 C ATOM 1010 CD1 LEU A 492 14.813 -4.028 -2.826 1.00 23.92 C ATOM 1011 CD2 LEU A 492 14.993 -1.537 -2.529 1.00 29.66 C ATOM 1012 H LEU A 492 11.057 -3.477 -1.095 1.00 0.00 H ATOM 1013 N GLU A 493 9.618 -1.203 -2.859 1.00 22.85 N ATOM 1014 CA GLU A 493 8.650 -0.578 -3.753 1.00 22.61 C ATOM 1015 C GLU A 493 7.942 0.638 -3.145 1.00 30.14 C ATOM 1016 O GLU A 493 6.984 1.146 -3.732 1.00 33.09 O ATOM 1017 CB GLU A 493 7.618 -1.606 -4.234 1.00 23.69 C ATOM 1018 CG GLU A 493 6.658 -2.117 -3.178 1.00 35.03 C ATOM 1019 CD GLU A 493 5.809 -3.282 -3.678 1.00 40.90 C ATOM 1020 OE1 GLU A 493 6.056 -3.777 -4.801 1.00 32.00 O ATOM 1021 OE2 GLU A 493 4.895 -3.706 -2.941 1.00 48.92 O ATOM 1022 H GLU A 493 9.287 -1.891 -2.152 1.00 0.00 H ATOM 1023 N GLN A 494 8.382 1.104 -1.975 1.00 26.89 N ATOM 1024 CA GLN A 494 7.735 2.275 -1.385 1.00 27.96 C ATOM 1025 C GLN A 494 8.382 3.545 -1.934 1.00 20.04 C ATOM 1026 O GLN A 494 9.516 3.880 -1.599 1.00 16.78 O ATOM 1027 CB GLN A 494 7.837 2.257 0.147 1.00 28.07 C ATOM 1028 CG GLN A 494 7.317 0.988 0.820 1.00 34.61 C ATOM 1029 CD GLN A 494 5.865 0.675 0.478 1.00 41.95 C ATOM 1030 OE1 GLN A 494 5.015 1.567 0.424 1.00 43.33 O ATOM 1031 NE2 GLN A 494 5.578 -0.601 0.244 1.00 37.34 N ATOM 1032 HE22 GLN A 494 6.326 -1.321 0.300 1.00 0.00 H ATOM 1033 HE21 GLN A 494 4.605 -0.880 0.004 1.00 0.00 H ATOM 1034 H GLN A 494 9.176 0.640 -1.488 1.00 0.00 H ATOM 1035 N ASP A 495 7.625 4.272 -2.746 1.00 21.14 N ATOM 1036 CA ASP A 495 8.154 5.434 -3.458 1.00 25.70 C ATOM 1037 C ASP A 495 8.635 6.529 -2.519 1.00 21.18 C ATOM 1038 O ASP A 495 9.613 7.219 -2.812 1.00 16.87 O ATOM 1039 CB ASP A 495 7.098 6.009 -4.399 1.00 25.19 C ATOM 1040 CG ASP A 495 6.754 5.070 -5.528 1.00 34.09 C ATOM 1041 OD1 ASP A 495 7.561 4.160 -5.810 1.00 48.39 O ATOM 1042 OD2 ASP A 495 5.681 5.248 -6.141 1.00 37.92 O ATOM 1043 H ASP A 495 6.628 4.008 -2.880 1.00 0.00 H ATOM 1044 N ILE A 496 7.952 6.681 -1.389 1.00 14.87 N ATOM 1045 CA ILE A 496 8.245 7.786 -0.496 1.00 16.85 C ATOM 1046 C ILE A 496 9.636 7.614 0.100 1.00 16.14 C ATOM 1047 O ILE A 496 10.323 8.603 0.342 1.00 22.98 O ATOM 1048 CB ILE A 496 7.179 7.934 0.629 1.00 23.43 C ATOM 1049 CG1 ILE A 496 7.360 9.264 1.364 1.00 22.64 C ATOM 1050 CG2 ILE A 496 7.216 6.755 1.603 1.00 21.86 C ATOM 1051 CD1 ILE A 496 7.077 10.497 0.499 1.00 17.33 C ATOM 1052 H ILE A 496 7.202 6.003 -1.143 1.00 0.00 H ATOM 1053 N PHE A 497 10.076 6.370 0.295 1.00 19.61 N ATOM 1054 CA PHE A 497 11.408 6.142 0.857 1.00 14.59 C ATOM 1055 C PHE A 497 12.485 6.592 -0.120 1.00 20.32 C ATOM 1056 O PHE A 497 13.397 7.338 0.243 1.00 26.47 O ATOM 1057 CB PHE A 497 11.635 4.669 1.231 1.00 17.41 C ATOM 1058 CG PHE A 497 13.051 4.383 1.676 1.00 20.24 C ATOM 1059 CD1 PHE A 497 13.986 3.873 0.790 1.00 16.04 C ATOM 1060 CD2 PHE A 497 13.456 4.677 2.968 1.00 21.50 C ATOM 1061 CE1 PHE A 497 15.296 3.638 1.193 1.00 23.21 C ATOM 1062 CE2 PHE A 497 14.759 4.444 3.377 1.00 21.52 C ATOM 1063 CZ PHE A 497 15.683 3.926 2.487 1.00 14.88 C ATOM 1064 H PHE A 497 9.472 5.561 0.047 1.00 0.00 H ATOM 1065 N HIS A 498 12.382 6.130 -1.363 1.00 22.16 N ATOM 1066 CA HIS A 498 13.374 6.467 -2.379 1.00 18.91 C ATOM 1067 C HIS A 498 13.411 7.963 -2.671 1.00 19.03 C ATOM 1068 O HIS A 498 14.492 8.547 -2.795 1.00 18.87 O ATOM 1069 CB HIS A 498 13.104 5.683 -3.662 1.00 14.50 C ATOM 1070 CG HIS A 498 13.208 4.199 -3.488 1.00 19.33 C ATOM 1071 ND1 HIS A 498 14.406 3.560 -3.247 1.00 18.07 N ATOM 1072 CD2 HIS A 498 12.263 3.226 -3.511 1.00 21.01 C ATOM 1073 CE1 HIS A 498 14.196 2.259 -3.130 1.00 19.96 C ATOM 1074 NE2 HIS A 498 12.904 2.031 -3.289 1.00 24.47 N ATOM 1075 H HIS A 498 11.580 5.518 -1.615 1.00 0.00 H ATOM 1076 N ARG A 499 12.238 8.581 -2.783 1.00 19.96 N ATOM 1077 CA ARG A 499 12.170 10.021 -3.028 1.00 16.79 C ATOM 1078 C ARG A 499 12.812 10.777 -1.880 1.00 10.75 C ATOM 1079 O ARG A 499 13.581 11.711 -2.102 1.00 15.05 O ATOM 1080 CB ARG A 499 10.722 10.492 -3.212 1.00 13.33 C ATOM 1081 CG ARG A 499 10.006 9.895 -4.424 1.00 10.73 C ATOM 1082 CD ARG A 499 8.513 10.226 -4.382 1.00 15.74 C ATOM 1083 NE ARG A 499 8.272 11.659 -4.519 1.00 15.68 N ATOM 1084 CZ ARG A 499 7.347 12.335 -3.846 1.00 21.60 C ATOM 1085 NH1 ARG A 499 6.570 11.710 -2.970 1.00 23.91 N ATOM 1086 NH2 ARG A 499 7.207 13.640 -4.042 1.00 23.23 N ATOM 1087 HE ARG A 499 8.865 12.188 -5.190 1.00 0.00 H ATOM 1088 HH12 ARG A 499 5.847 12.241 -2.445 1.00 0.00 H ATOM 1089 HH11 ARG A 499 6.684 10.689 -2.809 1.00 0.00 H ATOM 1090 HH22 ARG A 499 6.483 14.170 -3.516 1.00 0.00 H ATOM 1091 HH21 ARG A 499 7.821 14.133 -4.722 1.00 0.00 H ATOM 1092 H ARG A 499 11.358 8.033 -2.695 1.00 0.00 H ATOM 1093 N SER A 500 12.487 10.373 -0.654 1.00 13.35 N ATOM 1094 CA SER A 500 13.021 11.039 0.524 1.00 10.22 C ATOM 1095 C SER A 500 14.528 10.874 0.606 1.00 13.72 C ATOM 1096 O SER A 500 15.233 11.810 0.989 1.00 15.75 O ATOM 1097 CB SER A 500 12.361 10.504 1.802 1.00 13.87 C ATOM 1098 OG SER A 500 10.996 10.888 1.867 1.00 13.51 O ATOM 1099 HG SER A 500 10.514 10.523 1.083 1.00 0.00 H ATOM 1100 H SER A 500 11.840 9.567 -0.536 1.00 0.00 H ATOM 1101 N LEU A 501 15.018 9.687 0.248 1.00 13.39 N ATOM 1102 CA LEU A 501 16.455 9.399 0.318 1.00 15.48 C ATOM 1103 C LEU A 501 17.218 10.227 -0.703 1.00 12.49 C ATOM 1104 O LEU A 501 18.260 10.801 -0.395 1.00 15.29 O ATOM 1105 CB LEU A 501 16.733 7.908 0.095 1.00 11.89 C ATOM 1106 CG LEU A 501 18.207 7.484 0.169 1.00 22.49 C ATOM 1107 CD1 LEU A 501 18.816 7.851 1.521 1.00 15.12 C ATOM 1108 CD2 LEU A 501 18.379 5.985 -0.106 1.00 16.35 C ATOM 1109 H LEU A 501 14.367 8.949 -0.088 1.00 0.00 H ATOM 1110 N MET A 502 16.685 10.291 -1.918 1.00 11.28 N ATOM 1111 CA MET A 502 17.291 11.097 -2.967 1.00 22.56 C ATOM 1112 C MET A 502 17.275 12.590 -2.606 1.00 18.19 C ATOM 1113 O MET A 502 18.237 13.307 -2.880 1.00 21.44 O ATOM 1114 CB MET A 502 16.578 10.860 -4.300 1.00 27.04 C ATOM 1115 CG MET A 502 17.207 11.598 -5.465 1.00 30.64 C ATOM 1116 SD MET A 502 18.956 11.203 -5.645 1.00 32.53 S ATOM 1117 CE MET A 502 19.507 12.629 -6.572 1.00 27.15 C ATOM 1118 H MET A 502 15.818 9.755 -2.123 1.00 0.00 H ATOM 1119 N ALA A 503 16.193 13.053 -1.986 1.00 19.99 N ATOM 1120 CA ALA A 503 16.115 14.448 -1.552 1.00 25.28 C ATOM 1121 C ALA A 503 17.108 14.729 -0.441 1.00 19.14 C ATOM 1122 O ALA A 503 17.751 15.781 -0.427 1.00 14.25 O ATOM 1123 CB ALA A 503 14.723 14.800 -1.087 1.00 10.11 C ATOM 1124 H ALA A 503 15.392 12.415 -1.807 1.00 0.00 H ATOM 1125 N CYS A 504 17.212 13.797 0.502 1.00 18.06 N ATOM 1126 CA CYS A 504 18.168 13.956 1.585 1.00 22.30 C ATOM 1127 C CYS A 504 19.589 13.967 1.033 1.00 18.31 C ATOM 1128 O CYS A 504 20.437 14.711 1.513 1.00 23.65 O ATOM 1129 CB CYS A 504 18.013 12.855 2.636 1.00 20.77 C ATOM 1130 SG CYS A 504 18.748 13.304 4.234 1.00 28.47 S ATOM 1131 H CYS A 504 16.607 12.952 0.464 1.00 0.00 H ATOM 1132 N CYS A 505 19.843 13.153 0.014 1.00 19.36 N ATOM 1133 CA CYS A 505 21.162 13.146 -0.614 1.00 24.64 C ATOM 1134 C CYS A 505 21.429 14.488 -1.284 1.00 22.65 C ATOM 1135 O CYS A 505 22.533 15.026 -1.187 1.00 21.91 O ATOM 1136 CB CYS A 505 21.288 12.006 -1.626 1.00 30.33 C ATOM 1137 SG CYS A 505 21.396 10.351 -0.872 1.00 27.48 S ATOM 1138 H CYS A 505 19.099 12.518 -0.338 1.00 0.00 H ATOM 1139 N LEU A 506 20.412 15.037 -1.944 1.00 20.95 N ATOM 1140 CA LEU A 506 20.552 16.341 -2.587 1.00 24.35 C ATOM 1141 C LEU A 506 20.813 17.419 -1.544 1.00 22.18 C ATOM 1142 O LEU A 506 21.632 18.313 -1.752 1.00 18.06 O ATOM 1143 CB LEU A 506 19.307 16.683 -3.405 1.00 23.22 C ATOM 1144 CG LEU A 506 19.255 16.042 -4.795 1.00 23.80 C ATOM 1145 CD1 LEU A 506 17.857 16.130 -5.392 1.00 11.32 C ATOM 1146 CD2 LEU A 506 20.286 16.680 -5.719 1.00 17.41 C ATOM 1147 H LEU A 506 19.505 14.531 -2.003 1.00 0.00 H ATOM 1148 N GLU A 507 20.125 17.308 -0.412 1.00 22.02 N ATOM 1149 CA GLU A 507 20.296 18.249 0.687 1.00 20.65 C ATOM 1150 C GLU A 507 21.705 18.177 1.269 1.00 21.46 C ATOM 1151 O GLU A 507 22.290 19.206 1.600 1.00 23.85 O ATOM 1152 CB GLU A 507 19.257 17.987 1.779 1.00 21.99 C ATOM 1153 CG GLU A 507 19.427 18.836 3.026 1.00 22.05 C ATOM 1154 CD GLU A 507 19.297 20.327 2.758 1.00 29.09 C ATOM 1155 OE1 GLU A 507 18.674 20.712 1.744 1.00 33.11 O ATOM 1156 OE2 GLU A 507 19.821 21.117 3.568 1.00 37.97 O ATOM 1157 H GLU A 507 19.446 16.528 -0.308 1.00 0.00 H ATOM 1158 N ILE A 508 22.244 16.963 1.391 1.00 18.89 N ATOM 1159 CA ILE A 508 23.622 16.777 1.849 1.00 22.17 C ATOM 1160 C ILE A 508 24.599 17.510 0.938 1.00 24.04 C ATOM 1161 O ILE A 508 25.475 18.235 1.398 1.00 19.68 O ATOM 1162 CB ILE A 508 24.012 15.282 1.897 1.00 23.35 C ATOM 1163 CG1 ILE A 508 23.283 14.583 3.037 1.00 27.71 C ATOM 1164 CG2 ILE A 508 25.517 15.117 2.074 1.00 20.52 C ATOM 1165 CD1 ILE A 508 23.560 15.219 4.357 1.00 37.36 C ATOM 1166 H ILE A 508 21.671 16.128 1.155 1.00 0.00 H ATOM 1167 N VAL A 509 24.426 17.320 -0.365 1.00 13.70 N ATOM 1168 CA VAL A 509 25.318 17.901 -1.350 1.00 18.76 C ATOM 1169 C VAL A 509 25.218 19.425 -1.339 1.00 22.98 C ATOM 1170 O VAL A 509 26.232 20.120 -1.269 1.00 19.54 O ATOM 1171 CB VAL A 509 25.004 17.354 -2.754 1.00 24.62 C ATOM 1172 CG1 VAL A 509 25.806 18.084 -3.816 1.00 25.89 C ATOM 1173 CG2 VAL A 509 25.271 15.855 -2.799 1.00 19.21 C ATOM 1174 H VAL A 509 23.627 16.738 -0.689 1.00 0.00 H ATOM 1175 N LEU A 510 23.990 19.931 -1.394 1.00 21.76 N ATOM 1176 CA LEU A 510 23.735 21.367 -1.329 1.00 18.51 C ATOM 1177 C LEU A 510 24.339 21.997 -0.085 1.00 21.36 C ATOM 1178 O LEU A 510 24.943 23.066 -0.156 1.00 20.46 O ATOM 1179 CB LEU A 510 22.227 21.649 -1.366 1.00 13.08 C ATOM 1180 CG LEU A 510 21.553 21.404 -2.718 1.00 19.51 C ATOM 1181 CD1 LEU A 510 20.032 21.602 -2.625 1.00 12.20 C ATOM 1182 CD2 LEU A 510 22.152 22.303 -3.797 1.00 13.28 C ATOM 1183 H LEU A 510 23.183 19.281 -1.487 1.00 0.00 H ATOM 1184 N PHE A 511 24.169 21.343 1.057 1.00 25.35 N ATOM 1185 CA PHE A 511 24.739 21.855 2.297 1.00 24.62 C ATOM 1186 C PHE A 511 26.261 21.905 2.221 1.00 24.96 C ATOM 1187 O PHE A 511 26.874 22.896 2.617 1.00 20.34 O ATOM 1188 CB PHE A 511 24.313 21.004 3.491 1.00 26.28 C ATOM 1189 CG PHE A 511 24.999 21.386 4.767 1.00 29.18 C ATOM 1190 CD1 PHE A 511 24.739 22.607 5.367 1.00 30.81 C ATOM 1191 CD2 PHE A 511 25.915 20.534 5.360 1.00 31.59 C ATOM 1192 CE1 PHE A 511 25.371 22.968 6.543 1.00 29.81 C ATOM 1193 CE2 PHE A 511 26.551 20.889 6.534 1.00 34.63 C ATOM 1194 CZ PHE A 511 26.275 22.110 7.125 1.00 35.09 C ATOM 1195 H PHE A 511 23.624 20.457 1.067 1.00 0.00 H ATOM 1196 N ALA A 512 26.860 20.835 1.702 1.00 20.30 N ATOM 1197 CA ALA A 512 28.319 20.726 1.619 1.00 20.61 C ATOM 1198 C ALA A 512 28.935 21.867 0.818 1.00 21.25 C ATOM 1199 O ALA A 512 30.082 22.254 1.055 1.00 27.89 O ATOM 1200 CB ALA A 512 28.715 19.382 1.008 1.00 16.51 C ATOM 1201 H ALA A 512 26.275 20.053 1.345 1.00 0.00 H ATOM 1202 N TYR A 513 28.172 22.391 -0.137 1.00 21.73 N ATOM 1203 CA TYR A 513 28.636 23.479 -0.992 1.00 25.15 C ATOM 1204 C TYR A 513 28.214 24.853 -0.481 1.00 22.22 C ATOM 1205 O TYR A 513 28.470 25.855 -1.141 1.00 28.50 O ATOM 1206 CB TYR A 513 28.137 23.279 -2.430 1.00 18.17 C ATOM 1207 CG TYR A 513 28.961 22.266 -3.201 1.00 26.01 C ATOM 1208 CD1 TYR A 513 30.089 22.658 -3.917 1.00 28.42 C ATOM 1209 CD2 TYR A 513 28.622 20.919 -3.200 1.00 20.38 C ATOM 1210 CE1 TYR A 513 30.848 21.737 -4.617 1.00 28.30 C ATOM 1211 CE2 TYR A 513 29.380 19.990 -3.889 1.00 25.57 C ATOM 1212 CZ TYR A 513 30.488 20.403 -4.599 1.00 31.16 C ATOM 1213 OH TYR A 513 31.238 19.478 -5.290 1.00 28.67 O ATOM 1214 HH TYR A 513 31.991 19.936 -5.741 1.00 0.00 H ATOM 1215 H TYR A 513 27.214 22.013 -0.279 1.00 0.00 H ATOM 1216 N SER A 514 27.584 24.889 0.692 1.00 20.73 N ATOM 1217 CA SER A 514 27.031 26.124 1.259 1.00 22.34 C ATOM 1218 C SER A 514 26.066 26.769 0.281 1.00 23.05 C ATOM 1219 O SER A 514 26.149 27.970 0.005 1.00 23.35 O ATOM 1220 CB SER A 514 28.134 27.123 1.630 1.00 18.15 C ATOM 1221 OG SER A 514 28.915 26.659 2.718 1.00 37.51 O ATOM 1222 HG SER A 514 29.615 27.327 2.929 1.00 0.00 H ATOM 1223 H SER A 514 27.480 24.004 1.229 1.00 0.00 H ATOM 1224 N SER A 515 25.164 25.956 -0.256 1.00 23.57 N ATOM 1225 CA SER A 515 24.183 26.433 -1.213 1.00 19.78 C ATOM 1226 C SER A 515 23.285 27.494 -0.590 1.00 23.83 C ATOM 1227 O SER A 515 22.938 27.412 0.587 1.00 22.04 O ATOM 1228 CB SER A 515 23.340 25.277 -1.742 1.00 17.95 C ATOM 1229 OG SER A 515 22.342 25.750 -2.627 1.00 22.54 O ATOM 1230 HG SER A 515 21.807 24.986 -2.958 1.00 0.00 H ATOM 1231 H SER A 515 25.160 24.952 0.016 1.00 0.00 H ATOM 1232 N PRO A 516 22.936 28.516 -1.380 1.00 18.53 N ATOM 1233 CA PRO A 516 21.932 29.516 -1.011 1.00 18.52 C ATOM 1234 C PRO A 516 20.540 28.901 -0.970 1.00 26.03 C ATOM 1235 O PRO A 516 19.607 29.537 -0.479 1.00 19.63 O ATOM 1236 CB PRO A 516 22.042 30.561 -2.123 1.00 18.63 C ATOM 1237 CG PRO A 516 22.552 29.796 -3.300 1.00 16.06 C ATOM 1238 CD PRO A 516 23.495 28.769 -2.719 1.00 16.54 C ATOM 1239 N ARG A 517 20.385 27.687 -1.497 1.00 26.74 N ATOM 1240 CA ARG A 517 19.053 27.114 -1.544 1.00 19.18 C ATOM 1241 C ARG A 517 18.853 26.365 -0.246 1.00 25.88 C ATOM 1242 O ARG A 517 19.187 25.185 -0.114 1.00 31.81 O ATOM 1243 CB ARG A 517 18.911 26.190 -2.757 1.00 15.53 C ATOM 1244 CG ARG A 517 19.113 26.931 -4.076 1.00 19.10 C ATOM 1245 CD ARG A 517 19.322 26.030 -5.285 1.00 15.37 C ATOM 1246 NE ARG A 517 19.247 26.824 -6.509 1.00 18.85 N ATOM 1247 CZ ARG A 517 20.258 27.530 -7.015 1.00 24.27 C ATOM 1248 NH1 ARG A 517 21.444 27.520 -6.426 1.00 23.55 N ATOM 1249 NH2 ARG A 517 20.084 28.244 -8.119 1.00 18.46 N ATOM 1250 HE ARG A 517 18.342 26.839 -7.021 1.00 0.00 H ATOM 1251 HH12 ARG A 517 22.228 28.073 -6.827 1.00 0.00 H ATOM 1252 HH11 ARG A 517 21.591 26.959 -5.563 1.00 0.00 H ATOM 1253 HH22 ARG A 517 20.874 28.794 -8.512 1.00 0.00 H ATOM 1254 HH21 ARG A 517 19.158 28.254 -8.591 1.00 0.00 H ATOM 1255 H ARG A 517 21.202 27.161 -1.867 1.00 0.00 H ATOM 1256 N THR A 518 18.177 27.046 0.666 1.00 24.76 N ATOM 1257 CA THR A 518 18.130 26.647 2.061 1.00 22.53 C ATOM 1258 C THR A 518 16.923 25.759 2.259 1.00 20.65 C ATOM 1259 O THR A 518 15.858 26.030 1.706 1.00 19.38 O ATOM 1260 CB THR A 518 18.044 27.872 2.995 1.00 27.93 C ATOM 1261 OG1 THR A 518 18.965 28.879 2.556 1.00 34.57 O ATOM 1262 CG2 THR A 518 18.352 27.493 4.433 1.00 23.99 C ATOM 1263 HG1 THR A 518 18.737 29.153 1.632 1.00 0.00 H ATOM 1264 H THR A 518 17.660 27.899 0.372 1.00 0.00 H ATOM 1265 N PHE A 519 17.103 24.689 3.023 1.00 22.42 N ATOM 1266 CA PHE A 519 15.997 23.846 3.429 1.00 28.23 C ATOM 1267 C PHE A 519 14.906 24.732 4.042 1.00 28.09 C ATOM 1268 O PHE A 519 15.223 25.654 4.794 1.00 30.65 O ATOM 1269 CB PHE A 519 16.474 22.789 4.430 1.00 26.41 C ATOM 1270 CG PHE A 519 15.433 21.773 4.763 1.00 25.10 C ATOM 1271 CD1 PHE A 519 15.302 20.625 3.997 1.00 20.01 C ATOM 1272 CD2 PHE A 519 14.562 21.977 5.821 1.00 21.70 C ATOM 1273 CE1 PHE A 519 14.330 19.690 4.292 1.00 16.45 C ATOM 1274 CE2 PHE A 519 13.584 21.047 6.119 1.00 16.43 C ATOM 1275 CZ PHE A 519 13.466 19.906 5.352 1.00 15.73 C ATOM 1276 H PHE A 519 18.064 24.449 3.339 1.00 0.00 H ATOM 1277 N PRO A 520 13.624 24.445 3.739 1.00 21.25 N ATOM 1278 CA PRO A 520 13.171 23.301 2.934 1.00 22.62 C ATOM 1279 C PRO A 520 13.064 23.510 1.423 1.00 25.21 C ATOM 1280 O PRO A 520 12.110 22.982 0.851 1.00 22.94 O ATOM 1281 CB PRO A 520 11.773 23.060 3.491 1.00 20.75 C ATOM 1282 CG PRO A 520 11.270 24.465 3.724 1.00 16.17 C ATOM 1283 CD PRO A 520 12.483 25.238 4.236 1.00 14.99 C ATOM 1284 N TRP A 521 14.043 24.140 0.781 1.00 20.40 N ATOM 1285 CA TRP A 521 13.964 24.382 -0.656 1.00 20.16 C ATOM 1286 C TRP A 521 13.812 23.059 -1.412 1.00 24.15 C ATOM 1287 O TRP A 521 12.910 22.907 -2.244 1.00 16.22 O ATOM 1288 CB TRP A 521 15.204 25.143 -1.149 1.00 17.54 C ATOM 1289 CG TRP A 521 15.212 25.471 -2.617 1.00 13.61 C ATOM 1290 CD1 TRP A 521 14.722 26.602 -3.210 1.00 16.39 C ATOM 1291 CD2 TRP A 521 15.752 24.666 -3.677 1.00 17.37 C ATOM 1292 NE1 TRP A 521 14.916 26.544 -4.571 1.00 14.23 N ATOM 1293 CE2 TRP A 521 15.545 25.370 -4.882 1.00 12.83 C ATOM 1294 CE3 TRP A 521 16.386 23.418 -3.722 1.00 16.58 C ATOM 1295 CZ2 TRP A 521 15.953 24.866 -6.118 1.00 19.93 C ATOM 1296 CZ3 TRP A 521 16.783 22.919 -4.947 1.00 11.71 C ATOM 1297 CH2 TRP A 521 16.568 23.643 -6.131 1.00 21.55 C ATOM 1298 HE1 TRP A 521 14.630 27.275 -5.253 1.00 0.00 H ATOM 1299 H TRP A 521 14.877 24.465 1.310 1.00 0.00 H ATOM 1300 N ILE A 522 14.673 22.095 -1.095 1.00 19.47 N ATOM 1301 CA ILE A 522 14.718 20.850 -1.854 1.00 17.21 C ATOM 1302 C ILE A 522 13.399 20.062 -1.760 1.00 15.04 C ATOM 1303 O ILE A 522 12.936 19.529 -2.768 1.00 13.91 O ATOM 1304 CB ILE A 522 15.940 19.954 -1.418 1.00 16.91 C ATOM 1305 CG1 ILE A 522 16.061 18.726 -2.323 1.00 18.08 C ATOM 1306 CG2 ILE A 522 15.880 19.555 0.063 1.00 20.50 C ATOM 1307 CD1 ILE A 522 16.343 19.067 -3.771 1.00 24.51 C ATOM 1308 H ILE A 522 15.323 22.231 -0.295 1.00 0.00 H ATOM 1309 N ILE A 523 12.761 20.022 -0.589 1.00 14.44 N ATOM 1310 CA ILE A 523 11.515 19.253 -0.469 1.00 14.46 C ATOM 1311 C ILE A 523 10.268 20.006 -0.944 1.00 18.79 C ATOM 1312 O ILE A 523 9.216 19.401 -1.172 1.00 22.57 O ATOM 1313 CB ILE A 523 11.277 18.773 0.970 1.00 12.36 C ATOM 1314 CG1 ILE A 523 11.241 19.949 1.938 1.00 10.98 C ATOM 1315 CG2 ILE A 523 12.351 17.750 1.378 1.00 14.53 C ATOM 1316 CD1 ILE A 523 10.533 19.641 3.241 1.00 19.84 C ATOM 1317 H ILE A 523 13.143 20.532 0.233 1.00 0.00 H ATOM 1318 N GLU A 524 10.368 21.319 -1.109 1.00 20.31 N ATOM 1319 CA GLU A 524 9.265 22.052 -1.724 1.00 23.11 C ATOM 1320 C GLU A 524 9.317 21.878 -3.234 1.00 20.21 C ATOM 1321 O GLU A 524 8.286 21.727 -3.894 1.00 22.35 O ATOM 1322 CB GLU A 524 9.305 23.526 -1.339 1.00 26.84 C ATOM 1323 CG GLU A 524 8.896 23.764 0.102 1.00 36.02 C ATOM 1324 CD GLU A 524 8.986 25.221 0.499 1.00 46.56 C ATOM 1325 OE1 GLU A 524 9.663 25.988 -0.216 1.00 49.33 O ATOM 1326 OE2 GLU A 524 8.377 25.597 1.524 1.00 51.61 O ATOM 1327 H GLU A 524 11.225 21.822 -0.803 1.00 0.00 H ATOM 1328 N VAL A 525 10.534 21.884 -3.763 1.00 18.59 N ATOM 1329 CA VAL A 525 10.789 21.693 -5.182 1.00 16.69 C ATOM 1330 C VAL A 525 10.367 20.297 -5.641 1.00 16.49 C ATOM 1331 O VAL A 525 9.844 20.123 -6.745 1.00 13.58 O ATOM 1332 CB VAL A 525 12.288 21.930 -5.496 1.00 21.59 C ATOM 1333 CG1 VAL A 525 12.725 21.181 -6.740 1.00 18.61 C ATOM 1334 CG2 VAL A 525 12.575 23.424 -5.620 1.00 15.12 C ATOM 1335 H VAL A 525 11.346 22.033 -3.131 1.00 0.00 H ATOM 1336 N LEU A 526 10.584 19.309 -4.779 1.00 13.80 N ATOM 1337 CA LEU A 526 10.293 17.916 -5.110 1.00 20.20 C ATOM 1338 C LEU A 526 8.931 17.451 -4.592 1.00 18.49 C ATOM 1339 O LEU A 526 8.583 16.282 -4.730 1.00 17.90 O ATOM 1340 CB LEU A 526 11.390 17.003 -4.559 1.00 22.27 C ATOM 1341 CG LEU A 526 12.786 17.162 -5.158 1.00 26.11 C ATOM 1342 CD1 LEU A 526 13.742 16.192 -4.496 1.00 23.31 C ATOM 1343 CD2 LEU A 526 12.760 16.942 -6.667 1.00 26.91 C ATOM 1344 H LEU A 526 10.973 19.534 -3.841 1.00 0.00 H ATOM 1345 N ASN A 527 8.183 18.366 -3.982 1.00 17.03 N ATOM 1346 CA ASN A 527 6.871 18.068 -3.416 1.00 22.45 C ATOM 1347 C ASN A 527 6.888 16.931 -2.403 1.00 26.69 C ATOM 1348 O ASN A 527 6.049 16.030 -2.447 1.00 23.90 O ATOM 1349 CB ASN A 527 5.865 17.750 -4.529 1.00 23.43 C ATOM 1350 CG ASN A 527 5.186 18.995 -5.067 1.00 30.43 C ATOM 1351 OD1 ASN A 527 4.331 19.577 -4.404 1.00 32.62 O ATOM 1352 ND2 ASN A 527 5.571 19.415 -6.267 1.00 22.32 N ATOM 1353 HD22 ASN A 527 6.299 18.890 -6.793 1.00 0.00 H ATOM 1354 HD21 ASN A 527 5.145 20.269 -6.681 1.00 0.00 H ATOM 1355 H ASN A 527 8.549 19.336 -3.905 1.00 0.00 H ATOM 1356 N LEU A 528 7.844 16.978 -1.485 1.00 19.28 N ATOM 1357 CA LEU A 528 7.911 15.986 -0.428 1.00 21.47 C ATOM 1358 C LEU A 528 7.352 16.534 0.877 1.00 19.19 C ATOM 1359 O LEU A 528 7.841 17.531 1.410 1.00 19.34 O ATOM 1360 CB LEU A 528 9.347 15.513 -0.233 1.00 25.24 C ATOM 1361 CG LEU A 528 9.813 14.511 -1.283 1.00 24.73 C ATOM 1362 CD1 LEU A 528 11.314 14.457 -1.313 1.00 20.15 C ATOM 1363 CD2 LEU A 528 9.236 13.131 -0.995 1.00 17.00 C ATOM 1364 H LEU A 528 8.555 17.736 -1.523 1.00 0.00 H ATOM 1365 N GLN A 529 6.316 15.872 1.377 1.00 15.93 N ATOM 1366 CA GLN A 529 5.712 16.212 2.659 1.00 17.81 C ATOM 1367 C GLN A 529 6.721 16.083 3.784 1.00 19.77 C ATOM 1368 O GLN A 529 7.336 15.030 3.943 1.00 27.08 O ATOM 1369 CB GLN A 529 4.504 15.311 2.943 1.00 22.62 C ATOM 1370 CG GLN A 529 3.283 15.618 2.105 1.00 25.35 C ATOM 1371 CD GLN A 529 2.577 16.869 2.574 1.00 40.33 C ATOM 1372 OE1 GLN A 529 2.596 17.195 3.762 1.00 36.78 O ATOM 1373 NE2 GLN A 529 1.945 17.579 1.645 1.00 52.42 N ATOM 1374 HE22 GLN A 529 1.956 17.265 0.654 1.00 0.00 H ATOM 1375 HE21 GLN A 529 1.440 18.449 1.909 1.00 0.00 H ATOM 1376 H GLN A 529 5.920 15.079 0.833 1.00 0.00 H ATOM 1377 N PRO A 530 6.894 17.161 4.566 1.00 23.18 N ATOM 1378 CA PRO A 530 7.757 17.176 5.752 1.00 19.74 C ATOM 1379 C PRO A 530 7.459 16.016 6.700 1.00 14.68 C ATOM 1380 O PRO A 530 8.378 15.412 7.239 1.00 12.26 O ATOM 1381 CB PRO A 530 7.417 18.520 6.420 1.00 15.82 C ATOM 1382 CG PRO A 530 6.966 19.388 5.306 1.00 18.55 C ATOM 1383 CD PRO A 530 6.262 18.473 4.322 1.00 17.29 C ATOM 1384 N PHE A 531 6.181 15.715 6.889 1.00 20.00 N ATOM 1385 CA PHE A 531 5.754 14.670 7.815 1.00 14.92 C ATOM 1386 C PHE A 531 6.295 13.294 7.410 1.00 17.51 C ATOM 1387 O PHE A 531 6.591 12.452 8.262 1.00 23.35 O ATOM 1388 CB PHE A 531 4.222 14.646 7.892 1.00 16.44 C ATOM 1389 CG PHE A 531 3.663 13.589 8.813 1.00 15.73 C ATOM 1390 CD1 PHE A 531 3.839 13.680 10.184 1.00 13.93 C ATOM 1391 CD2 PHE A 531 2.941 12.517 8.301 1.00 13.89 C ATOM 1392 CE1 PHE A 531 3.313 12.718 11.027 1.00 22.99 C ATOM 1393 CE2 PHE A 531 2.420 11.552 9.133 1.00 21.16 C ATOM 1394 CZ PHE A 531 2.606 11.650 10.502 1.00 29.80 C ATOM 1395 H PHE A 531 5.458 16.242 6.359 1.00 0.00 H ATOM 1396 N TYR A 532 6.391 13.056 6.107 1.00 13.44 N ATOM 1397 CA TYR A 532 6.943 11.805 5.605 1.00 14.42 C ATOM 1398 C TYR A 532 8.465 11.851 5.537 1.00 19.40 C ATOM 1399 O TYR A 532 9.147 10.921 5.957 1.00 25.23 O ATOM 1400 CB TYR A 532 6.363 11.490 4.227 1.00 24.24 C ATOM 1401 CG TYR A 532 4.861 11.296 4.220 1.00 27.85 C ATOM 1402 CD1 TYR A 532 4.221 10.615 5.247 1.00 31.59 C ATOM 1403 CD2 TYR A 532 4.085 11.794 3.183 1.00 29.53 C ATOM 1404 CE1 TYR A 532 2.846 10.433 5.236 1.00 33.13 C ATOM 1405 CE2 TYR A 532 2.717 11.621 3.165 1.00 30.60 C ATOM 1406 CZ TYR A 532 2.103 10.941 4.192 1.00 31.56 C ATOM 1407 OH TYR A 532 0.737 10.773 4.165 1.00 45.45 O ATOM 1408 HH TYR A 532 0.452 10.268 4.967 1.00 0.00 H ATOM 1409 H TYR A 532 6.066 13.777 5.432 1.00 0.00 H ATOM 1410 N PHE A 533 8.984 12.965 5.035 1.00 22.25 N ATOM 1411 CA PHE A 533 10.400 13.093 4.713 1.00 20.05 C ATOM 1412 C PHE A 533 11.343 12.912 5.899 1.00 14.84 C ATOM 1413 O PHE A 533 12.342 12.207 5.784 1.00 19.42 O ATOM 1414 CB PHE A 533 10.667 14.455 4.065 1.00 19.81 C ATOM 1415 CG PHE A 533 12.123 14.766 3.904 1.00 20.88 C ATOM 1416 CD1 PHE A 533 12.856 14.203 2.865 1.00 22.98 C ATOM 1417 CD2 PHE A 533 12.767 15.619 4.790 1.00 15.97 C ATOM 1418 CE1 PHE A 533 14.211 14.483 2.716 1.00 17.44 C ATOM 1419 CE2 PHE A 533 14.120 15.901 4.644 1.00 23.12 C ATOM 1420 CZ PHE A 533 14.839 15.331 3.606 1.00 18.41 C ATOM 1421 H PHE A 533 8.357 13.777 4.865 1.00 0.00 H ATOM 1422 N TYR A 534 11.034 13.542 7.030 1.00 15.79 N ATOM 1423 CA TYR A 534 11.959 13.583 8.165 1.00 18.57 C ATOM 1424 C TYR A 534 12.434 12.188 8.601 1.00 21.81 C ATOM 1425 O TYR A 534 13.520 12.042 9.169 1.00 23.21 O ATOM 1426 CB TYR A 534 11.310 14.295 9.361 1.00 17.44 C ATOM 1427 CG TYR A 534 10.524 13.350 10.228 1.00 21.24 C ATOM 1428 CD1 TYR A 534 11.109 12.739 11.337 1.00 19.13 C ATOM 1429 CD2 TYR A 534 9.206 13.040 9.924 1.00 18.06 C ATOM 1430 CE1 TYR A 534 10.398 11.852 12.115 1.00 22.74 C ATOM 1431 CE2 TYR A 534 8.489 12.155 10.700 1.00 18.44 C ATOM 1432 CZ TYR A 534 9.088 11.566 11.789 1.00 16.88 C ATOM 1433 OH TYR A 534 8.377 10.686 12.557 1.00 24.04 O ATOM 1434 HH TYR A 534 8.949 10.356 13.294 1.00 0.00 H ATOM 1435 H TYR A 534 10.112 14.017 7.110 1.00 0.00 H ATOM 1436 N LYS A 535 11.616 11.171 8.344 1.00 24.89 N ATOM 1437 CA LYS A 535 11.913 9.805 8.778 1.00 28.06 C ATOM 1438 C LYS A 535 13.186 9.234 8.152 1.00 22.99 C ATOM 1439 O LYS A 535 13.808 8.339 8.715 1.00 23.93 O ATOM 1440 CB LYS A 535 10.731 8.872 8.465 1.00 33.57 C ATOM 1441 CG LYS A 535 9.497 9.127 9.317 1.00 37.25 C ATOM 1442 CD LYS A 535 8.627 7.877 9.493 1.00 38.80 C ATOM 1443 CE LYS A 535 7.810 7.538 8.255 1.00 34.20 C ATOM 1444 NZ LYS A 535 8.540 6.626 7.332 1.00 29.61 N ATOM 1445 HZ1 LYS A 535 9.422 7.081 7.023 1.00 0.00 H ATOM 1446 HZ2 LYS A 535 8.761 5.738 7.827 1.00 0.00 H ATOM 1447 HZ3 LYS A 535 7.944 6.423 6.504 1.00 0.00 H ATOM 1448 H LYS A 535 10.737 11.352 7.818 1.00 0.00 H ATOM 1449 N VAL A 536 13.571 9.745 6.988 1.00 17.35 N ATOM 1450 CA VAL A 536 14.738 9.220 6.289 1.00 12.86 C ATOM 1451 C VAL A 536 16.054 9.737 6.895 1.00 16.21 C ATOM 1452 O VAL A 536 17.095 9.088 6.780 1.00 17.16 O ATOM 1453 CB VAL A 536 14.683 9.575 4.777 1.00 22.86 C ATOM 1454 CG1 VAL A 536 15.072 11.031 4.541 1.00 12.77 C ATOM 1455 CG2 VAL A 536 15.573 8.637 3.968 1.00 18.95 C ATOM 1456 H VAL A 536 13.033 10.530 6.569 1.00 0.00 H ATOM 1457 N ILE A 537 16.004 10.890 7.556 1.00 15.32 N ATOM 1458 CA ILE A 537 17.215 11.515 8.092 1.00 18.51 C ATOM 1459 C ILE A 537 17.956 10.590 9.058 1.00 20.90 C ATOM 1460 O ILE A 537 19.175 10.413 8.958 1.00 25.61 O ATOM 1461 CB ILE A 537 16.880 12.846 8.800 1.00 19.90 C ATOM 1462 CG1 ILE A 537 16.290 13.843 7.793 1.00 15.14 C ATOM 1463 CG2 ILE A 537 18.115 13.427 9.480 1.00 19.70 C ATOM 1464 CD1 ILE A 537 15.630 15.049 8.433 1.00 18.24 C ATOM 1465 H ILE A 537 15.086 11.358 7.695 1.00 0.00 H ATOM 1466 N GLU A 538 17.212 9.990 9.980 1.00 20.24 N ATOM 1467 CA GLU A 538 17.786 9.062 10.945 1.00 23.58 C ATOM 1468 C GLU A 538 18.323 7.807 10.250 1.00 24.05 C ATOM 1469 O GLU A 538 19.281 7.185 10.723 1.00 23.40 O ATOM 1470 CB GLU A 538 16.745 8.686 12.002 1.00 29.72 C ATOM 1471 CG GLU A 538 17.298 7.903 13.180 1.00 42.64 C ATOM 1472 CD GLU A 538 16.299 7.787 14.321 1.00 52.99 C ATOM 1473 OE1 GLU A 538 15.136 7.410 14.059 1.00 52.31 O ATOM 1474 OE2 GLU A 538 16.675 8.082 15.477 1.00 53.25 O ATOM 1475 H GLU A 538 16.192 10.188 10.014 1.00 0.00 H ATOM 1476 N VAL A 539 17.717 7.435 9.126 1.00 18.55 N ATOM 1477 CA VAL A 539 18.215 6.284 8.377 1.00 23.97 C ATOM 1478 C VAL A 539 19.545 6.639 7.719 1.00 25.46 C ATOM 1479 O VAL A 539 20.484 5.849 7.751 1.00 22.38 O ATOM 1480 CB VAL A 539 17.223 5.803 7.297 1.00 26.84 C ATOM 1481 CG1 VAL A 539 17.806 4.607 6.552 1.00 28.28 C ATOM 1482 CG2 VAL A 539 15.883 5.443 7.916 1.00 22.81 C ATOM 1483 H VAL A 539 16.890 7.963 8.781 1.00 0.00 H ATOM 1484 N VAL A 540 19.614 7.830 7.124 1.00 24.10 N ATOM 1485 CA VAL A 540 20.849 8.329 6.516 1.00 21.78 C ATOM 1486 C VAL A 540 21.984 8.418 7.533 1.00 21.18 C ATOM 1487 O VAL A 540 23.092 7.946 7.283 1.00 25.56 O ATOM 1488 CB VAL A 540 20.650 9.719 5.884 1.00 19.92 C ATOM 1489 CG1 VAL A 540 21.997 10.368 5.572 1.00 15.38 C ATOM 1490 CG2 VAL A 540 19.779 9.625 4.634 1.00 14.63 C ATOM 1491 H VAL A 540 18.762 8.425 7.091 1.00 0.00 H ATOM 1492 N ILE A 541 21.696 9.022 8.681 1.00 22.58 N ATOM 1493 CA ILE A 541 22.694 9.194 9.730 1.00 30.68 C ATOM 1494 C ILE A 541 23.234 7.835 10.188 1.00 27.35 C ATOM 1495 O ILE A 541 24.430 7.677 10.407 1.00 31.58 O ATOM 1496 CB ILE A 541 22.110 9.988 10.930 1.00 18.31 C ATOM 1497 CG1 ILE A 541 21.798 11.424 10.490 1.00 20.40 C ATOM 1498 CG2 ILE A 541 23.086 9.998 12.102 1.00 20.14 C ATOM 1499 CD1 ILE A 541 21.248 12.322 11.580 1.00 15.45 C ATOM 1500 H ILE A 541 20.733 9.382 8.835 1.00 0.00 H ATOM 1501 N ARG A 542 22.348 6.851 10.291 1.00 21.59 N ATOM 1502 CA ARG A 542 22.736 5.491 10.643 1.00 28.53 C ATOM 1503 C ARG A 542 23.564 4.810 9.558 1.00 33.52 C ATOM 1504 O ARG A 542 24.542 4.129 9.849 1.00 35.97 O ATOM 1505 CB ARG A 542 21.498 4.636 10.918 1.00 34.56 C ATOM 1506 CG ARG A 542 20.839 4.835 12.272 1.00 42.42 C ATOM 1507 CD ARG A 542 19.552 4.019 12.336 1.00 50.69 C ATOM 1508 NE ARG A 542 19.688 2.758 11.606 1.00 56.52 N ATOM 1509 CZ ARG A 542 18.775 2.268 10.772 1.00 61.40 C ATOM 1510 NH1 ARG A 542 17.642 2.924 10.557 1.00 53.52 N ATOM 1511 NH2 ARG A 542 18.992 1.115 10.153 1.00 69.06 N ATOM 1512 HE ARG A 542 20.558 2.207 11.749 1.00 0.00 H ATOM 1513 HH12 ARG A 542 16.932 2.536 9.904 1.00 0.00 H ATOM 1514 HH11 ARG A 542 17.464 3.827 11.042 1.00 0.00 H ATOM 1515 HH22 ARG A 542 18.278 0.732 9.501 1.00 0.00 H ATOM 1516 HH21 ARG A 542 19.876 0.594 10.320 1.00 0.00 H ATOM 1517 H ARG A 542 21.344 7.058 10.115 1.00 0.00 H ATOM 1518 N SER A 543 23.158 4.985 8.305 1.00 30.55 N ATOM 1519 CA SER A 543 23.693 4.169 7.218 1.00 27.47 C ATOM 1520 C SER A 543 24.953 4.716 6.547 1.00 32.98 C ATOM 1521 O SER A 543 25.591 4.012 5.768 1.00 42.97 O ATOM 1522 CB SER A 543 22.609 3.964 6.168 1.00 23.32 C ATOM 1523 OG SER A 543 21.445 3.432 6.777 1.00 33.15 O ATOM 1524 HG SER A 543 21.662 2.563 7.198 1.00 0.00 H ATOM 1525 H SER A 543 22.448 5.715 8.095 1.00 0.00 H ATOM 1526 N GLU A 544 25.311 5.961 6.830 1.00 23.34 N ATOM 1527 CA GLU A 544 26.557 6.499 6.307 1.00 32.90 C ATOM 1528 C GLU A 544 27.376 7.089 7.446 1.00 40.96 C ATOM 1529 O GLU A 544 27.044 8.148 7.989 1.00 46.12 O ATOM 1530 CB GLU A 544 26.283 7.554 5.228 1.00 36.89 C ATOM 1531 CG GLU A 544 27.541 8.148 4.597 1.00 39.21 C ATOM 1532 CD GLU A 544 28.522 7.088 4.111 1.00 37.59 C ATOM 1533 OE1 GLU A 544 28.242 6.433 3.084 1.00 33.10 O ATOM 1534 OE2 GLU A 544 29.575 6.912 4.758 1.00 38.10 O ATOM 1535 H GLU A 544 24.700 6.554 7.427 1.00 0.00 H ATOM 1536 N GLU A 545 28.470 6.413 7.776 1.00 31.42 N ATOM 1537 CA GLU A 545 29.300 6.799 8.910 1.00 41.49 C ATOM 1538 C GLU A 545 30.370 7.787 8.471 1.00 26.91 C ATOM 1539 O GLU A 545 31.054 8.388 9.295 1.00 34.10 O ATOM 1540 CB GLU A 545 29.942 5.563 9.555 1.00 49.69 C ATOM 1541 CG GLU A 545 29.014 4.785 10.486 1.00 58.47 C ATOM 1542 CD GLU A 545 29.029 5.316 11.917 1.00 68.40 C ATOM 1543 OE1 GLU A 545 30.087 5.218 12.577 1.00 73.43 O ATOM 1544 OE2 GLU A 545 27.986 5.829 12.381 1.00 66.72 O ATOM 1545 H GLU A 545 28.742 5.585 7.209 1.00 0.00 H ATOM 1546 N GLY A 546 30.504 7.940 7.159 1.00 23.40 N ATOM 1547 CA GLY A 546 31.464 8.860 6.584 1.00 27.57 C ATOM 1548 C GLY A 546 30.999 10.304 6.644 1.00 31.42 C ATOM 1549 O GLY A 546 31.773 11.216 6.356 1.00 30.93 O ATOM 1550 H GLY A 546 29.900 7.381 6.523 1.00 0.00 H ATOM 1551 N LEU A 547 29.737 10.516 7.013 1.00 28.36 N ATOM 1552 CA LEU A 547 29.231 11.874 7.207 1.00 28.88 C ATOM 1553 C LEU A 547 29.960 12.543 8.362 1.00 28.44 C ATOM 1554 O LEU A 547 30.188 11.934 9.407 1.00 36.44 O ATOM 1555 CB LEU A 547 27.720 11.880 7.471 1.00 23.69 C ATOM 1556 CG LEU A 547 26.812 11.353 6.359 1.00 27.39 C ATOM 1557 CD1 LEU A 547 25.341 11.547 6.722 1.00 28.96 C ATOM 1558 CD2 LEU A 547 27.142 12.015 5.033 1.00 25.15 C ATOM 1559 H LEU A 547 29.103 9.705 7.165 1.00 0.00 H ATOM 1560 N SER A 548 30.322 13.802 8.164 1.00 30.22 N ATOM 1561 CA SER A 548 31.005 14.579 9.193 1.00 32.61 C ATOM 1562 C SER A 548 30.057 14.967 10.324 1.00 29.43 C ATOM 1563 O SER A 548 28.829 14.853 10.197 1.00 21.55 O ATOM 1564 CB SER A 548 31.632 15.831 8.587 1.00 30.21 C ATOM 1565 OG SER A 548 30.630 16.680 8.061 1.00 31.25 O ATOM 1566 HG SER A 548 31.053 17.486 7.672 1.00 0.00 H ATOM 1567 H SER A 548 30.113 14.249 7.249 1.00 0.00 H ATOM 1568 N ARG A 549 30.638 15.377 11.446 1.00 29.51 N ATOM 1569 CA ARG A 549 29.869 15.938 12.552 1.00 33.96 C ATOM 1570 C ARG A 549 29.001 17.122 12.105 1.00 32.82 C ATOM 1571 O ARG A 549 27.844 17.247 12.524 1.00 29.06 O ATOM 1572 CB ARG A 549 30.810 16.367 13.678 1.00 40.59 C ATOM 1573 CG ARG A 549 31.541 15.206 14.340 1.00 50.51 C ATOM 1574 CD ARG A 549 32.808 15.670 15.044 1.00 57.84 C ATOM 1575 NE ARG A 549 33.766 16.231 14.096 1.00 66.13 N ATOM 1576 CZ ARG A 549 34.970 16.689 14.423 1.00 71.04 C ATOM 1577 NH1 ARG A 549 35.378 16.658 15.685 1.00 73.41 N ATOM 1578 NH2 ARG A 549 35.769 17.181 13.484 1.00 72.83 N ATOM 1579 HE ARG A 549 33.487 16.275 13.095 1.00 0.00 H ATOM 1580 HH12 ARG A 549 36.321 17.018 15.936 1.00 0.00 H ATOM 1581 HH11 ARG A 549 34.755 16.274 16.424 1.00 0.00 H ATOM 1582 HH22 ARG A 549 36.711 17.540 13.739 1.00 0.00 H ATOM 1583 HH21 ARG A 549 35.453 17.208 12.494 1.00 0.00 H ATOM 1584 H ARG A 549 31.671 15.296 11.539 1.00 0.00 H ATOM 1585 N ASP A 550 29.553 17.978 11.245 1.00 27.43 N ATOM 1586 CA ASP A 550 28.825 19.151 10.750 1.00 27.84 C ATOM 1587 C ASP A 550 27.667 18.765 9.832 1.00 27.88 C ATOM 1588 O ASP A 550 26.602 19.379 9.881 1.00 38.37 O ATOM 1589 CB ASP A 550 29.770 20.111 10.022 1.00 32.22 C ATOM 1590 CG ASP A 550 30.553 20.998 10.980 1.00 49.69 C ATOM 1591 OD1 ASP A 550 30.175 21.070 12.169 1.00 55.14 O ATOM 1592 OD2 ASP A 550 31.543 21.629 10.546 1.00 55.63 O ATOM 1593 H ASP A 550 30.525 17.810 10.916 1.00 0.00 H ATOM 1594 N MET A 551 27.878 17.754 8.996 1.00 25.46 N ATOM 1595 CA MET A 551 26.813 17.227 8.150 1.00 26.96 C ATOM 1596 C MET A 551 25.689 16.630 8.995 1.00 22.49 C ATOM 1597 O MET A 551 24.516 16.898 8.747 1.00 24.95 O ATOM 1598 CB MET A 551 27.354 16.173 7.181 1.00 32.02 C ATOM 1599 CG MET A 551 28.271 16.715 6.092 1.00 40.77 C ATOM 1600 SD MET A 551 29.018 15.410 5.079 1.00 51.87 S ATOM 1601 CE MET A 551 30.305 16.338 4.251 1.00 44.34 C ATOM 1602 H MET A 551 28.825 17.328 8.944 1.00 0.00 H ATOM 1603 N VAL A 552 26.051 15.824 9.992 1.00 22.86 N ATOM 1604 CA VAL A 552 25.062 15.210 10.887 1.00 23.85 C ATOM 1605 C VAL A 552 24.299 16.280 11.673 1.00 18.97 C ATOM 1606 O VAL A 552 23.085 16.204 11.830 1.00 22.18 O ATOM 1607 CB VAL A 552 25.727 14.211 11.860 1.00 25.49 C ATOM 1608 CG1 VAL A 552 24.785 13.831 12.992 1.00 24.60 C ATOM 1609 CG2 VAL A 552 26.183 12.965 11.107 1.00 21.90 C ATOM 1610 H VAL A 552 27.061 15.624 10.140 1.00 0.00 H ATOM 1611 N LYS A 553 25.015 17.296 12.135 1.00 22.97 N ATOM 1612 CA LYS A 553 24.395 18.420 12.827 1.00 25.74 C ATOM 1613 C LYS A 553 23.337 19.087 11.948 1.00 24.84 C ATOM 1614 O LYS A 553 22.225 19.375 12.394 1.00 27.43 O ATOM 1615 CB LYS A 553 25.459 19.436 13.234 1.00 37.14 C ATOM 1616 CG LYS A 553 25.136 20.224 14.484 1.00 47.53 C ATOM 1617 CD LYS A 553 26.309 21.113 14.872 1.00 54.59 C ATOM 1618 CE LYS A 553 27.622 20.337 14.854 1.00 58.42 C ATOM 1619 NZ LYS A 553 27.587 19.123 15.722 1.00 58.72 N ATOM 1620 HZ1 LYS A 553 27.398 19.406 16.705 1.00 0.00 H ATOM 1621 HZ2 LYS A 553 26.835 18.485 15.393 1.00 0.00 H ATOM 1622 HZ3 LYS A 553 28.504 18.635 15.671 1.00 0.00 H ATOM 1623 H LYS A 553 26.046 17.291 12.000 1.00 0.00 H ATOM 1624 N HIS A 554 23.690 19.319 10.690 1.00 19.96 N ATOM 1625 CA HIS A 554 22.762 19.916 9.749 1.00 16.65 C ATOM 1626 C HIS A 554 21.518 19.054 9.563 1.00 16.55 C ATOM 1627 O HIS A 554 20.395 19.564 9.538 1.00 19.38 O ATOM 1628 CB HIS A 554 23.439 20.146 8.401 1.00 24.26 C ATOM 1629 CG HIS A 554 22.538 20.764 7.382 1.00 28.07 C ATOM 1630 ND1 HIS A 554 21.959 22.002 7.557 1.00 26.09 N ATOM 1631 CD2 HIS A 554 22.098 20.308 6.185 1.00 27.95 C ATOM 1632 CE1 HIS A 554 21.213 22.289 6.506 1.00 24.18 C ATOM 1633 NE2 HIS A 554 21.279 21.277 5.659 1.00 23.21 N ATOM 1634 H HIS A 554 24.648 19.068 10.374 1.00 0.00 H ATOM 1635 N LEU A 555 21.719 17.748 9.437 1.00 16.80 N ATOM 1636 CA LEU A 555 20.606 16.830 9.247 1.00 19.38 C ATOM 1637 C LEU A 555 19.706 16.809 10.471 1.00 18.11 C ATOM 1638 O LEU A 555 18.487 16.767 10.351 1.00 17.52 O ATOM 1639 CB LEU A 555 21.115 15.424 8.944 1.00 22.31 C ATOM 1640 CG LEU A 555 21.746 15.280 7.563 1.00 32.22 C ATOM 1641 CD1 LEU A 555 22.460 13.941 7.444 1.00 35.12 C ATOM 1642 CD2 LEU A 555 20.682 15.428 6.492 1.00 28.37 C ATOM 1643 H LEU A 555 22.689 17.374 9.475 1.00 0.00 H ATOM 1644 N ASN A 556 20.308 16.836 11.651 1.00 21.15 N ATOM 1645 CA ASN A 556 19.519 16.953 12.869 1.00 20.32 C ATOM 1646 C ASN A 556 18.790 18.299 12.957 1.00 25.19 C ATOM 1647 O ASN A 556 17.690 18.372 13.503 1.00 28.83 O ATOM 1648 CB ASN A 556 20.404 16.735 14.094 1.00 18.48 C ATOM 1649 CG ASN A 556 20.792 15.267 14.274 1.00 27.31 C ATOM 1650 OD1 ASN A 556 20.022 14.370 13.939 1.00 29.89 O ATOM 1651 ND2 ASN A 556 21.987 15.023 14.795 1.00 25.21 N ATOM 1652 HD22 ASN A 556 22.608 15.813 15.065 1.00 0.00 H ATOM 1653 HD21 ASN A 556 22.303 14.042 14.934 1.00 0.00 H ATOM 1654 H ASN A 556 21.345 16.774 11.707 1.00 0.00 H ATOM 1655 N SER A 557 19.383 19.354 12.400 1.00 20.44 N ATOM 1656 CA SER A 557 18.757 20.677 12.448 1.00 22.28 C ATOM 1657 C SER A 557 17.496 20.714 11.606 1.00 20.36 C ATOM 1658 O SER A 557 16.485 21.265 12.023 1.00 16.60 O ATOM 1659 CB SER A 557 19.716 21.774 11.972 1.00 19.67 C ATOM 1660 OG SER A 557 20.881 21.823 12.773 1.00 36.65 O ATOM 1661 HG SER A 557 21.350 20.952 12.725 1.00 0.00 H ATOM 1662 H SER A 557 20.301 19.237 11.926 1.00 0.00 H ATOM 1663 N ILE A 558 17.552 20.134 10.416 1.00 16.98 N ATOM 1664 CA ILE A 558 16.399 20.207 9.534 1.00 23.92 C ATOM 1665 C ILE A 558 15.318 19.218 9.970 1.00 21.84 C ATOM 1666 O ILE A 558 14.153 19.389 9.636 1.00 25.41 O ATOM 1667 CB ILE A 558 16.787 19.965 8.057 1.00 25.38 C ATOM 1668 CG1 ILE A 558 17.303 18.547 7.840 1.00 26.84 C ATOM 1669 CG2 ILE A 558 17.829 20.987 7.604 1.00 15.65 C ATOM 1670 CD1 ILE A 558 17.623 18.260 6.390 1.00 29.17 C ATOM 1671 H ILE A 558 18.412 19.632 10.116 1.00 0.00 H ATOM 1672 N GLU A 559 15.697 18.194 10.729 1.00 21.88 N ATOM 1673 CA GLU A 559 14.701 17.316 11.333 1.00 21.80 C ATOM 1674 C GLU A 559 13.949 18.081 12.417 1.00 18.74 C ATOM 1675 O GLU A 559 12.718 18.038 12.494 1.00 12.68 O ATOM 1676 CB GLU A 559 15.345 16.059 11.920 1.00 23.96 C ATOM 1677 CG GLU A 559 14.345 15.138 12.600 1.00 28.59 C ATOM 1678 CD GLU A 559 15.007 14.009 13.372 1.00 40.74 C ATOM 1679 OE1 GLU A 559 15.442 14.248 14.523 1.00 39.73 O ATOM 1680 OE2 GLU A 559 15.084 12.883 12.830 1.00 38.90 O ATOM 1681 H GLU A 559 16.709 18.018 10.893 1.00 0.00 H ATOM 1682 N GLU A 560 14.706 18.797 13.243 1.00 16.77 N ATOM 1683 CA GLU A 560 14.127 19.667 14.261 1.00 21.19 C ATOM 1684 C GLU A 560 13.219 20.733 13.655 1.00 16.52 C ATOM 1685 O GLU A 560 12.171 21.045 14.217 1.00 17.69 O ATOM 1686 CB GLU A 560 15.229 20.324 15.091 1.00 20.99 C ATOM 1687 CG GLU A 560 16.020 19.331 15.929 1.00 30.38 C ATOM 1688 CD GLU A 560 16.891 20.005 16.968 1.00 36.17 C ATOM 1689 OE1 GLU A 560 16.772 21.238 17.130 1.00 38.96 O ATOM 1690 OE2 GLU A 560 17.687 19.300 17.627 1.00 38.77 O ATOM 1691 H GLU A 560 15.741 18.735 13.161 1.00 0.00 H ATOM 1692 N GLN A 561 13.616 21.277 12.507 1.00 18.03 N ATOM 1693 CA GLN A 561 12.811 22.283 11.818 1.00 20.32 C ATOM 1694 C GLN A 561 11.462 21.708 11.399 1.00 15.60 C ATOM 1695 O GLN A 561 10.437 22.389 11.445 1.00 19.71 O ATOM 1696 CB GLN A 561 13.534 22.819 10.582 1.00 21.65 C ATOM 1697 CG GLN A 561 14.712 23.723 10.862 1.00 32.67 C ATOM 1698 CD GLN A 561 15.341 24.231 9.584 1.00 37.33 C ATOM 1699 OE1 GLN A 561 14.658 24.401 8.571 1.00 34.90 O ATOM 1700 NE2 GLN A 561 16.648 24.467 9.616 1.00 35.70 N ATOM 1701 HE22 GLN A 561 17.184 24.309 10.493 1.00 0.00 H ATOM 1702 HE21 GLN A 561 17.136 24.810 8.764 1.00 0.00 H ATOM 1703 H GLN A 561 14.521 20.979 12.090 1.00 0.00 H ATOM 1704 N ILE A 562 11.475 20.452 10.975 1.00 17.67 N ATOM 1705 CA ILE A 562 10.252 19.775 10.552 1.00 18.38 C ATOM 1706 C ILE A 562 9.369 19.498 11.762 1.00 14.81 C ATOM 1707 O ILE A 562 8.167 19.784 11.759 1.00 23.58 O ATOM 1708 CB ILE A 562 10.574 18.464 9.816 1.00 13.74 C ATOM 1709 CG1 ILE A 562 11.302 18.777 8.508 1.00 21.18 C ATOM 1710 CG2 ILE A 562 9.303 17.643 9.563 1.00 11.94 C ATOM 1711 CD1 ILE A 562 11.928 17.568 7.830 1.00 20.78 C ATOM 1712 H ILE A 562 12.378 19.936 10.943 1.00 0.00 H ATOM 1713 N LEU A 563 9.985 18.946 12.799 1.00 14.80 N ATOM 1714 CA LEU A 563 9.286 18.612 14.035 1.00 17.77 C ATOM 1715 C LEU A 563 8.675 19.827 14.737 1.00 18.89 C ATOM 1716 O LEU A 563 7.594 19.727 15.309 1.00 16.75 O ATOM 1717 CB LEU A 563 10.239 17.902 14.992 1.00 17.12 C ATOM 1718 CG LEU A 563 10.762 16.557 14.492 1.00 22.09 C ATOM 1719 CD1 LEU A 563 11.735 15.947 15.502 1.00 17.19 C ATOM 1720 CD2 LEU A 563 9.592 15.628 14.206 1.00 14.17 C ATOM 1721 H LEU A 563 11.003 18.744 12.728 1.00 0.00 H ATOM 1722 N GLU A 564 9.382 20.957 14.713 1.00 19.43 N ATOM 1723 CA GLU A 564 8.951 22.152 15.444 1.00 21.89 C ATOM 1724 C GLU A 564 7.916 23.020 14.719 1.00 22.27 C ATOM 1725 O GLU A 564 7.111 23.677 15.372 1.00 22.81 O ATOM 1726 CB GLU A 564 10.169 23.019 15.811 1.00 14.86 C ATOM 1727 CG GLU A 564 10.739 23.833 14.666 1.00 22.00 C ATOM 1728 CD GLU A 564 12.107 24.423 14.977 1.00 25.81 C ATOM 1729 OE1 GLU A 564 12.627 24.201 16.091 1.00 26.97 O ATOM 1730 OE2 GLU A 564 12.664 25.111 14.096 1.00 27.48 O ATOM 1731 H GLU A 564 10.263 20.991 14.161 1.00 0.00 H ATOM 1732 N SER A 565 7.988 23.090 13.389 1.00 13.33 N ATOM 1733 CA SER A 565 7.086 23.946 12.618 1.00 24.84 C ATOM 1734 C SER A 565 6.515 23.270 11.361 1.00 20.67 C ATOM 1735 O SER A 565 5.296 23.188 11.191 1.00 17.85 O ATOM 1736 CB SER A 565 7.780 25.273 12.245 1.00 13.49 C ATOM 1737 OG SER A 565 8.861 25.075 11.356 1.00 30.99 O ATOM 1738 HG SER A 565 9.532 24.484 11.781 1.00 0.00 H ATOM 1739 H SER A 565 8.702 22.523 12.888 1.00 0.00 H ATOM 1740 N LEU A 566 7.400 22.864 10.452 1.00 11.98 N ATOM 1741 CA LEU A 566 7.002 22.495 9.084 1.00 23.68 C ATOM 1742 C LEU A 566 5.944 21.394 8.967 1.00 20.38 C ATOM 1743 O LEU A 566 5.075 21.463 8.102 1.00 19.49 O ATOM 1744 CB LEU A 566 8.228 22.077 8.280 1.00 12.23 C ATOM 1745 CG LEU A 566 9.329 23.129 8.160 1.00 24.41 C ATOM 1746 CD1 LEU A 566 10.467 22.591 7.303 1.00 13.74 C ATOM 1747 CD2 LEU A 566 8.773 24.444 7.591 1.00 16.43 C ATOM 1748 H LEU A 566 8.404 22.806 10.717 1.00 0.00 H ATOM 1749 N ALA A 567 6.009 20.386 9.827 1.00 22.57 N ATOM 1750 CA ALA A 567 5.044 19.290 9.759 1.00 23.59 C ATOM 1751 C ALA A 567 3.683 19.709 10.302 1.00 20.42 C ATOM 1752 O ALA A 567 2.723 18.948 10.224 1.00 16.34 O ATOM 1753 CB ALA A 567 5.560 18.078 10.516 1.00 23.13 C ATOM 1754 H ALA A 567 6.752 20.375 10.555 1.00 0.00 H ATOM 1755 N TRP A 568 3.617 20.907 10.881 1.00 15.49 N ATOM 1756 CA TRP A 568 2.385 21.414 11.484 1.00 15.50 C ATOM 1757 C TRP A 568 1.611 22.392 10.606 1.00 16.96 C ATOM 1758 O TRP A 568 0.564 22.893 11.017 1.00 14.41 O ATOM 1759 CB TRP A 568 2.693 22.079 12.824 1.00 17.74 C ATOM 1760 CG TRP A 568 3.370 21.168 13.791 1.00 22.01 C ATOM 1761 CD1 TRP A 568 4.710 21.079 14.039 1.00 21.17 C ATOM 1762 CD2 TRP A 568 2.738 20.213 14.649 1.00 18.34 C ATOM 1763 NE1 TRP A 568 4.949 20.128 15.000 1.00 22.17 N ATOM 1764 CE2 TRP A 568 3.754 19.582 15.391 1.00 18.16 C ATOM 1765 CE3 TRP A 568 1.409 19.837 14.868 1.00 21.62 C ATOM 1766 CZ2 TRP A 568 3.484 18.594 16.338 1.00 18.32 C ATOM 1767 CZ3 TRP A 568 1.143 18.853 15.803 1.00 18.82 C ATOM 1768 CH2 TRP A 568 2.177 18.240 16.523 1.00 14.49 C ATOM 1769 HE1 TRP A 568 5.884 19.865 15.371 1.00 0.00 H ATOM 1770 H TRP A 568 4.470 21.501 10.905 1.00 0.00 H ATOM 1771 N SER A 569 2.126 22.676 9.414 1.00 13.88 N ATOM 1772 CA SER A 569 1.439 23.574 8.493 1.00 20.14 C ATOM 1773 C SER A 569 0.068 23.007 8.155 1.00 25.93 C ATOM 1774 O SER A 569 -0.130 21.794 8.196 1.00 26.21 O ATOM 1775 CB SER A 569 2.252 23.779 7.213 1.00 22.85 C ATOM 1776 OG SER A 569 2.171 22.630 6.388 1.00 26.62 O ATOM 1777 HG SER A 569 1.225 22.464 6.147 1.00 0.00 H ATOM 1778 H SER A 569 3.033 22.251 9.134 1.00 0.00 H ATOM 1779 N HIS A 570 -0.876 23.885 7.833 1.00 19.76 N ATOM 1780 CA HIS A 570 -2.254 23.472 7.601 1.00 25.03 C ATOM 1781 C HIS A 570 -2.409 22.422 6.495 1.00 21.78 C ATOM 1782 O HIS A 570 -3.377 21.673 6.492 1.00 22.90 O ATOM 1783 CB HIS A 570 -3.118 24.691 7.267 1.00 26.88 C ATOM 1784 CG HIS A 570 -2.774 25.329 5.958 1.00 34.23 C ATOM 1785 ND1 HIS A 570 -1.931 26.416 5.858 1.00 35.04 N ATOM 1786 CD2 HIS A 570 -3.157 25.032 4.694 1.00 37.38 C ATOM 1787 CE1 HIS A 570 -1.811 26.761 4.588 1.00 38.63 C ATOM 1788 NE2 HIS A 570 -2.545 25.938 3.861 1.00 41.75 N ATOM 1789 H HIS A 570 -0.625 24.890 7.744 1.00 0.00 H ATOM 1790 N ASP A 571 -1.487 22.396 5.540 1.00 14.34 N ATOM 1791 CA ASP A 571 -1.568 21.433 4.442 1.00 26.99 C ATOM 1792 C ASP A 571 -0.688 20.185 4.647 1.00 20.46 C ATOM 1793 O ASP A 571 -0.509 19.387 3.732 1.00 26.25 O ATOM 1794 CB ASP A 571 -1.235 22.116 3.109 1.00 28.32 C ATOM 1795 CG ASP A 571 0.233 22.416 2.956 1.00 37.66 C ATOM 1796 OD1 ASP A 571 0.908 22.621 3.984 1.00 40.08 O ATOM 1797 OD2 ASP A 571 0.710 22.444 1.801 1.00 49.39 O ATOM 1798 H ASP A 571 -0.696 23.070 5.573 1.00 0.00 H ATOM 1799 N SER A 572 -0.095 20.054 5.827 1.00 17.83 N ATOM 1800 CA SER A 572 0.754 18.903 6.141 1.00 14.59 C ATOM 1801 C SER A 572 -0.009 17.577 6.191 1.00 16.01 C ATOM 1802 O SER A 572 -1.164 17.529 6.609 1.00 12.37 O ATOM 1803 CB SER A 572 1.453 19.122 7.479 1.00 19.45 C ATOM 1804 OG SER A 572 2.102 17.938 7.911 1.00 20.09 O ATOM 1805 HG SER A 572 2.547 18.105 8.779 1.00 0.00 H ATOM 1806 H SER A 572 -0.237 20.789 6.549 1.00 0.00 H ATOM 1807 N ALA A 573 0.658 16.499 5.798 1.00 13.24 N ATOM 1808 CA ALA A 573 0.064 15.163 5.834 1.00 16.63 C ATOM 1809 C ALA A 573 -0.199 14.685 7.274 1.00 17.43 C ATOM 1810 O ALA A 573 -0.933 13.721 7.496 1.00 14.40 O ATOM 1811 CB ALA A 573 0.961 14.169 5.097 1.00 13.21 C ATOM 1812 H ALA A 573 1.633 16.608 5.454 1.00 0.00 H ATOM 1813 N LEU A 574 0.399 15.362 8.246 1.00 14.25 N ATOM 1814 CA LEU A 574 0.117 15.072 9.648 1.00 13.41 C ATOM 1815 C LEU A 574 -1.381 15.070 9.946 1.00 16.52 C ATOM 1816 O LEU A 574 -1.892 14.145 10.584 1.00 21.05 O ATOM 1817 CB LEU A 574 0.799 16.088 10.548 1.00 13.42 C ATOM 1818 CG LEU A 574 0.314 16.047 11.996 1.00 14.60 C ATOM 1819 CD1 LEU A 574 0.696 14.729 12.666 1.00 12.20 C ATOM 1820 CD2 LEU A 574 0.890 17.228 12.744 1.00 18.06 C ATOM 1821 H LEU A 574 1.079 16.111 8.005 1.00 0.00 H ATOM 1822 N TRP A 575 -2.076 16.105 9.473 1.00 12.23 N ATOM 1823 CA TRP A 575 -3.506 16.254 9.734 1.00 15.06 C ATOM 1824 C TRP A 575 -4.319 15.107 9.131 1.00 15.32 C ATOM 1825 O TRP A 575 -5.290 14.654 9.728 1.00 18.11 O ATOM 1826 CB TRP A 575 -3.995 17.612 9.217 1.00 14.93 C ATOM 1827 CG TRP A 575 -3.229 18.730 9.848 1.00 14.14 C ATOM 1828 CD1 TRP A 575 -2.338 19.569 9.237 1.00 13.97 C ATOM 1829 CD2 TRP A 575 -3.238 19.092 11.233 1.00 20.05 C ATOM 1830 NE1 TRP A 575 -1.806 20.446 10.158 1.00 15.87 N ATOM 1831 CE2 TRP A 575 -2.344 20.174 11.391 1.00 26.38 C ATOM 1832 CE3 TRP A 575 -3.923 18.612 12.358 1.00 14.93 C ATOM 1833 CZ2 TRP A 575 -2.119 20.785 12.624 1.00 25.36 C ATOM 1834 CZ3 TRP A 575 -3.700 19.217 13.581 1.00 15.61 C ATOM 1835 CH2 TRP A 575 -2.804 20.294 13.704 1.00 27.15 C ATOM 1836 HE1 TRP A 575 -1.111 21.192 9.952 1.00 0.00 H ATOM 1837 H TRP A 575 -1.588 16.825 8.903 1.00 0.00 H ATOM 1838 N GLU A 576 -3.907 14.640 7.957 1.00 18.38 N ATOM 1839 CA GLU A 576 -4.516 13.477 7.323 1.00 19.76 C ATOM 1840 C GLU A 576 -4.401 12.244 8.207 1.00 21.42 C ATOM 1841 O GLU A 576 -5.368 11.496 8.392 1.00 17.91 O ATOM 1842 CB GLU A 576 -3.861 13.197 5.970 1.00 19.82 C ATOM 1843 CG GLU A 576 -4.018 14.324 4.955 1.00 22.34 C ATOM 1844 CD GLU A 576 -3.421 13.981 3.602 1.00 34.80 C ATOM 1845 OE1 GLU A 576 -3.825 12.954 3.010 1.00 36.46 O ATOM 1846 OE2 GLU A 576 -2.544 14.739 3.131 1.00 41.13 O ATOM 1847 H GLU A 576 -3.122 15.121 7.473 1.00 0.00 H ATOM 1848 N ALA A 577 -3.201 12.042 8.740 1.00 12.00 N ATOM 1849 CA ALA A 577 -2.899 10.900 9.595 1.00 18.36 C ATOM 1850 C ALA A 577 -3.695 10.950 10.893 1.00 21.40 C ATOM 1851 O ALA A 577 -4.195 9.926 11.363 1.00 20.57 O ATOM 1852 CB ALA A 577 -1.400 10.849 9.893 1.00 18.74 C ATOM 1853 H ALA A 577 -2.445 12.727 8.539 1.00 0.00 H ATOM 1854 N LEU A 578 -3.809 12.142 11.472 1.00 12.94 N ATOM 1855 CA LEU A 578 -4.596 12.310 12.692 1.00 24.88 C ATOM 1856 C LEU A 578 -6.062 12.052 12.381 1.00 20.23 C ATOM 1857 O LEU A 578 -6.792 11.477 13.193 1.00 16.81 O ATOM 1858 CB LEU A 578 -4.411 13.713 13.290 1.00 15.31 C ATOM 1859 CG LEU A 578 -3.176 13.903 14.185 1.00 23.10 C ATOM 1860 CD1 LEU A 578 -3.028 15.350 14.669 1.00 18.57 C ATOM 1861 CD2 LEU A 578 -3.236 12.957 15.370 1.00 26.33 C ATOM 1862 H LEU A 578 -3.332 12.965 11.051 1.00 0.00 H ATOM 1863 N GLN A 579 -6.476 12.475 11.190 1.00 14.32 N ATOM 1864 CA GLN A 579 -7.866 12.358 10.761 1.00 14.16 C ATOM 1865 C GLN A 579 -8.330 10.900 10.700 1.00 14.54 C ATOM 1866 O GLN A 579 -9.395 10.564 11.214 1.00 16.93 O ATOM 1867 CB GLN A 579 -8.042 13.033 9.398 1.00 14.72 C ATOM 1868 CG GLN A 579 -9.467 13.092 8.872 1.00 18.38 C ATOM 1869 CD GLN A 579 -9.534 13.741 7.506 1.00 19.75 C ATOM 1870 OE1 GLN A 579 -9.219 14.920 7.345 1.00 29.14 O ATOM 1871 NE2 GLN A 579 -9.914 12.966 6.507 1.00 14.20 N ATOM 1872 HE22 GLN A 579 -10.172 11.975 6.687 1.00 0.00 H ATOM 1873 HE21 GLN A 579 -9.955 13.347 5.540 1.00 0.00 H ATOM 1874 H GLN A 579 -5.785 12.904 10.542 1.00 0.00 H ATOM 1875 N VAL A 580 -7.534 10.023 10.091 1.00 18.94 N ATOM 1876 CA VAL A 580 -7.959 8.629 9.973 1.00 18.56 C ATOM 1877 C VAL A 580 -7.846 7.927 11.330 1.00 21.55 C ATOM 1878 O VAL A 580 -8.375 6.835 11.531 1.00 24.54 O ATOM 1879 CB VAL A 580 -7.145 7.867 8.902 1.00 22.15 C ATOM 1880 CG1 VAL A 580 -7.140 8.648 7.583 1.00 14.45 C ATOM 1881 CG2 VAL A 580 -5.726 7.592 9.386 1.00 25.86 C ATOM 1882 H VAL A 580 -6.618 10.327 9.703 1.00 0.00 H ATOM 1883 N SER A 581 -7.158 8.581 12.259 1.00 24.81 N ATOM 1884 CA SER A 581 -7.048 8.130 13.644 1.00 25.09 C ATOM 1885 C SER A 581 -8.110 8.771 14.539 1.00 24.23 C ATOM 1886 O SER A 581 -7.991 8.743 15.764 1.00 24.44 O ATOM 1887 CB SER A 581 -5.648 8.399 14.189 1.00 31.23 C ATOM 1888 OG SER A 581 -4.729 7.453 13.668 1.00 38.85 O ATOM 1889 HG SER A 581 -4.711 7.521 12.681 1.00 0.00 H ATOM 1890 H SER A 581 -6.673 9.459 11.986 1.00 0.00 H ATOM 1891 N ALA A 582 -9.088 9.424 13.915 1.00 27.53 N ATOM 1892 CA ALA A 582 -10.196 10.068 14.623 1.00 22.84 C ATOM 1893 C ALA A 582 -9.690 11.222 15.465 1.00 22.32 C ATOM 1894 O ALA A 582 -10.214 11.487 16.543 1.00 29.27 O ATOM 1895 CB ALA A 582 -10.952 9.062 15.495 1.00 23.69 C ATOM 1896 H ALA A 582 -9.064 9.479 12.877 1.00 0.00 H ATOM 1897 N ASN A 583 -8.647 11.883 14.967 1.00 23.73 N ATOM 1898 CA ASN A 583 -8.037 13.030 15.632 1.00 28.49 C ATOM 1899 C ASN A 583 -7.645 12.739 17.070 1.00 35.34 C ATOM 1900 O ASN A 583 -7.646 13.626 17.924 1.00 41.54 O ATOM 1901 CB ASN A 583 -8.976 14.232 15.562 1.00 25.04 C ATOM 1902 CG ASN A 583 -9.115 14.762 14.155 1.00 25.76 C ATOM 1903 OD1 ASN A 583 -8.193 14.642 13.345 1.00 31.97 O ATOM 1904 ND2 ASN A 583 -10.268 15.338 13.847 1.00 22.35 N ATOM 1905 HD22 ASN A 583 -11.018 15.417 14.564 1.00 0.00 H ATOM 1906 HD21 ASN A 583 -10.423 15.711 12.889 1.00 0.00 H ATOM 1907 H ASN A 583 -8.248 11.567 14.060 1.00 0.00 H ATOM 1908 N LYS A 584 -7.280 11.489 17.320 1.00 30.04 N ATOM 1909 CA LYS A 584 -6.781 11.100 18.622 1.00 25.23 C ATOM 1910 C LYS A 584 -5.270 11.276 18.622 1.00 28.62 C ATOM 1911 O LYS A 584 -4.546 10.559 17.934 1.00 36.33 O ATOM 1912 CB LYS A 584 -7.160 9.652 18.945 1.00 28.60 C ATOM 1913 CG LYS A 584 -6.837 9.236 20.371 1.00 39.51 C ATOM 1914 CD LYS A 584 -7.094 7.751 20.599 1.00 51.96 C ATOM 1915 CE LYS A 584 -6.129 6.884 19.798 1.00 61.49 C ATOM 1916 NZ LYS A 584 -4.702 7.143 20.155 1.00 65.86 N ATOM 1917 HZ1 LYS A 584 -4.474 8.140 19.965 1.00 0.00 H ATOM 1918 HZ2 LYS A 584 -4.556 6.939 21.164 1.00 0.00 H ATOM 1919 HZ3 LYS A 584 -4.086 6.530 19.584 1.00 0.00 H ATOM 1920 H LYS A 584 -7.354 10.775 16.567 1.00 0.00 H ATOM 1921 N VAL A 585 -4.804 12.248 19.391 1.00 29.01 N ATOM 1922 CA VAL A 585 -3.380 12.534 19.496 1.00 27.18 C ATOM 1923 C VAL A 585 -2.746 11.645 20.559 1.00 31.70 C ATOM 1924 O VAL A 585 -3.218 11.595 21.693 1.00 29.74 O ATOM 1925 CB VAL A 585 -3.138 14.015 19.839 1.00 24.57 C ATOM 1926 CG1 VAL A 585 -1.654 14.303 19.972 1.00 24.19 C ATOM 1927 CG2 VAL A 585 -3.785 14.914 18.783 1.00 22.84 C ATOM 1928 H VAL A 585 -5.476 12.825 19.937 1.00 0.00 H ATOM 1929 N PRO A 586 -1.675 10.928 20.196 1.00 36.27 N ATOM 1930 CA PRO A 586 -1.046 10.053 21.189 1.00 28.66 C ATOM 1931 C PRO A 586 -0.409 10.843 22.333 1.00 31.90 C ATOM 1932 O PRO A 586 0.265 11.844 22.094 1.00 27.01 O ATOM 1933 CB PRO A 586 0.009 9.301 20.375 1.00 33.10 C ATOM 1934 CG PRO A 586 0.286 10.162 19.205 1.00 31.36 C ATOM 1935 CD PRO A 586 -0.997 10.871 18.889 1.00 36.42 C ATOM 1936 N THR A 587 -0.651 10.407 23.566 1.00 34.23 N ATOM 1937 CA THR A 587 -0.042 11.036 24.733 1.00 32.73 C ATOM 1938 C THR A 587 1.427 10.628 24.809 1.00 29.83 C ATOM 1939 O THR A 587 1.830 9.642 24.197 1.00 33.98 O ATOM 1940 CB THR A 587 -0.763 10.650 26.041 1.00 33.16 C ATOM 1941 OG1 THR A 587 -0.375 9.330 26.435 1.00 34.21 O ATOM 1942 CG2 THR A 587 -2.268 10.693 25.858 1.00 31.79 C ATOM 1943 HG1 THR A 587 -0.840 9.087 27.274 1.00 0.00 H ATOM 1944 H THR A 587 -1.290 9.598 23.702 1.00 0.00 H ATOM 1945 N CYS A 588 2.228 11.391 25.546 1.00 30.08 N ATOM 1946 CA CYS A 588 3.655 11.100 25.660 1.00 37.86 C ATOM 1947 C CYS A 588 3.904 9.692 26.199 1.00 36.02 C ATOM 1948 O CYS A 588 4.732 8.952 25.667 1.00 36.52 O ATOM 1949 CB CYS A 588 4.343 12.137 26.547 1.00 31.30 C ATOM 1950 SG CYS A 588 6.126 11.878 26.736 1.00 43.36 S ATOM 1951 H CYS A 588 1.832 12.210 26.050 1.00 0.00 H ATOM 1952 N GLU A 589 3.170 9.328 27.244 1.00 34.88 N ATOM 1953 CA GLU A 589 3.296 8.017 27.862 1.00 38.89 C ATOM 1954 C GLU A 589 3.046 6.897 26.853 1.00 37.00 C ATOM 1955 O GLU A 589 3.710 5.862 26.878 1.00 39.67 O ATOM 1956 CB GLU A 589 2.326 7.899 29.040 1.00 48.06 C ATOM 1957 CG GLU A 589 2.673 6.804 30.029 1.00 63.95 C ATOM 1958 CD GLU A 589 1.768 6.818 31.249 1.00 77.51 C ATOM 1959 OE1 GLU A 589 0.755 6.085 31.250 1.00 82.40 O ATOM 1960 OE2 GLU A 589 2.070 7.565 32.206 1.00 78.13 O ATOM 1961 H GLU A 589 2.482 10.003 27.634 1.00 0.00 H ATOM 1962 N GLU A 590 2.095 7.119 25.955 1.00 34.31 N ATOM 1963 CA GLU A 590 1.755 6.127 24.945 1.00 44.07 C ATOM 1964 C GLU A 590 2.904 5.851 23.972 1.00 51.08 C ATOM 1965 O GLU A 590 3.178 4.694 23.656 1.00 51.72 O ATOM 1966 CB GLU A 590 0.505 6.567 24.180 1.00 39.05 C ATOM 1967 CG GLU A 590 -0.766 6.438 25.005 1.00 48.88 C ATOM 1968 CD GLU A 590 -1.969 7.090 24.357 1.00 50.37 C ATOM 1969 OE1 GLU A 590 -1.792 8.100 23.651 1.00 52.65 O ATOM 1970 OE2 GLU A 590 -3.097 6.594 24.562 1.00 54.66 O ATOM 1971 H GLU A 590 1.580 8.023 25.973 1.00 0.00 H ATOM 1972 N VAL A 591 3.570 6.898 23.488 1.00 33.85 N ATOM 1973 CA VAL A 591 4.637 6.699 22.507 1.00 34.42 C ATOM 1974 C VAL A 591 6.073 6.590 23.048 1.00 35.85 C ATOM 1975 O VAL A 591 6.964 6.173 22.311 1.00 45.97 O ATOM 1976 CB VAL A 591 4.624 7.832 21.449 1.00 32.89 C ATOM 1977 CG1 VAL A 591 3.293 7.848 20.711 1.00 31.70 C ATOM 1978 CG2 VAL A 591 4.896 9.179 22.098 1.00 31.98 C ATOM 1979 H VAL A 591 3.331 7.858 23.808 1.00 0.00 H ATOM 1980 N ILE A 592 6.320 6.926 24.313 1.00 41.41 N ATOM 1981 CA ILE A 592 7.699 6.838 24.814 1.00 41.98 C ATOM 1982 C ILE A 592 7.963 5.491 25.464 1.00 46.39 C ATOM 1983 O ILE A 592 9.035 5.255 26.014 1.00 48.32 O ATOM 1984 CB ILE A 592 8.055 7.952 25.827 1.00 42.53 C ATOM 1985 CG1 ILE A 592 7.268 7.791 27.131 1.00 46.53 C ATOM 1986 CG2 ILE A 592 7.878 9.321 25.196 1.00 45.60 C ATOM 1987 CD1 ILE A 592 7.712 8.727 28.240 1.00 41.41 C ATOM 1988 H ILE A 592 5.550 7.245 24.935 1.00 0.00 H ATOM 1989 N PHE A 593 6.973 4.611 25.407 1.00 52.34 N ATOM 1990 CA PHE A 593 7.164 3.240 25.843 1.00 56.29 C ATOM 1991 C PHE A 593 6.744 2.296 24.724 1.00 57.73 C ATOM 1992 O PHE A 593 5.776 2.558 24.008 1.00 55.79 O ATOM 1993 CB PHE A 593 6.385 2.966 27.133 1.00 57.20 C ATOM 1994 CG PHE A 593 6.826 3.819 28.289 1.00 53.22 C ATOM 1995 CD1 PHE A 593 8.077 3.640 28.861 1.00 49.71 C ATOM 1996 CD2 PHE A 593 5.999 4.807 28.797 1.00 50.36 C ATOM 1997 CE1 PHE A 593 8.492 4.431 29.915 1.00 44.78 C ATOM 1998 CE2 PHE A 593 6.409 5.599 29.857 1.00 48.17 C ATOM 1999 CZ PHE A 593 7.656 5.412 30.414 1.00 43.31 C ATOM 2000 H PHE A 593 6.045 4.908 25.044 1.00 0.00 H ATOM 2001 N PRO A 594 7.497 1.214 24.568 1.00 62.20 N ATOM 2002 CA PRO A 594 7.258 0.247 23.504 1.00 64.06 C ATOM 2003 C PRO A 594 5.905 -0.439 23.658 1.00 63.32 C ATOM 2004 O PRO A 594 5.058 -0.366 22.766 1.00 65.32 O ATOM 2005 CB PRO A 594 8.390 -0.767 23.691 1.00 20.00 C ATOM 2006 CG PRO A 594 8.680 -0.745 25.151 1.00 20.00 C ATOM 2007 CD PRO A 594 7.729 0.254 25.731 1.00 20.00 C TER 2008 PRO A 594 ATOM 2009 N ASN A 780 -5.576 -5.109 13.166 1.00 66.98 N ATOM 2010 CA ASN A 780 -5.983 -4.184 12.107 1.00 58.33 C ATOM 2011 C ASN A 780 -5.978 -2.683 12.458 1.00 58.15 C ATOM 2012 O ASN A 780 -7.038 -2.076 12.577 1.00 57.37 O ATOM 2013 CB ASN A 780 -7.387 -4.591 11.636 1.00 53.49 C ATOM 2014 CG ASN A 780 -7.772 -3.965 10.319 1.00 50.95 C ATOM 2015 OD1 ASN A 780 -6.944 -3.356 9.644 1.00 50.42 O ATOM 2016 ND2 ASN A 780 -9.033 -4.124 9.936 1.00 54.29 N ATOM 2017 HD22 ASN A 780 -9.698 -4.647 10.541 1.00 0.00 H ATOM 2018 HD21 ASN A 780 -9.356 -3.725 9.031 1.00 0.00 H ATOM 2019 HN3 ASN A 780 -6.216 -5.007 13.979 1.00 0.00 H ATOM 2020 HN2 ASN A 780 -4.603 -4.891 13.460 1.00 0.00 H ATOM 2021 HN1 ASN A 780 -5.621 -6.085 12.809 1.00 0.00 H ATOM 2022 N ARG A 781 -4.786 -2.095 12.605 1.00 60.19 N ATOM 2023 CA ARG A 781 -4.606 -0.674 12.981 1.00 54.17 C ATOM 2024 C ARG A 781 -4.988 0.307 11.872 1.00 45.96 C ATOM 2025 O ARG A 781 -4.881 -0.029 10.695 1.00 47.77 O ATOM 2026 CB ARG A 781 -3.144 -0.387 13.357 1.00 51.18 C ATOM 2027 CG ARG A 781 -2.280 -1.621 13.560 1.00 60.00 C ATOM 2028 CD ARG A 781 -2.631 -2.375 14.846 1.00 65.99 C ATOM 2029 NE ARG A 781 -1.956 -3.665 14.913 1.00 74.20 N ATOM 2030 CZ ARG A 781 -2.452 -4.735 15.532 1.00 78.48 C ATOM 2031 NH1 ARG A 781 -3.616 -4.663 16.170 1.00 78.34 N ATOM 2032 NH2 ARG A 781 -1.774 -5.877 15.539 1.00 82.88 N ATOM 2033 HE ARG A 781 -1.030 -3.756 14.449 1.00 0.00 H ATOM 2034 HH12 ARG A 781 -3.998 -5.502 16.651 1.00 0.00 H ATOM 2035 HH11 ARG A 781 -4.145 -3.768 16.188 1.00 0.00 H ATOM 2036 HH22 ARG A 781 -2.164 -6.710 16.023 1.00 0.00 H ATOM 2037 HH21 ARG A 781 -0.853 -5.938 15.060 1.00 0.00 H ATOM 2038 H ARG A 781 -3.934 -2.670 12.446 1.00 0.00 H ATOM 2039 N PRO A 782 -5.398 1.539 12.241 1.00 41.57 N ATOM 2040 CA PRO A 782 -5.504 2.608 11.234 1.00 32.24 C ATOM 2041 C PRO A 782 -4.151 2.841 10.567 1.00 39.73 C ATOM 2042 O PRO A 782 -3.139 2.730 11.260 1.00 40.81 O ATOM 2043 CB PRO A 782 -5.918 3.839 12.053 1.00 30.25 C ATOM 2044 CG PRO A 782 -6.511 3.288 13.317 1.00 37.89 C ATOM 2045 CD PRO A 782 -5.768 2.007 13.590 1.00 39.47 C ATOM 2046 N LYS A 783 -4.103 3.139 9.270 1.00 33.18 N ATOM 2047 CA LYS A 783 -2.799 3.419 8.674 1.00 47.65 C ATOM 2048 C LYS A 783 -2.268 4.740 9.236 1.00 42.85 C ATOM 2049 O LYS A 783 -3.055 5.603 9.640 1.00 30.94 O ATOM 2050 CB LYS A 783 -2.849 3.461 7.140 1.00 47.45 C ATOM 2051 CG LYS A 783 -1.466 3.753 6.549 1.00 56.05 C ATOM 2052 CD LYS A 783 -1.347 3.659 5.044 1.00 56.96 C ATOM 2053 CE LYS A 783 0.044 3.125 4.689 1.00 66.22 C ATOM 2054 NZ LYS A 783 0.574 3.636 3.390 1.00 67.62 N ATOM 2055 HZ1 LYS A 783 -0.069 3.358 2.621 1.00 0.00 H ATOM 2056 HZ2 LYS A 783 0.642 4.673 3.429 1.00 0.00 H ATOM 2057 HZ3 LYS A 783 1.517 3.232 3.219 1.00 0.00 H ATOM 2058 H LYS A 783 -4.970 3.172 8.697 1.00 0.00 H ATOM 2059 N ARG A 784 -0.936 4.851 9.288 1.00 43.82 N ATOM 2060 CA ARG A 784 -0.194 6.010 9.797 1.00 49.25 C ATOM 2061 C ARG A 784 -0.124 5.991 11.320 1.00 49.06 C ATOM 2062 O ARG A 784 0.458 6.891 11.925 1.00 48.39 O ATOM 2063 CB ARG A 784 -0.789 7.336 9.302 1.00 49.17 C ATOM 2064 CG ARG A 784 -0.826 7.460 7.791 1.00 51.78 C ATOM 2065 CD ARG A 784 0.566 7.304 7.195 1.00 56.55 C ATOM 2066 NE ARG A 784 0.522 6.974 5.774 1.00 59.59 N ATOM 2067 CZ ARG A 784 1.595 6.884 4.996 1.00 70.01 C ATOM 2068 NH1 ARG A 784 2.801 7.105 5.503 1.00 77.37 N ATOM 2069 NH2 ARG A 784 1.465 6.577 3.712 1.00 71.96 N ATOM 2070 HE ARG A 784 -0.408 6.798 5.343 1.00 0.00 H ATOM 2071 HH12 ARG A 784 3.642 7.035 4.895 1.00 0.00 H ATOM 2072 HH11 ARG A 784 2.906 7.348 6.509 1.00 0.00 H ATOM 2073 HH22 ARG A 784 2.307 6.507 3.106 1.00 0.00 H ATOM 2074 HH21 ARG A 784 0.521 6.406 3.311 1.00 0.00 H ATOM 2075 H ARG A 784 -0.378 4.046 8.937 1.00 0.00 H ATOM 2076 N THR A 785 -0.742 4.982 11.931 1.00 40.23 N ATOM 2077 CA THR A 785 -0.626 4.756 13.372 1.00 43.69 C ATOM 2078 C THR A 785 0.838 4.739 13.803 1.00 41.11 C ATOM 2079 O THR A 785 1.238 5.479 14.701 1.00 36.02 O ATOM 2080 CB THR A 785 -1.284 3.427 13.792 1.00 44.86 C ATOM 2081 OG1 THR A 785 -2.706 3.529 13.648 1.00 47.93 O ATOM 2082 CG2 THR A 785 -0.950 3.094 15.239 1.00 43.64 C ATOM 2083 HG1 THR A 785 -2.928 3.723 12.703 1.00 0.00 H ATOM 2084 H THR A 785 -1.326 4.333 11.366 1.00 0.00 H ATOM 2085 N GLY A 786 1.627 3.891 13.148 1.00 38.85 N ATOM 2086 CA GLY A 786 3.061 3.842 13.366 1.00 39.24 C ATOM 2087 C GLY A 786 3.731 5.172 13.064 1.00 33.23 C ATOM 2088 O GLY A 786 4.590 5.620 13.815 1.00 34.34 O ATOM 2089 H GLY A 786 1.202 3.241 12.456 1.00 0.00 H ATOM 2090 N SER A 787 3.331 5.808 11.966 1.00 31.95 N ATOM 2091 CA SER A 787 3.844 7.132 11.620 1.00 29.01 C ATOM 2092 C SER A 787 3.478 8.183 12.669 1.00 24.76 C ATOM 2093 O SER A 787 4.296 9.031 13.015 1.00 30.86 O ATOM 2094 CB SER A 787 3.323 7.569 10.250 1.00 32.05 C ATOM 2095 OG SER A 787 4.080 6.975 9.212 1.00 36.93 O ATOM 2096 HG SER A 787 3.726 7.271 8.336 1.00 0.00 H ATOM 2097 H SER A 787 2.637 5.352 11.339 1.00 0.00 H ATOM 2098 N LEU A 788 2.245 8.127 13.164 1.00 24.96 N ATOM 2099 CA LEU A 788 1.805 9.032 14.216 1.00 23.67 C ATOM 2100 C LEU A 788 2.631 8.838 15.475 1.00 25.03 C ATOM 2101 O LEU A 788 3.096 9.812 16.072 1.00 25.30 O ATOM 2102 CB LEU A 788 0.326 8.825 14.536 1.00 27.60 C ATOM 2103 CG LEU A 788 -0.691 9.648 13.751 1.00 31.09 C ATOM 2104 CD1 LEU A 788 -2.077 9.405 14.316 1.00 32.11 C ATOM 2105 CD2 LEU A 788 -0.334 11.133 13.795 1.00 28.70 C ATOM 2106 H LEU A 788 1.580 7.420 12.791 1.00 0.00 H ATOM 2107 N ALA A 789 2.810 7.577 15.867 1.00 20.65 N ATOM 2108 CA ALA A 789 3.553 7.234 17.080 1.00 26.13 C ATOM 2109 C ALA A 789 5.002 7.708 17.025 1.00 24.93 C ATOM 2110 O ALA A 789 5.501 8.286 17.990 1.00 30.79 O ATOM 2111 CB ALA A 789 3.507 5.724 17.332 1.00 17.86 C ATOM 2112 H ALA A 789 2.408 6.810 15.291 1.00 0.00 H ATOM 2113 N LEU A 790 5.675 7.460 15.904 1.00 20.18 N ATOM 2114 CA LEU A 790 7.066 7.881 15.746 1.00 24.53 C ATOM 2115 C LEU A 790 7.204 9.402 15.732 1.00 18.87 C ATOM 2116 O LEU A 790 8.075 9.952 16.400 1.00 23.72 O ATOM 2117 CB LEU A 790 7.682 7.303 14.467 1.00 25.92 C ATOM 2118 CG LEU A 790 9.098 7.827 14.155 1.00 34.05 C ATOM 2119 CD1 LEU A 790 10.088 7.512 15.279 1.00 24.55 C ATOM 2120 CD2 LEU A 790 9.627 7.306 12.826 1.00 33.85 C ATOM 2121 H LEU A 790 5.203 6.957 15.126 1.00 0.00 H ATOM 2122 N PHE A 791 6.353 10.075 14.963 1.00 18.43 N ATOM 2123 CA PHE A 791 6.426 11.530 14.855 1.00 13.80 C ATOM 2124 C PHE A 791 6.273 12.178 16.231 1.00 14.28 C ATOM 2125 O PHE A 791 7.100 12.994 16.635 1.00 14.50 O ATOM 2126 CB PHE A 791 5.363 12.051 13.891 1.00 13.05 C ATOM 2127 CG PHE A 791 5.261 13.548 13.855 1.00 22.03 C ATOM 2128 CD1 PHE A 791 6.189 14.300 13.161 1.00 18.66 C ATOM 2129 CD2 PHE A 791 4.229 14.201 14.507 1.00 16.11 C ATOM 2130 CE1 PHE A 791 6.097 15.677 13.135 1.00 15.86 C ATOM 2131 CE2 PHE A 791 4.135 15.573 14.481 1.00 13.38 C ATOM 2132 CZ PHE A 791 5.072 16.310 13.798 1.00 14.91 C ATOM 2133 H PHE A 791 5.625 9.558 14.431 1.00 0.00 H ATOM 2134 N TYR A 792 5.241 11.777 16.964 1.00 14.63 N ATOM 2135 CA TYR A 792 4.975 12.367 18.272 1.00 27.44 C ATOM 2136 C TYR A 792 6.016 11.968 19.313 1.00 26.34 C ATOM 2137 O TYR A 792 6.301 12.735 20.233 1.00 26.77 O ATOM 2138 CB TYR A 792 3.572 11.994 18.751 1.00 23.63 C ATOM 2139 CG TYR A 792 2.528 12.972 18.279 1.00 26.63 C ATOM 2140 CD1 TYR A 792 2.331 14.173 18.948 1.00 25.27 C ATOM 2141 CD2 TYR A 792 1.749 12.707 17.158 1.00 22.39 C ATOM 2142 CE1 TYR A 792 1.385 15.081 18.522 1.00 24.21 C ATOM 2143 CE2 TYR A 792 0.794 13.614 16.726 1.00 21.27 C ATOM 2144 CZ TYR A 792 0.617 14.798 17.415 1.00 24.32 C ATOM 2145 OH TYR A 792 -0.325 15.708 17.001 1.00 22.23 O ATOM 2146 HH TYR A 792 -0.314 16.491 17.607 1.00 0.00 H ATOM 2147 H TYR A 792 4.613 11.032 16.601 1.00 0.00 H ATOM 2148 N ARG A 793 6.586 10.776 19.168 1.00 22.87 N ATOM 2149 CA ARG A 793 7.720 10.393 20.002 1.00 31.67 C ATOM 2150 C ARG A 793 8.875 11.375 19.808 1.00 17.70 C ATOM 2151 O ARG A 793 9.511 11.799 20.771 1.00 23.23 O ATOM 2152 CB ARG A 793 8.184 8.967 19.689 1.00 34.87 C ATOM 2153 CG ARG A 793 9.269 8.462 20.630 1.00 40.95 C ATOM 2154 CD ARG A 793 9.811 7.106 20.207 1.00 45.48 C ATOM 2155 NE ARG A 793 10.633 7.199 19.004 1.00 55.88 N ATOM 2156 CZ ARG A 793 11.931 7.487 19.004 1.00 62.49 C ATOM 2157 NH1 ARG A 793 12.562 7.715 20.148 1.00 67.77 N ATOM 2158 NH2 ARG A 793 12.600 7.550 17.859 1.00 60.80 N ATOM 2159 HE ARG A 793 10.173 7.029 18.087 1.00 0.00 H ATOM 2160 HH12 ARG A 793 13.577 7.940 20.146 1.00 0.00 H ATOM 2161 HH11 ARG A 793 12.041 7.669 21.047 1.00 0.00 H ATOM 2162 HH22 ARG A 793 13.615 7.775 17.862 1.00 0.00 H ATOM 2163 HH21 ARG A 793 12.109 7.374 16.959 1.00 0.00 H ATOM 2164 H ARG A 793 6.221 10.112 18.455 1.00 0.00 H ATOM 2165 N LYS A 794 9.139 11.738 18.558 1.00 18.19 N ATOM 2166 CA LYS A 794 10.205 12.691 18.250 1.00 23.93 C ATOM 2167 C LYS A 794 9.861 14.084 18.770 1.00 18.11 C ATOM 2168 O LYS A 794 10.729 14.805 19.266 1.00 23.70 O ATOM 2169 CB LYS A 794 10.464 12.743 16.743 1.00 24.91 C ATOM 2170 CG LYS A 794 10.941 11.436 16.155 1.00 32.30 C ATOM 2171 CD LYS A 794 12.317 11.075 16.664 1.00 42.52 C ATOM 2172 CE LYS A 794 13.378 11.408 15.632 1.00 51.64 C ATOM 2173 NZ LYS A 794 13.108 10.703 14.348 1.00 58.59 N ATOM 2174 HZ1 LYS A 794 13.109 9.676 14.511 1.00 0.00 H ATOM 2175 HZ2 LYS A 794 12.180 10.996 13.982 1.00 0.00 H ATOM 2176 HZ3 LYS A 794 13.847 10.947 13.658 1.00 0.00 H ATOM 2177 H LYS A 794 8.576 11.336 17.782 1.00 0.00 H ATOM 2178 N VAL A 795 8.589 14.450 18.648 1.00 15.95 N ATOM 2179 CA VAL A 795 8.098 15.746 19.108 1.00 15.93 C ATOM 2180 C VAL A 795 8.200 15.860 20.623 1.00 25.32 C ATOM 2181 O VAL A 795 8.736 16.840 21.146 1.00 21.07 O ATOM 2182 CB VAL A 795 6.634 15.979 18.674 1.00 18.28 C ATOM 2183 CG1 VAL A 795 6.037 17.190 19.388 1.00 15.51 C ATOM 2184 CG2 VAL A 795 6.553 16.151 17.166 1.00 18.07 C ATOM 2185 H VAL A 795 7.918 13.788 18.208 1.00 0.00 H ATOM 2186 N TYR A 796 7.690 14.850 21.322 1.00 17.56 N ATOM 2187 CA TYR A 796 7.756 14.822 22.778 1.00 26.95 C ATOM 2188 C TYR A 796 9.203 14.815 23.257 1.00 27.90 C ATOM 2189 O TYR A 796 9.538 15.483 24.236 1.00 33.00 O ATOM 2190 CB TYR A 796 7.007 13.608 23.330 1.00 24.04 C ATOM 2191 CG TYR A 796 5.500 13.768 23.333 1.00 22.71 C ATOM 2192 CD1 TYR A 796 4.909 14.913 23.847 1.00 29.35 C ATOM 2193 CD2 TYR A 796 4.670 12.776 22.824 1.00 18.73 C ATOM 2194 CE1 TYR A 796 3.530 15.067 23.858 1.00 29.53 C ATOM 2195 CE2 TYR A 796 3.290 12.921 22.829 1.00 18.62 C ATOM 2196 CZ TYR A 796 2.730 14.070 23.350 1.00 27.41 C ATOM 2197 OH TYR A 796 1.367 14.229 23.369 1.00 31.28 O ATOM 2198 HH TYR A 796 1.019 14.194 22.443 1.00 0.00 H ATOM 2199 H TYR A 796 7.234 14.063 20.819 1.00 0.00 H ATOM 2200 N HIS A 797 10.058 14.068 22.560 1.00 22.91 N ATOM 2201 CA HIS A 797 11.475 14.009 22.912 1.00 24.87 C ATOM 2202 C HIS A 797 12.158 15.358 22.731 1.00 26.82 C ATOM 2203 O HIS A 797 12.956 15.774 23.569 1.00 27.72 O ATOM 2204 CB HIS A 797 12.207 12.951 22.077 1.00 30.90 C ATOM 2205 CG HIS A 797 13.683 12.899 22.330 1.00 42.82 C ATOM 2206 ND1 HIS A 797 14.227 12.299 23.446 1.00 50.02 N ATOM 2207 CD2 HIS A 797 14.729 13.384 21.618 1.00 47.96 C ATOM 2208 CE1 HIS A 797 15.543 12.411 23.408 1.00 45.54 C ATOM 2209 NE2 HIS A 797 15.874 13.064 22.308 1.00 47.10 N ATOM 2210 H HIS A 797 9.710 13.516 21.750 1.00 0.00 H ATOM 2211 N LEU A 798 11.847 16.031 21.626 1.00 23.68 N ATOM 2212 CA LEU A 798 12.453 17.321 21.318 1.00 25.75 C ATOM 2213 C LEU A 798 12.018 18.389 22.316 1.00 28.76 C ATOM 2214 O LEU A 798 12.836 19.166 22.814 1.00 26.55 O ATOM 2215 CB LEU A 798 12.087 17.761 19.901 1.00 27.76 C ATOM 2216 CG LEU A 798 12.624 19.125 19.460 1.00 23.70 C ATOM 2217 CD1 LEU A 798 14.145 19.112 19.433 1.00 24.61 C ATOM 2218 CD2 LEU A 798 12.062 19.512 18.106 1.00 23.18 C ATOM 2219 H LEU A 798 11.154 15.626 20.965 1.00 0.00 H ATOM 2220 N ALA A 799 10.723 18.420 22.600 1.00 22.41 N ATOM 2221 CA ALA A 799 10.162 19.428 23.486 1.00 26.44 C ATOM 2222 C ALA A 799 10.659 19.244 24.917 1.00 21.98 C ATOM 2223 O ALA A 799 10.814 20.215 25.654 1.00 27.67 O ATOM 2224 CB ALA A 799 8.634 19.387 23.435 1.00 23.81 C ATOM 2225 H ALA A 799 10.094 17.707 22.179 1.00 0.00 H ATOM 2226 N SER A 800 10.918 17.999 25.305 1.00 22.46 N ATOM 2227 CA SER A 800 11.391 17.718 26.656 1.00 31.29 C ATOM 2228 C SER A 800 12.814 18.232 26.844 1.00 28.86 C ATOM 2229 O SER A 800 13.161 18.736 27.910 1.00 30.14 O ATOM 2230 CB SER A 800 11.323 16.219 26.961 1.00 29.72 C ATOM 2231 OG SER A 800 12.168 15.482 26.099 1.00 38.98 O ATOM 2232 HG SER A 800 11.887 15.627 25.161 1.00 0.00 H ATOM 2233 H SER A 800 10.781 17.215 24.636 1.00 0.00 H ATOM 2234 N VAL A 801 13.628 18.107 25.800 1.00 29.86 N ATOM 2235 CA VAL A 801 15.004 18.588 25.832 1.00 25.98 C ATOM 2236 C VAL A 801 15.022 20.107 25.951 1.00 26.78 C ATOM 2237 O VAL A 801 15.790 20.675 26.732 1.00 30.02 O ATOM 2238 CB VAL A 801 15.785 18.146 24.579 1.00 34.05 C ATOM 2239 CG1 VAL A 801 17.147 18.828 24.520 1.00 36.83 C ATOM 2240 CG2 VAL A 801 15.944 16.628 24.567 1.00 33.75 C ATOM 2241 H VAL A 801 13.272 17.653 24.935 1.00 0.00 H ATOM 2242 N ARG A 802 14.151 20.758 25.190 1.00 25.60 N ATOM 2243 CA ARG A 802 14.035 22.208 25.245 1.00 33.64 C ATOM 2244 C ARG A 802 13.479 22.680 26.590 1.00 35.14 C ATOM 2245 O ARG A 802 13.960 23.662 27.152 1.00 33.14 O ATOM 2246 CB ARG A 802 13.168 22.705 24.085 1.00 27.67 C ATOM 2247 CG ARG A 802 13.836 22.464 22.738 1.00 23.62 C ATOM 2248 CD ARG A 802 12.999 22.913 21.562 1.00 23.22 C ATOM 2249 NE ARG A 802 13.724 22.686 20.314 1.00 27.80 N ATOM 2250 CZ ARG A 802 13.250 22.964 19.105 1.00 27.69 C ATOM 2251 NH1 ARG A 802 12.034 23.483 18.963 1.00 22.04 N ATOM 2252 NH2 ARG A 802 13.993 22.720 18.035 1.00 19.80 N ATOM 2253 HE ARG A 802 14.679 22.278 20.377 1.00 0.00 H ATOM 2254 HH12 ARG A 802 11.668 23.699 18.014 1.00 0.00 H ATOM 2255 HH11 ARG A 802 11.449 23.673 19.801 1.00 0.00 H ATOM 2256 HH22 ARG A 802 13.626 22.936 17.086 1.00 0.00 H ATOM 2257 HH21 ARG A 802 14.944 22.312 18.144 1.00 0.00 H ATOM 2258 H ARG A 802 13.540 20.222 24.542 1.00 0.00 H ATOM 2259 N LEU A 803 12.484 21.972 27.115 1.00 31.43 N ATOM 2260 CA LEU A 803 11.905 22.346 28.400 1.00 28.90 C ATOM 2261 C LEU A 803 12.903 22.154 29.537 1.00 36.70 C ATOM 2262 O LEU A 803 12.954 22.958 30.472 1.00 38.48 O ATOM 2263 CB LEU A 803 10.634 21.547 28.680 1.00 26.44 C ATOM 2264 CG LEU A 803 9.981 21.862 30.031 1.00 30.42 C ATOM 2265 CD1 LEU A 803 9.747 23.363 30.181 1.00 29.62 C ATOM 2266 CD2 LEU A 803 8.678 21.095 30.209 1.00 27.33 C ATOM 2267 H LEU A 803 12.115 21.144 26.605 1.00 0.00 H ATOM 2268 N ARG A 804 13.702 21.094 29.452 1.00 39.17 N ATOM 2269 CA ARG A 804 14.726 20.840 30.459 1.00 43.12 C ATOM 2270 C ARG A 804 15.755 21.965 30.499 1.00 41.46 C ATOM 2271 O ARG A 804 16.192 22.380 31.578 1.00 36.82 O ATOM 2272 CB ARG A 804 15.420 19.497 30.206 1.00 50.07 C ATOM 2273 CG ARG A 804 15.127 18.453 31.277 1.00 62.24 C ATOM 2274 CD ARG A 804 15.672 17.072 30.919 1.00 69.51 C ATOM 2275 NE ARG A 804 15.096 16.027 31.766 1.00 73.75 N ATOM 2276 CZ ARG A 804 15.672 15.536 32.862 1.00 79.95 C ATOM 2277 NH1 ARG A 804 16.857 15.985 33.258 1.00 81.07 N ATOM 2278 NH2 ARG A 804 15.062 14.591 33.563 1.00 83.17 N ATOM 2279 HE ARG A 804 14.170 15.640 31.493 1.00 0.00 H ATOM 2280 HH12 ARG A 804 17.300 15.597 34.115 1.00 0.00 H ATOM 2281 HH11 ARG A 804 17.342 16.725 32.711 1.00 0.00 H ATOM 2282 HH22 ARG A 804 15.511 14.207 34.419 1.00 0.00 H ATOM 2283 HH21 ARG A 804 14.134 14.234 33.257 1.00 0.00 H ATOM 2284 H ARG A 804 13.595 20.435 28.654 1.00 0.00 H ATOM 2285 N ASP A 805 16.139 22.461 29.325 1.00 40.36 N ATOM 2286 CA ASP A 805 17.129 23.531 29.259 1.00 44.93 C ATOM 2287 C ASP A 805 16.567 24.821 29.843 1.00 41.60 C ATOM 2288 O ASP A 805 17.238 25.504 30.622 1.00 42.03 O ATOM 2289 CB ASP A 805 17.596 23.766 27.820 1.00 47.96 C ATOM 2290 CG ASP A 805 18.601 24.905 27.715 1.00 56.75 C ATOM 2291 OD1 ASP A 805 18.212 26.010 27.281 1.00 62.56 O ATOM 2292 OD2 ASP A 805 19.777 24.702 28.084 1.00 52.46 O ATOM 2293 H ASP A 805 15.730 22.083 28.447 1.00 0.00 H ATOM 2294 N LEU A 806 15.336 25.146 29.457 1.00 33.52 N ATOM 2295 CA LEU A 806 14.657 26.333 29.954 1.00 36.53 C ATOM 2296 C LEU A 806 14.544 26.324 31.472 1.00 35.81 C ATOM 2297 O LEU A 806 14.873 27.307 32.130 1.00 39.57 O ATOM 2298 CB LEU A 806 13.268 26.446 29.336 1.00 39.43 C ATOM 2299 CG LEU A 806 13.173 27.246 28.045 1.00 39.70 C ATOM 2300 CD1 LEU A 806 11.764 27.149 27.510 1.00 39.98 C ATOM 2301 CD2 LEU A 806 13.559 28.691 28.306 1.00 44.33 C ATOM 2302 H LEU A 806 14.843 24.532 28.778 1.00 0.00 H ATOM 2303 N CYS A 807 14.077 25.205 32.016 1.00 34.17 N ATOM 2304 CA CYS A 807 13.921 25.047 33.454 1.00 36.01 C ATOM 2305 C CYS A 807 15.249 25.209 34.177 1.00 51.27 C ATOM 2306 O CYS A 807 15.296 25.694 35.306 1.00 58.48 O ATOM 2307 CB CYS A 807 13.316 23.684 33.779 1.00 35.57 C ATOM 2308 SG CYS A 807 11.578 23.533 33.365 1.00 41.95 S ATOM 2309 H CYS A 807 13.814 24.415 31.393 1.00 0.00 H ATOM 2310 N LEU A 808 16.326 24.797 33.519 1.00 46.47 N ATOM 2311 CA LEU A 808 17.662 24.921 34.083 1.00 47.04 C ATOM 2312 C LEU A 808 18.090 26.385 34.129 1.00 51.59 C ATOM 2313 O LEU A 808 18.505 26.888 35.172 1.00 53.65 O ATOM 2314 CB LEU A 808 18.656 24.093 33.268 1.00 46.19 C ATOM 2315 CG LEU A 808 20.023 23.783 33.872 1.00 58.78 C ATOM 2316 CD1 LEU A 808 20.466 22.395 33.431 1.00 59.07 C ATOM 2317 CD2 LEU A 808 21.051 24.831 33.462 1.00 63.86 C ATOM 2318 H LEU A 808 16.212 24.374 32.576 1.00 0.00 H ATOM 2319 N LYS A 809 17.977 27.069 32.995 1.00 52.29 N ATOM 2320 CA LYS A 809 18.407 28.459 32.901 1.00 57.41 C ATOM 2321 C LYS A 809 17.495 29.381 33.702 1.00 55.74 C ATOM 2322 O LYS A 809 17.902 30.466 34.116 1.00 57.37 O ATOM 2323 CB LYS A 809 18.468 28.901 31.438 1.00 60.25 C ATOM 2324 CG LYS A 809 19.592 28.233 30.661 1.00 69.39 C ATOM 2325 CD LYS A 809 19.806 28.865 29.295 1.00 75.07 C ATOM 2326 CE LYS A 809 21.082 28.337 28.649 1.00 77.10 C ATOM 2327 NZ LYS A 809 21.366 28.985 27.340 1.00 77.62 N ATOM 2328 HZ1 LYS A 809 20.577 28.805 26.687 1.00 0.00 H ATOM 2329 HZ2 LYS A 809 21.476 30.010 27.479 1.00 0.00 H ATOM 2330 HZ3 LYS A 809 22.243 28.591 26.943 1.00 0.00 H ATOM 2331 H LYS A 809 17.573 26.603 32.157 1.00 0.00 H ATOM 2332 N LEU A 810 16.259 28.943 33.917 1.00 54.83 N ATOM 2333 CA LEU A 810 15.326 29.693 34.746 1.00 55.52 C ATOM 2334 C LEU A 810 15.313 29.161 36.178 1.00 57.43 C ATOM 2335 O LEU A 810 14.609 29.694 37.032 1.00 52.66 O ATOM 2336 CB LEU A 810 13.923 29.656 34.132 1.00 49.41 C ATOM 2337 CG LEU A 810 13.761 30.586 32.926 1.00 38.25 C ATOM 2338 CD1 LEU A 810 12.591 30.171 32.040 1.00 35.89 C ATOM 2339 CD2 LEU A 810 13.599 32.029 33.382 1.00 39.89 C ATOM 2340 H LEU A 810 15.952 28.048 33.485 1.00 0.00 H ATOM 2341 N ASP A 811 16.117 28.124 36.421 1.00 58.27 N ATOM 2342 CA ASP A 811 16.249 27.468 37.727 1.00 62.04 C ATOM 2343 C ASP A 811 14.878 27.255 38.361 1.00 56.47 C ATOM 2344 O ASP A 811 14.487 27.942 39.306 1.00 52.52 O ATOM 2345 CB ASP A 811 17.178 28.259 38.661 1.00 71.44 C ATOM 2346 CG ASP A 811 17.157 27.735 40.099 1.00 79.12 C ATOM 2347 OD1 ASP A 811 17.566 26.574 40.317 1.00 81.82 O ATOM 2348 OD2 ASP A 811 16.759 28.490 41.013 1.00 80.28 O ATOM 2349 H ASP A 811 16.688 27.757 35.633 1.00 0.00 H ATOM 2350 N VAL A 812 14.139 26.311 37.800 1.00 53.40 N ATOM 2351 CA VAL A 812 12.799 26.006 38.267 1.00 54.63 C ATOM 2352 C VAL A 812 12.804 24.643 38.952 1.00 50.72 C ATOM 2353 O VAL A 812 13.633 23.790 38.639 1.00 47.47 O ATOM 2354 CB VAL A 812 11.789 26.025 37.100 1.00 57.61 C ATOM 2355 CG1 VAL A 812 10.377 25.937 37.615 1.00 63.08 C ATOM 2356 CG2 VAL A 812 11.958 27.293 36.283 1.00 59.15 C ATOM 2357 H VAL A 812 14.530 25.772 37.001 1.00 0.00 H ATOM 2358 N SER A 813 11.903 24.457 39.911 1.00 50.33 N ATOM 2359 CA SER A 813 11.739 23.169 40.567 1.00 50.29 C ATOM 2360 C SER A 813 11.306 22.123 39.554 1.00 51.63 C ATOM 2361 O SER A 813 10.660 22.446 38.557 1.00 49.04 O ATOM 2362 CB SER A 813 10.711 23.261 41.694 1.00 47.48 C ATOM 2363 OG SER A 813 9.411 23.464 41.168 1.00 45.80 O ATOM 2364 HG SER A 813 9.394 24.307 40.648 1.00 0.00 H ATOM 2365 H SER A 813 11.299 25.253 40.200 1.00 0.00 H ATOM 2366 N ASN A 814 11.664 20.870 39.813 1.00 57.44 N ATOM 2367 CA ASN A 814 11.280 19.768 38.939 1.00 65.16 C ATOM 2368 C ASN A 814 9.778 19.501 38.976 1.00 62.00 C ATOM 2369 O ASN A 814 9.230 18.877 38.066 1.00 65.91 O ATOM 2370 CB ASN A 814 12.048 18.499 39.317 1.00 70.15 C ATOM 2371 CG ASN A 814 13.521 18.583 38.961 1.00 72.51 C ATOM 2372 OD1 ASN A 814 14.008 19.628 38.530 1.00 69.21 O ATOM 2373 ND2 ASN A 814 14.239 17.481 39.148 1.00 76.08 N ATOM 2374 HD22 ASN A 814 13.785 16.620 39.515 1.00 0.00 H ATOM 2375 HD21 ASN A 814 15.255 17.479 38.928 1.00 0.00 H ATOM 2376 H ASN A 814 12.233 20.670 40.661 1.00 0.00 H ATOM 2377 N GLU A 815 9.117 19.976 40.028 1.00 57.58 N ATOM 2378 CA GLU A 815 7.678 19.792 40.172 1.00 56.70 C ATOM 2379 C GLU A 815 6.898 20.720 39.246 1.00 49.19 C ATOM 2380 O GLU A 815 5.876 20.328 38.684 1.00 45.68 O ATOM 2381 CB GLU A 815 7.247 20.012 41.626 1.00 66.44 C ATOM 2382 CG GLU A 815 5.735 20.159 41.837 1.00 74.45 C ATOM 2383 CD GLU A 815 4.958 18.849 41.704 1.00 82.72 C ATOM 2384 OE1 GLU A 815 5.377 17.956 40.935 1.00 85.89 O ATOM 2385 OE2 GLU A 815 3.914 18.713 42.379 1.00 84.80 O ATOM 2386 H GLU A 815 9.639 20.491 40.765 1.00 0.00 H ATOM 2387 N LEU A 816 7.373 21.952 39.090 1.00 47.22 N ATOM 2388 CA LEU A 816 6.750 22.865 38.142 1.00 45.06 C ATOM 2389 C LEU A 816 7.085 22.416 36.724 1.00 42.80 C ATOM 2390 O LEU A 816 6.264 22.542 35.819 1.00 43.21 O ATOM 2391 CB LEU A 816 7.200 24.309 38.373 1.00 43.62 C ATOM 2392 CG LEU A 816 6.638 25.332 37.380 1.00 43.18 C ATOM 2393 CD1 LEU A 816 5.123 25.204 37.251 1.00 38.68 C ATOM 2394 CD2 LEU A 816 7.006 26.741 37.786 1.00 47.63 C ATOM 2395 H LEU A 816 8.193 22.265 39.648 1.00 0.00 H ATOM 2396 N ARG A 817 8.291 21.883 36.544 1.00 44.87 N ATOM 2397 CA ARG A 817 8.697 21.318 35.259 1.00 43.92 C ATOM 2398 C ARG A 817 7.701 20.253 34.803 1.00 40.43 C ATOM 2399 O ARG A 817 7.212 20.287 33.675 1.00 36.31 O ATOM 2400 CB ARG A 817 10.104 20.722 35.349 1.00 41.56 C ATOM 2401 CG ARG A 817 10.657 20.221 34.019 1.00 38.64 C ATOM 2402 CD ARG A 817 12.070 19.672 34.178 1.00 40.39 C ATOM 2403 NE ARG A 817 12.090 18.459 34.993 1.00 46.85 N ATOM 2404 CZ ARG A 817 13.196 17.825 35.365 1.00 52.82 C ATOM 2405 NH1 ARG A 817 14.383 18.287 34.998 1.00 55.00 N ATOM 2406 NH2 ARG A 817 13.117 16.731 36.111 1.00 55.03 N ATOM 2407 HE ARG A 817 11.178 18.066 35.302 1.00 0.00 H ATOM 2408 HH12 ARG A 817 15.248 17.789 35.290 1.00 0.00 H ATOM 2409 HH11 ARG A 817 14.449 19.147 34.418 1.00 0.00 H ATOM 2410 HH22 ARG A 817 13.984 16.236 36.401 1.00 0.00 H ATOM 2411 HH21 ARG A 817 12.188 16.368 36.406 1.00 0.00 H ATOM 2412 H ARG A 817 8.962 21.868 37.338 1.00 0.00 H ATOM 2413 N ARG A 818 7.391 19.324 35.700 1.00 43.77 N ATOM 2414 CA ARG A 818 6.422 18.272 35.418 1.00 42.09 C ATOM 2415 C ARG A 818 5.032 18.856 35.154 1.00 39.87 C ATOM 2416 O ARG A 818 4.276 18.329 34.340 1.00 33.53 O ATOM 2417 CB ARG A 818 6.372 17.278 36.580 1.00 45.99 C ATOM 2418 CG ARG A 818 5.608 15.997 36.284 1.00 58.93 C ATOM 2419 CD ARG A 818 5.482 15.144 37.539 1.00 71.23 C ATOM 2420 NE ARG A 818 4.747 13.905 37.298 1.00 77.31 N ATOM 2421 CZ ARG A 818 5.306 12.701 37.237 1.00 80.12 C ATOM 2422 NH1 ARG A 818 6.614 12.563 37.407 1.00 79.18 N ATOM 2423 NH2 ARG A 818 4.554 11.631 37.013 1.00 82.67 N ATOM 2424 HE ARG A 818 3.718 13.969 37.165 1.00 0.00 H ATOM 2425 HH12 ARG A 818 7.048 11.619 37.359 1.00 0.00 H ATOM 2426 HH11 ARG A 818 7.206 13.399 37.589 1.00 0.00 H ATOM 2427 HH22 ARG A 818 4.991 10.689 36.965 1.00 0.00 H ATOM 2428 HH21 ARG A 818 3.527 11.735 36.885 1.00 0.00 H ATOM 2429 H ARG A 818 7.853 19.348 36.631 1.00 0.00 H ATOM 2430 N LYS A 819 4.702 19.948 35.842 1.00 38.88 N ATOM 2431 CA LYS A 819 3.420 20.622 35.639 1.00 39.61 C ATOM 2432 C LYS A 819 3.377 21.365 34.306 1.00 35.03 C ATOM 2433 O LYS A 819 2.357 21.358 33.612 1.00 36.95 O ATOM 2434 CB LYS A 819 3.133 21.591 36.791 1.00 36.05 C ATOM 2435 CG LYS A 819 2.740 20.905 38.087 1.00 38.25 C ATOM 2436 CD LYS A 819 2.719 21.879 39.262 1.00 44.83 C ATOM 2437 CE LYS A 819 2.416 21.157 40.567 1.00 51.31 C ATOM 2438 NZ LYS A 819 2.586 22.034 41.765 1.00 57.26 N ATOM 2439 HZ1 LYS A 819 3.568 22.373 41.809 1.00 0.00 H ATOM 2440 HZ2 LYS A 819 1.941 22.846 41.693 1.00 0.00 H ATOM 2441 HZ3 LYS A 819 2.367 21.491 42.625 1.00 0.00 H ATOM 2442 H LYS A 819 5.372 20.330 36.540 1.00 0.00 H ATOM 2443 N ILE A 820 4.482 22.017 33.960 1.00 36.04 N ATOM 2444 CA ILE A 820 4.597 22.703 32.675 1.00 36.26 C ATOM 2445 C ILE A 820 4.500 21.690 31.538 1.00 34.21 C ATOM 2446 O ILE A 820 3.781 21.903 30.558 1.00 29.71 O ATOM 2447 CB ILE A 820 5.923 23.491 32.571 1.00 35.95 C ATOM 2448 CG1 ILE A 820 5.900 24.693 33.519 1.00 37.64 C ATOM 2449 CG2 ILE A 820 6.177 23.939 31.138 1.00 35.43 C ATOM 2450 CD1 ILE A 820 7.248 25.371 33.702 1.00 33.14 C ATOM 2451 H ILE A 820 5.285 22.040 34.620 1.00 0.00 H ATOM 2452 N TRP A 821 5.217 20.580 31.691 1.00 37.52 N ATOM 2453 CA TRP A 821 5.171 19.482 30.730 1.00 30.05 C ATOM 2454 C TRP A 821 3.757 18.929 30.557 1.00 35.13 C ATOM 2455 O TRP A 821 3.332 18.631 29.436 1.00 33.55 O ATOM 2456 CB TRP A 821 6.115 18.357 31.160 1.00 28.03 C ATOM 2457 CG TRP A 821 6.083 17.177 30.239 1.00 29.29 C ATOM 2458 CD1 TRP A 821 5.550 15.947 30.497 1.00 29.89 C ATOM 2459 CD2 TRP A 821 6.594 17.119 28.903 1.00 27.33 C ATOM 2460 NE1 TRP A 821 5.706 15.125 29.408 1.00 33.26 N ATOM 2461 CE2 TRP A 821 6.343 15.822 28.414 1.00 31.34 C ATOM 2462 CE3 TRP A 821 7.242 18.038 28.073 1.00 31.81 C ATOM 2463 CZ2 TRP A 821 6.721 15.419 27.135 1.00 29.83 C ATOM 2464 CZ3 TRP A 821 7.615 17.637 26.801 1.00 28.90 C ATOM 2465 CH2 TRP A 821 7.354 16.339 26.347 1.00 25.23 C ATOM 2466 HE1 TRP A 821 5.392 14.135 29.347 1.00 0.00 H ATOM 2467 H TRP A 821 5.832 20.491 32.525 1.00 0.00 H ATOM 2468 N THR A 822 3.039 18.792 31.671 1.00 34.63 N ATOM 2469 CA THR A 822 1.667 18.287 31.660 1.00 34.64 C ATOM 2470 C THR A 822 0.737 19.226 30.890 1.00 31.21 C ATOM 2471 O THR A 822 -0.144 18.784 30.151 1.00 28.37 O ATOM 2472 CB THR A 822 1.126 18.095 33.101 1.00 38.14 C ATOM 2473 OG1 THR A 822 1.881 17.077 33.770 1.00 39.09 O ATOM 2474 CG2 THR A 822 -0.324 17.678 33.080 1.00 30.58 C ATOM 2475 HG1 THR A 822 2.833 17.346 33.810 1.00 0.00 H ATOM 2476 H THR A 822 3.470 19.054 32.581 1.00 0.00 H ATOM 2477 N CYS A 823 0.941 20.527 31.062 1.00 29.29 N ATOM 2478 CA CYS A 823 0.141 21.522 30.360 1.00 26.78 C ATOM 2479 C CYS A 823 0.455 21.515 28.864 1.00 27.41 C ATOM 2480 O CYS A 823 -0.442 21.615 28.028 1.00 24.11 O ATOM 2481 CB CYS A 823 0.388 22.913 30.937 1.00 27.78 C ATOM 2482 SG CYS A 823 -0.621 24.217 30.197 1.00 38.55 S ATOM 2483 H CYS A 823 1.689 20.843 31.712 1.00 0.00 H ATOM 2484 N PHE A 824 1.737 21.408 28.538 1.00 24.25 N ATOM 2485 CA PHE A 824 2.162 21.357 27.148 1.00 26.62 C ATOM 2486 C PHE A 824 1.577 20.141 26.431 1.00 27.31 C ATOM 2487 O PHE A 824 1.085 20.247 25.311 1.00 20.63 O ATOM 2488 CB PHE A 824 3.687 21.335 27.054 1.00 22.48 C ATOM 2489 CG PHE A 824 4.194 21.109 25.666 1.00 28.28 C ATOM 2490 CD1 PHE A 824 4.140 22.125 24.722 1.00 26.27 C ATOM 2491 CD2 PHE A 824 4.712 19.877 25.296 1.00 24.92 C ATOM 2492 CE1 PHE A 824 4.600 21.915 23.433 1.00 24.52 C ATOM 2493 CE2 PHE A 824 5.173 19.663 24.013 1.00 26.25 C ATOM 2494 CZ PHE A 824 5.117 20.682 23.080 1.00 23.34 C ATOM 2495 H PHE A 824 2.452 21.360 29.292 1.00 0.00 H ATOM 2496 N GLU A 825 1.640 18.985 27.080 1.00 32.55 N ATOM 2497 CA GLU A 825 1.066 17.773 26.510 1.00 31.00 C ATOM 2498 C GLU A 825 -0.435 17.945 26.298 1.00 32.88 C ATOM 2499 O GLU A 825 -0.975 17.528 25.270 1.00 29.03 O ATOM 2500 CB GLU A 825 1.344 16.568 27.408 1.00 28.30 C ATOM 2501 CG GLU A 825 0.621 15.308 26.982 1.00 36.07 C ATOM 2502 CD GLU A 825 1.033 14.106 27.803 1.00 48.47 C ATOM 2503 OE1 GLU A 825 2.217 14.035 28.189 1.00 61.97 O ATOM 2504 OE2 GLU A 825 0.177 13.237 28.068 1.00 48.73 O ATOM 2505 H GLU A 825 2.106 18.944 28.009 1.00 0.00 H ATOM 2506 N PHE A 826 -1.095 18.583 27.264 1.00 28.93 N ATOM 2507 CA PHE A 826 -2.524 18.850 27.161 1.00 27.94 C ATOM 2508 C PHE A 826 -2.855 19.645 25.908 1.00 27.63 C ATOM 2509 O PHE A 826 -3.865 19.388 25.254 1.00 25.81 O ATOM 2510 CB PHE A 826 -3.041 19.605 28.389 1.00 25.20 C ATOM 2511 CG PHE A 826 -4.447 20.111 28.229 1.00 27.21 C ATOM 2512 CD1 PHE A 826 -5.529 19.260 28.415 1.00 33.38 C ATOM 2513 CD2 PHE A 826 -4.692 21.430 27.877 1.00 27.96 C ATOM 2514 CE1 PHE A 826 -6.825 19.714 28.258 1.00 32.27 C ATOM 2515 CE2 PHE A 826 -5.987 21.892 27.715 1.00 33.10 C ATOM 2516 CZ PHE A 826 -7.055 21.033 27.907 1.00 35.31 C ATOM 2517 H PHE A 826 -0.579 18.897 28.110 1.00 0.00 H ATOM 2518 N THR A 827 -2.017 20.622 25.581 1.00 27.19 N ATOM 2519 CA THR A 827 -2.274 21.440 24.406 1.00 24.71 C ATOM 2520 C THR A 827 -2.019 20.636 23.133 1.00 25.23 C ATOM 2521 O THR A 827 -2.743 20.789 22.164 1.00 25.99 O ATOM 2522 CB THR A 827 -1.431 22.740 24.399 1.00 28.15 C ATOM 2523 OG1 THR A 827 -0.034 22.432 24.500 1.00 35.20 O ATOM 2524 CG2 THR A 827 -1.835 23.632 25.562 1.00 24.94 C ATOM 2525 HG1 THR A 827 0.135 21.943 25.344 1.00 0.00 H ATOM 2526 H THR A 827 -1.176 20.802 26.166 1.00 0.00 H ATOM 2527 N LEU A 828 -1.010 19.769 23.138 1.00 19.03 N ATOM 2528 CA LEU A 828 -0.770 18.890 21.986 1.00 23.51 C ATOM 2529 C LEU A 828 -1.889 17.881 21.791 1.00 18.05 C ATOM 2530 O LEU A 828 -2.334 17.643 20.672 1.00 34.40 O ATOM 2531 CB LEU A 828 0.555 18.133 22.130 1.00 21.15 C ATOM 2532 CG LEU A 828 1.849 18.918 21.925 1.00 27.30 C ATOM 2533 CD1 LEU A 828 3.027 17.970 21.774 1.00 31.71 C ATOM 2534 CD2 LEU A 828 1.733 19.838 20.716 1.00 29.13 C ATOM 2535 H LEU A 828 -0.384 19.713 23.967 1.00 0.00 H ATOM 2536 N VAL A 829 -2.315 17.266 22.888 1.00 29.55 N ATOM 2537 CA VAL A 829 -3.314 16.202 22.845 1.00 24.00 C ATOM 2538 C VAL A 829 -4.748 16.702 22.729 1.00 30.57 C ATOM 2539 O VAL A 829 -5.527 16.191 21.921 1.00 33.17 O ATOM 2540 CB VAL A 829 -3.200 15.305 24.102 1.00 27.92 C ATOM 2541 CG1 VAL A 829 -4.289 14.242 24.116 1.00 27.49 C ATOM 2542 CG2 VAL A 829 -1.831 14.654 24.146 1.00 25.48 C ATOM 2543 H VAL A 829 -1.924 17.552 23.808 1.00 0.00 H ATOM 2544 N HIS A 830 -5.121 17.655 23.576 1.00 32.07 N ATOM 2545 CA HIS A 830 -6.496 18.138 23.569 1.00 34.19 C ATOM 2546 C HIS A 830 -6.751 19.490 22.902 1.00 33.31 C ATOM 2547 O HIS A 830 -7.905 19.899 22.786 1.00 34.59 O ATOM 2548 CB HIS A 830 -7.023 18.145 25.000 1.00 37.18 C ATOM 2549 CG HIS A 830 -7.214 16.771 25.558 1.00 43.40 C ATOM 2550 ND1 HIS A 830 -8.095 15.865 25.005 1.00 42.63 N ATOM 2551 CD2 HIS A 830 -6.618 16.134 26.593 1.00 43.30 C ATOM 2552 CE1 HIS A 830 -8.044 14.734 25.686 1.00 42.56 C ATOM 2553 NE2 HIS A 830 -7.157 14.871 26.656 1.00 42.20 N ATOM 2554 H HIS A 830 -4.432 18.056 24.244 1.00 0.00 H ATOM 2555 N CYS A 831 -5.700 20.181 22.461 1.00 29.58 N ATOM 2556 CA CYS A 831 -5.891 21.356 21.606 1.00 26.20 C ATOM 2557 C CYS A 831 -4.926 21.353 20.427 1.00 28.47 C ATOM 2558 O CYS A 831 -4.202 22.328 20.225 1.00 26.25 O ATOM 2559 CB CYS A 831 -5.690 22.652 22.394 1.00 25.30 C ATOM 2560 SG CYS A 831 -6.521 22.761 23.985 1.00 38.40 S ATOM 2561 H CYS A 831 -4.739 19.885 22.725 1.00 0.00 H ATOM 2562 N PRO A 832 -4.931 20.278 19.625 1.00 25.88 N ATOM 2563 CA PRO A 832 -3.864 20.167 18.624 1.00 21.57 C ATOM 2564 C PRO A 832 -3.968 21.209 17.509 1.00 25.80 C ATOM 2565 O PRO A 832 -2.954 21.506 16.878 1.00 24.67 O ATOM 2566 CB PRO A 832 -4.049 18.752 18.070 1.00 17.18 C ATOM 2567 CG PRO A 832 -5.503 18.445 18.304 1.00 24.13 C ATOM 2568 CD PRO A 832 -5.867 19.138 19.577 1.00 25.46 C ATOM 2569 N ASP A 833 -5.164 21.749 17.280 1.00 27.59 N ATOM 2570 CA ASP A 833 -5.363 22.793 16.274 1.00 27.53 C ATOM 2571 C ASP A 833 -4.515 24.044 16.556 1.00 32.65 C ATOM 2572 O ASP A 833 -4.174 24.785 15.631 1.00 31.76 O ATOM 2573 CB ASP A 833 -6.846 23.177 16.184 1.00 28.83 C ATOM 2574 CG ASP A 833 -7.347 23.889 17.429 1.00 39.39 C ATOM 2575 OD1 ASP A 833 -7.467 25.133 17.396 1.00 44.09 O ATOM 2576 OD2 ASP A 833 -7.621 23.208 18.441 1.00 41.83 O ATOM 2577 H ASP A 833 -5.981 21.419 17.833 1.00 0.00 H ATOM 2578 N LEU A 834 -4.176 24.272 17.826 1.00 26.67 N ATOM 2579 CA LEU A 834 -3.330 25.408 18.207 1.00 27.81 C ATOM 2580 C LEU A 834 -1.961 25.363 17.532 1.00 27.19 C ATOM 2581 O LEU A 834 -1.338 26.403 17.320 1.00 29.39 O ATOM 2582 CB LEU A 834 -3.139 25.462 19.724 1.00 19.42 C ATOM 2583 CG LEU A 834 -4.331 25.962 20.546 1.00 30.09 C ATOM 2584 CD1 LEU A 834 -4.008 25.951 22.033 1.00 28.12 C ATOM 2585 CD2 LEU A 834 -4.734 27.352 20.097 1.00 28.51 C ATOM 2586 H LEU A 834 -4.521 23.627 18.566 1.00 0.00 H ATOM 2587 N MET A 835 -1.495 24.159 17.205 1.00 18.59 N ATOM 2588 CA MET A 835 -0.197 23.995 16.559 1.00 20.15 C ATOM 2589 C MET A 835 -0.238 24.283 15.060 1.00 21.33 C ATOM 2590 O MET A 835 0.802 24.515 14.452 1.00 23.92 O ATOM 2591 CB MET A 835 0.343 22.580 16.774 1.00 25.94 C ATOM 2592 CG MET A 835 1.282 22.431 17.964 1.00 31.97 C ATOM 2593 SD MET A 835 2.626 23.635 17.977 1.00 27.27 S ATOM 2594 CE MET A 835 3.462 23.279 16.439 1.00 21.52 C ATOM 2595 H MET A 835 -2.069 23.317 17.415 1.00 0.00 H ATOM 2596 N LYS A 836 -1.427 24.259 14.464 1.00 19.56 N ATOM 2597 CA LYS A 836 -1.523 24.425 13.017 1.00 20.67 C ATOM 2598 C LYS A 836 -0.932 25.764 12.579 1.00 24.04 C ATOM 2599 O LYS A 836 -1.350 26.825 13.049 1.00 17.38 O ATOM 2600 CB LYS A 836 -2.978 24.311 12.546 1.00 18.91 C ATOM 2601 CG LYS A 836 -3.123 24.400 11.023 1.00 24.70 C ATOM 2602 CD LYS A 836 -4.515 24.016 10.549 1.00 21.67 C ATOM 2603 CE LYS A 836 -5.554 25.020 11.009 1.00 22.88 C ATOM 2604 NZ LYS A 836 -6.884 24.705 10.432 1.00 22.57 N ATOM 2605 HZ1 LYS A 836 -6.826 24.734 9.394 1.00 0.00 H ATOM 2606 HZ2 LYS A 836 -7.177 23.755 10.738 1.00 0.00 H ATOM 2607 HZ3 LYS A 836 -7.578 25.406 10.761 1.00 0.00 H ATOM 2608 H LYS A 836 -2.289 24.122 15.030 1.00 0.00 H ATOM 2609 N ASP A 837 0.045 25.689 11.678 1.00 20.52 N ATOM 2610 CA ASP A 837 0.749 26.860 11.155 1.00 25.29 C ATOM 2611 C ASP A 837 1.475 27.661 12.233 1.00 22.57 C ATOM 2612 O ASP A 837 1.778 28.833 12.047 1.00 20.07 O ATOM 2613 CB ASP A 837 -0.223 27.768 10.403 1.00 18.50 C ATOM 2614 CG ASP A 837 -0.713 27.142 9.126 1.00 21.91 C ATOM 2615 OD1 ASP A 837 0.111 26.500 8.441 1.00 26.70 O ATOM 2616 OD2 ASP A 837 -1.916 27.280 8.812 1.00 24.81 O ATOM 2617 H ASP A 837 0.322 24.750 11.328 1.00 0.00 H ATOM 2618 N ARG A 838 1.792 27.016 13.347 1.00 18.88 N ATOM 2619 CA ARG A 838 2.511 27.696 14.408 1.00 21.77 C ATOM 2620 C ARG A 838 3.788 26.935 14.737 1.00 23.64 C ATOM 2621 O ARG A 838 4.183 26.022 14.014 1.00 21.62 O ATOM 2622 CB ARG A 838 1.635 27.865 15.651 1.00 17.76 C ATOM 2623 CG ARG A 838 0.455 28.796 15.431 1.00 24.88 C ATOM 2624 CD ARG A 838 -0.133 29.316 16.736 1.00 25.60 C ATOM 2625 NE ARG A 838 -1.258 30.210 16.471 1.00 29.50 N ATOM 2626 CZ ARG A 838 -2.528 29.819 16.426 1.00 20.82 C ATOM 2627 NH1 ARG A 838 -2.839 28.550 16.649 1.00 25.87 N ATOM 2628 NH2 ARG A 838 -3.487 30.694 16.166 1.00 22.28 N ATOM 2629 HE ARG A 838 -1.052 31.216 16.307 1.00 0.00 H ATOM 2630 HH12 ARG A 838 -3.832 28.244 16.614 1.00 0.00 H ATOM 2631 HH11 ARG A 838 -2.090 27.860 16.859 1.00 0.00 H ATOM 2632 HH22 ARG A 838 -4.479 30.383 16.132 1.00 0.00 H ATOM 2633 HH21 ARG A 838 -3.248 31.692 15.996 1.00 0.00 H ATOM 2634 H ARG A 838 1.524 26.018 13.461 1.00 0.00 H ATOM 2635 N HIS A 839 4.446 27.357 15.808 1.00 22.68 N ATOM 2636 CA HIS A 839 5.747 26.831 16.196 1.00 25.16 C ATOM 2637 C HIS A 839 5.634 26.131 17.542 1.00 20.39 C ATOM 2638 O HIS A 839 4.995 26.643 18.469 1.00 24.72 O ATOM 2639 CB HIS A 839 6.770 27.970 16.254 1.00 18.36 C ATOM 2640 CG HIS A 839 8.193 27.519 16.353 1.00 23.54 C ATOM 2641 ND1 HIS A 839 8.722 26.964 17.498 1.00 27.61 N ATOM 2642 CD2 HIS A 839 9.209 27.580 15.461 1.00 20.98 C ATOM 2643 CE1 HIS A 839 9.999 26.687 17.302 1.00 26.94 C ATOM 2644 NE2 HIS A 839 10.320 27.051 16.073 1.00 24.82 N ATOM 2645 H HIS A 839 4.013 28.097 16.397 1.00 0.00 H ATOM 2646 N LEU A 840 6.244 24.957 17.633 1.00 16.80 N ATOM 2647 CA LEU A 840 6.241 24.153 18.848 1.00 21.59 C ATOM 2648 C LEU A 840 6.667 24.925 20.100 1.00 25.47 C ATOM 2649 O LEU A 840 6.094 24.745 21.176 1.00 25.23 O ATOM 2650 CB LEU A 840 7.160 22.951 18.664 1.00 21.32 C ATOM 2651 CG LEU A 840 6.784 21.699 19.444 1.00 22.36 C ATOM 2652 CD1 LEU A 840 5.490 21.124 18.892 1.00 19.29 C ATOM 2653 CD2 LEU A 840 7.913 20.679 19.370 1.00 31.08 C ATOM 2654 H LEU A 840 6.748 24.594 16.799 1.00 0.00 H ATOM 2655 N ASP A 841 7.676 25.780 19.960 1.00 18.91 N ATOM 2656 CA ASP A 841 8.210 26.494 21.112 1.00 25.29 C ATOM 2657 C ASP A 841 7.226 27.545 21.620 1.00 28.12 C ATOM 2658 O ASP A 841 7.253 27.909 22.790 1.00 26.67 O ATOM 2659 CB ASP A 841 9.553 27.146 20.774 1.00 23.80 C ATOM 2660 CG ASP A 841 10.644 26.121 20.461 1.00 26.64 C ATOM 2661 OD1 ASP A 841 11.725 26.527 19.983 1.00 31.65 O ATOM 2662 OD2 ASP A 841 10.424 24.913 20.682 1.00 22.81 O ATOM 2663 H ASP A 841 8.088 25.940 19.019 1.00 0.00 H ATOM 2664 N GLN A 842 6.351 28.021 20.745 1.00 30.63 N ATOM 2665 CA GLN A 842 5.353 29.004 21.149 1.00 30.38 C ATOM 2666 C GLN A 842 4.391 28.402 22.166 1.00 31.87 C ATOM 2667 O GLN A 842 4.011 29.063 23.137 1.00 29.92 O ATOM 2668 CB GLN A 842 4.597 29.541 19.929 1.00 25.52 C ATOM 2669 CG GLN A 842 5.445 30.485 19.071 1.00 24.82 C ATOM 2670 CD GLN A 842 4.976 30.570 17.631 1.00 20.76 C ATOM 2671 OE1 GLN A 842 4.108 29.813 17.208 1.00 23.87 O ATOM 2672 NE2 GLN A 842 5.561 31.487 16.868 1.00 21.45 N ATOM 2673 HE22 GLN A 842 6.293 32.108 17.269 1.00 0.00 H ATOM 2674 HE21 GLN A 842 5.287 31.584 15.869 1.00 0.00 H ATOM 2675 H GLN A 842 6.377 27.690 19.760 1.00 0.00 H ATOM 2676 N LEU A 843 4.017 27.142 21.959 1.00 23.51 N ATOM 2677 CA LEU A 843 3.133 26.458 22.895 1.00 25.16 C ATOM 2678 C LEU A 843 3.876 26.091 24.170 1.00 27.23 C ATOM 2679 O LEU A 843 3.295 26.064 25.253 1.00 28.58 O ATOM 2680 CB LEU A 843 2.526 25.204 22.255 1.00 28.90 C ATOM 2681 CG LEU A 843 1.115 25.375 21.675 1.00 29.60 C ATOM 2682 CD1 LEU A 843 1.098 26.456 20.619 1.00 30.20 C ATOM 2683 CD2 LEU A 843 0.601 24.070 21.103 1.00 35.75 C ATOM 2684 H LEU A 843 4.360 26.638 21.117 1.00 0.00 H ATOM 2685 N LEU A 844 5.169 25.822 24.040 1.00 27.28 N ATOM 2686 CA LEU A 844 5.968 25.411 25.186 1.00 32.74 C ATOM 2687 C LEU A 844 6.229 26.589 26.124 1.00 31.68 C ATOM 2688 O LEU A 844 6.227 26.431 27.342 1.00 35.39 O ATOM 2689 CB LEU A 844 7.292 24.789 24.725 1.00 32.78 C ATOM 2690 CG LEU A 844 8.143 24.134 25.818 1.00 39.66 C ATOM 2691 CD1 LEU A 844 7.406 22.964 26.462 1.00 40.38 C ATOM 2692 CD2 LEU A 844 9.503 23.691 25.281 1.00 30.19 C ATOM 2693 H LEU A 844 5.618 25.906 23.106 1.00 0.00 H ATOM 2694 N LEU A 845 6.440 27.771 25.554 1.00 31.01 N ATOM 2695 CA LEU A 845 6.713 28.960 26.356 1.00 33.46 C ATOM 2696 C LEU A 845 5.444 29.428 27.059 1.00 31.38 C ATOM 2697 O LEU A 845 5.484 29.866 28.208 1.00 30.88 O ATOM 2698 CB LEU A 845 7.292 30.082 25.488 1.00 25.94 C ATOM 2699 CG LEU A 845 8.655 29.809 24.848 1.00 39.48 C ATOM 2700 CD1 LEU A 845 9.076 30.955 23.936 1.00 38.73 C ATOM 2701 CD2 LEU A 845 9.715 29.554 25.907 1.00 39.41 C ATOM 2702 H LEU A 845 6.410 27.850 24.517 1.00 0.00 H ATOM 2703 N CYS A 846 4.317 29.330 26.364 1.00 30.97 N ATOM 2704 CA CYS A 846 3.028 29.655 26.962 1.00 26.79 C ATOM 2705 C CYS A 846 2.694 28.684 28.087 1.00 31.11 C ATOM 2706 O CYS A 846 2.175 29.085 29.130 1.00 34.08 O ATOM 2707 CB CYS A 846 1.924 29.641 25.905 1.00 25.40 C ATOM 2708 SG CYS A 846 2.037 31.013 24.743 1.00 29.13 S ATOM 2709 H CYS A 846 4.355 29.015 25.374 1.00 0.00 H ATOM 2710 N ALA A 847 2.991 27.405 27.873 1.00 29.65 N ATOM 2711 CA ALA A 847 2.794 26.407 28.914 1.00 29.12 C ATOM 2712 C ALA A 847 3.616 26.769 30.143 1.00 32.74 C ATOM 2713 O ALA A 847 3.145 26.634 31.272 1.00 32.30 O ATOM 2714 CB ALA A 847 3.161 25.014 28.408 1.00 25.14 C ATOM 2715 H ALA A 847 3.369 27.114 26.949 1.00 0.00 H ATOM 2716 N PHE A 848 4.836 27.248 29.916 1.00 34.68 N ATOM 2717 CA PHE A 848 5.755 27.589 31.002 1.00 33.82 C ATOM 2718 C PHE A 848 5.187 28.657 31.943 1.00 36.13 C ATOM 2719 O PHE A 848 5.179 28.497 33.172 1.00 39.01 O ATOM 2720 CB PHE A 848 7.092 28.063 30.410 1.00 29.67 C ATOM 2721 CG PHE A 848 8.259 27.927 31.348 1.00 31.15 C ATOM 2722 CD1 PHE A 848 9.269 27.011 31.102 1.00 30.75 C ATOM 2723 CD2 PHE A 848 8.349 28.724 32.478 1.00 44.63 C ATOM 2724 CE1 PHE A 848 10.341 26.889 31.969 1.00 32.35 C ATOM 2725 CE2 PHE A 848 9.414 28.606 33.349 1.00 34.74 C ATOM 2726 CZ PHE A 848 10.409 27.684 33.095 1.00 34.35 C ATOM 2727 H PHE A 848 5.147 27.385 28.933 1.00 0.00 H ATOM 2728 N TYR A 849 4.714 29.743 31.334 1.00 33.21 N ATOM 2729 CA TYR A 849 4.257 30.943 32.052 1.00 36.13 C ATOM 2730 C TYR A 849 2.949 30.672 32.800 1.00 40.15 C ATOM 2731 O TYR A 849 2.845 30.957 33.999 1.00 35.76 O ATOM 2732 CB TYR A 849 4.096 32.130 31.078 1.00 32.93 C ATOM 2733 CG TYR A 849 3.506 33.387 31.714 1.00 42.08 C ATOM 2734 CD1 TYR A 849 4.297 34.282 32.435 1.00 44.96 C ATOM 2735 CD2 TYR A 849 2.150 33.673 31.598 1.00 37.43 C ATOM 2736 CE1 TYR A 849 3.742 35.418 33.031 1.00 45.44 C ATOM 2737 CE2 TYR A 849 1.593 34.795 32.182 1.00 40.82 C ATOM 2738 CZ TYR A 849 2.387 35.664 32.899 1.00 44.82 C ATOM 2739 OH TYR A 849 1.802 36.764 33.475 1.00 47.42 O ATOM 2740 HH TYR A 849 2.491 37.291 33.953 1.00 0.00 H ATOM 2741 H TYR A 849 4.665 29.743 30.295 1.00 0.00 H ATOM 2742 N ILE A 850 1.976 30.078 32.109 1.00 35.75 N ATOM 2743 CA ILE A 850 0.654 29.897 32.700 1.00 46.19 C ATOM 2744 C ILE A 850 0.727 28.931 33.880 1.00 45.74 C ATOM 2745 O ILE A 850 0.010 29.089 34.867 1.00 45.51 O ATOM 2746 CB ILE A 850 -0.399 29.400 31.653 1.00 37.35 C ATOM 2747 CG1 ILE A 850 -1.819 29.684 32.154 1.00 42.00 C ATOM 2748 CG2 ILE A 850 -0.221 27.922 31.310 1.00 32.57 C ATOM 2749 CD1 ILE A 850 -2.896 29.356 31.153 1.00 41.48 C ATOM 2750 H ILE A 850 2.160 29.741 31.142 1.00 0.00 H ATOM 2751 N MET A 851 1.637 27.967 33.796 1.00 41.00 N ATOM 2752 CA MET A 851 1.840 27.017 34.879 1.00 41.64 C ATOM 2753 C MET A 851 2.645 27.632 36.012 1.00 36.64 C ATOM 2754 O MET A 851 2.339 27.405 37.180 1.00 43.37 O ATOM 2755 CB MET A 851 2.535 25.754 34.373 1.00 35.75 C ATOM 2756 CG MET A 851 1.616 24.821 33.625 1.00 31.89 C ATOM 2757 SD MET A 851 0.167 24.373 34.591 1.00 54.07 S ATOM 2758 CE MET A 851 -1.101 25.098 33.582 1.00 37.67 C ATOM 2759 H MET A 851 2.218 27.890 32.937 1.00 0.00 H ATOM 2760 N ALA A 852 3.676 28.402 35.672 1.00 39.05 N ATOM 2761 CA ALA A 852 4.447 29.112 36.691 1.00 45.96 C ATOM 2762 C ALA A 852 3.544 30.113 37.396 1.00 48.04 C ATOM 2763 O ALA A 852 3.652 30.321 38.604 1.00 48.93 O ATOM 2764 CB ALA A 852 5.650 29.813 36.082 1.00 38.28 C ATOM 2765 H ALA A 852 3.936 28.500 34.670 1.00 0.00 H ATOM 2766 N LYS A 853 2.657 30.731 36.621 1.00 44.42 N ATOM 2767 CA LYS A 853 1.672 31.661 37.159 1.00 42.49 C ATOM 2768 C LYS A 853 0.772 30.990 38.193 1.00 45.30 C ATOM 2769 O LYS A 853 0.797 31.354 39.368 1.00 44.93 O ATOM 2770 CB LYS A 853 0.830 32.262 36.034 1.00 44.53 C ATOM 2771 CG LYS A 853 0.333 33.671 36.311 1.00 49.72 C ATOM 2772 CD LYS A 853 -0.273 34.277 35.055 1.00 54.49 C ATOM 2773 CE LYS A 853 -0.612 35.740 35.254 1.00 59.96 C ATOM 2774 NZ LYS A 853 0.603 36.553 35.525 1.00 60.83 N ATOM 2775 HZ1 LYS A 853 1.067 36.203 36.387 1.00 0.00 H ATOM 2776 HZ2 LYS A 853 1.258 36.474 34.721 1.00 0.00 H ATOM 2777 HZ3 LYS A 853 0.331 37.548 35.656 1.00 0.00 H ATOM 2778 H LYS A 853 2.667 30.545 35.598 1.00 0.00 H ATOM 2779 N VAL A 854 -0.019 30.012 37.753 1.00 43.60 N ATOM 2780 CA VAL A 854 -1.029 29.393 38.613 1.00 48.87 C ATOM 2781 C VAL A 854 -0.454 28.716 39.857 1.00 53.89 C ATOM 2782 O VAL A 854 -1.153 28.561 40.860 1.00 63.01 O ATOM 2783 CB VAL A 854 -1.869 28.346 37.841 1.00 47.04 C ATOM 2784 CG1 VAL A 854 -2.670 29.014 36.736 1.00 44.18 C ATOM 2785 CG2 VAL A 854 -0.984 27.239 37.284 1.00 40.74 C ATOM 2786 H VAL A 854 0.084 29.680 36.773 1.00 0.00 H ATOM 2787 N THR A 855 0.811 28.314 39.800 1.00 49.23 N ATOM 2788 CA THR A 855 1.435 27.644 40.939 1.00 52.83 C ATOM 2789 C THR A 855 2.204 28.614 41.832 1.00 48.80 C ATOM 2790 O THR A 855 2.808 28.202 42.823 1.00 49.80 O ATOM 2791 CB THR A 855 2.391 26.535 40.483 1.00 47.11 C ATOM 2792 OG1 THR A 855 3.424 27.106 39.674 1.00 50.13 O ATOM 2793 CG2 THR A 855 1.638 25.483 39.680 1.00 42.01 C ATOM 2794 HG1 THR A 855 3.019 27.542 38.883 1.00 0.00 H ATOM 2795 H THR A 855 1.364 28.478 38.934 1.00 0.00 H ATOM 2796 N LYS A 856 2.183 29.894 41.463 1.00 47.29 N ATOM 2797 CA LYS A 856 2.800 30.972 42.247 1.00 60.40 C ATOM 2798 C LYS A 856 4.316 30.810 42.354 1.00 57.06 C ATOM 2799 O LYS A 856 4.950 31.306 43.284 1.00 56.57 O ATOM 2800 CB LYS A 856 2.172 31.059 43.647 1.00 52.24 C ATOM 2801 CG LYS A 856 0.910 31.917 43.721 1.00 54.66 C ATOM 2802 CD LYS A 856 -0.171 31.429 42.768 1.00 53.77 C ATOM 2803 CE LYS A 856 -1.318 32.420 42.665 1.00 58.35 C ATOM 2804 NZ LYS A 856 -2.282 32.022 41.602 1.00 57.17 N ATOM 2805 HZ1 LYS A 856 -1.791 31.987 40.686 1.00 0.00 H ATOM 2806 HZ2 LYS A 856 -2.673 31.084 41.824 1.00 0.00 H ATOM 2807 HZ3 LYS A 856 -3.053 32.718 41.557 1.00 0.00 H ATOM 2808 H LYS A 856 1.705 30.143 40.574 1.00 0.00 H ATOM 2809 N GLU A 857 4.879 30.098 41.387 1.00 58.69 N ATOM 2810 CA GLU A 857 6.320 30.003 41.183 1.00 63.54 C ATOM 2811 C GLU A 857 6.743 31.037 40.131 1.00 68.33 C ATOM 2812 O GLU A 857 7.849 30.983 39.594 1.00 75.92 O ATOM 2813 CB GLU A 857 6.725 28.586 40.780 1.00 63.01 C ATOM 2814 CG GLU A 857 8.196 28.267 41.028 1.00 64.25 C ATOM 2815 CD GLU A 857 8.464 26.781 41.155 1.00 63.24 C ATOM 2816 OE1 GLU A 857 9.633 26.371 40.989 1.00 60.42 O ATOM 2817 OE2 GLU A 857 7.507 26.025 41.431 1.00 63.47 O ATOM 2818 H GLU A 857 4.257 29.577 40.736 1.00 0.00 H ATOM 2819 N GLU A 858 5.834 31.967 39.844 1.00 63.66 N ATOM 2820 CA GLU A 858 5.799 32.735 38.598 1.00 58.63 C ATOM 2821 C GLU A 858 7.114 33.324 38.104 1.00 55.26 C ATOM 2822 O GLU A 858 7.905 33.870 38.871 1.00 59.48 O ATOM 2823 CB GLU A 858 4.811 33.898 38.747 1.00 61.63 C ATOM 2824 CG GLU A 858 3.491 33.543 39.402 1.00 69.88 C ATOM 2825 CD GLU A 858 3.346 34.129 40.788 1.00 80.20 C ATOM 2826 OE1 GLU A 858 2.198 34.396 41.203 1.00 84.40 O ATOM 2827 OE2 GLU A 858 4.378 34.323 41.464 1.00 83.75 O ATOM 2828 H GLU A 858 5.099 32.161 40.553 1.00 0.00 H ATOM 2829 N ARG A 859 7.321 33.195 36.796 1.00 48.76 N ATOM 2830 CA ARG A 859 8.384 33.886 36.082 1.00 46.40 C ATOM 2831 C ARG A 859 7.742 34.743 34.990 1.00 41.31 C ATOM 2832 O ARG A 859 6.741 34.341 34.400 1.00 39.77 O ATOM 2833 CB ARG A 859 9.379 32.888 35.484 1.00 49.05 C ATOM 2834 CG ARG A 859 9.925 31.885 36.487 1.00 50.86 C ATOM 2835 CD ARG A 859 10.586 32.595 37.664 1.00 58.86 C ATOM 2836 NE ARG A 859 10.868 31.687 38.773 1.00 57.16 N ATOM 2837 CZ ARG A 859 11.921 30.878 38.819 1.00 60.17 C ATOM 2838 NH1 ARG A 859 12.786 30.863 37.814 1.00 62.12 N ATOM 2839 NH2 ARG A 859 12.107 30.081 39.864 1.00 57.85 N ATOM 2840 HE ARG A 859 10.205 31.673 39.574 1.00 0.00 H ATOM 2841 HH12 ARG A 859 13.611 30.231 37.847 1.00 0.00 H ATOM 2842 HH11 ARG A 859 12.639 31.483 36.992 1.00 0.00 H ATOM 2843 HH22 ARG A 859 12.933 29.449 39.896 1.00 0.00 H ATOM 2844 HH21 ARG A 859 11.427 30.088 40.651 1.00 0.00 H ATOM 2845 H ARG A 859 6.691 32.568 36.256 1.00 0.00 H ATOM 2846 N THR A 860 8.294 35.925 34.733 1.00 42.38 N ATOM 2847 CA THR A 860 7.751 36.786 33.686 1.00 47.21 C ATOM 2848 C THR A 860 7.999 36.169 32.304 1.00 45.73 C ATOM 2849 O THR A 860 8.998 35.472 32.105 1.00 41.28 O ATOM 2850 CB THR A 860 8.364 38.207 33.739 1.00 49.77 C ATOM 2851 OG1 THR A 860 9.721 38.167 33.284 1.00 52.49 O ATOM 2852 CG2 THR A 860 8.321 38.769 35.160 1.00 46.32 C ATOM 2853 HG1 THR A 860 9.746 37.834 32.352 1.00 0.00 H ATOM 2854 H THR A 860 9.119 36.239 35.282 1.00 0.00 H ATOM 2855 N PHE A 861 7.085 36.407 31.360 1.00 49.46 N ATOM 2856 CA PHE A 861 7.297 35.975 29.978 1.00 51.88 C ATOM 2857 C PHE A 861 8.589 36.565 29.428 1.00 52.25 C ATOM 2858 O PHE A 861 9.269 35.945 28.605 1.00 54.09 O ATOM 2859 CB PHE A 861 6.147 36.387 29.046 1.00 56.44 C ATOM 2860 CG PHE A 861 5.268 35.251 28.604 1.00 51.10 C ATOM 2861 CD1 PHE A 861 5.732 34.298 27.708 1.00 47.97 C ATOM 2862 CD2 PHE A 861 3.930 35.220 28.969 1.00 46.98 C ATOM 2863 CE1 PHE A 861 4.905 33.277 27.277 1.00 39.31 C ATOM 2864 CE2 PHE A 861 3.101 34.218 28.525 1.00 47.56 C ATOM 2865 CZ PHE A 861 3.597 33.225 27.672 1.00 45.21 C ATOM 2866 H PHE A 861 6.209 36.907 31.611 1.00 0.00 H ATOM 2867 N GLN A 862 8.912 37.775 29.876 1.00 56.87 N ATOM 2868 CA GLN A 862 10.108 38.461 29.412 1.00 52.46 C ATOM 2869 C GLN A 862 11.351 37.661 29.779 1.00 47.59 C ATOM 2870 O GLN A 862 12.190 37.410 28.917 1.00 48.89 O ATOM 2871 CB GLN A 862 10.177 39.883 29.982 1.00 48.27 C ATOM 2872 CG GLN A 862 9.261 40.868 29.264 1.00 54.40 C ATOM 2873 CD GLN A 862 9.502 42.316 29.665 1.00 66.21 C ATOM 2874 OE1 GLN A 862 10.002 42.600 30.754 1.00 72.93 O ATOM 2875 NE2 GLN A 862 9.148 43.239 28.777 1.00 67.14 N ATOM 2876 HE22 GLN A 862 8.729 42.953 27.869 1.00 0.00 H ATOM 2877 HE21 GLN A 862 9.290 44.247 28.990 1.00 0.00 H ATOM 2878 H GLN A 862 8.296 38.241 30.573 1.00 0.00 H ATOM 2879 N GLU A 863 11.459 37.236 31.037 1.00 45.58 N ATOM 2880 CA GLU A 863 12.614 36.433 31.442 1.00 47.41 C ATOM 2881 C GLU A 863 12.532 35.019 30.884 1.00 41.13 C ATOM 2882 O GLU A 863 13.556 34.388 30.633 1.00 38.91 O ATOM 2883 CB GLU A 863 12.776 36.416 32.965 1.00 50.96 C ATOM 2884 CG GLU A 863 11.659 35.774 33.755 1.00 57.88 C ATOM 2885 CD GLU A 863 11.863 35.954 35.249 1.00 65.43 C ATOM 2886 OE1 GLU A 863 13.006 36.250 35.652 1.00 73.17 O ATOM 2887 OE2 GLU A 863 10.889 35.820 36.016 1.00 63.17 O ATOM 2888 H GLU A 863 10.723 37.475 31.731 1.00 0.00 H ATOM 2889 N ILE A 864 11.315 34.531 30.676 1.00 41.33 N ATOM 2890 CA ILE A 864 11.113 33.254 30.002 1.00 38.32 C ATOM 2891 C ILE A 864 11.727 33.300 28.604 1.00 38.34 C ATOM 2892 O ILE A 864 12.443 32.385 28.196 1.00 40.27 O ATOM 2893 CB ILE A 864 9.617 32.900 29.914 1.00 33.81 C ATOM 2894 CG1 ILE A 864 9.127 32.377 31.265 1.00 34.94 C ATOM 2895 CG2 ILE A 864 9.365 31.856 28.835 1.00 36.81 C ATOM 2896 CD1 ILE A 864 7.655 32.064 31.301 1.00 33.89 C ATOM 2897 H ILE A 864 10.488 35.071 31.001 1.00 0.00 H ATOM 2898 N MET A 865 11.474 34.395 27.893 1.00 36.66 N ATOM 2899 CA MET A 865 11.942 34.541 26.520 1.00 39.94 C ATOM 2900 C MET A 865 13.437 34.885 26.385 1.00 36.68 C ATOM 2901 O MET A 865 14.071 34.465 25.416 1.00 34.56 O ATOM 2902 CB MET A 865 11.095 35.594 25.802 1.00 41.86 C ATOM 2903 CG MET A 865 9.736 35.068 25.328 1.00 36.10 C ATOM 2904 SD MET A 865 8.532 36.388 25.061 1.00 70.28 S ATOM 2905 CE MET A 865 9.603 37.731 24.557 1.00 67.16 C ATOM 2906 H MET A 865 10.929 35.167 28.327 1.00 0.00 H ATOM 2907 N LYS A 866 14.006 35.644 27.322 1.00 39.55 N ATOM 2908 CA LYS A 866 15.448 35.908 27.257 1.00 46.32 C ATOM 2909 C LYS A 866 16.215 34.606 27.509 1.00 50.31 C ATOM 2910 O LYS A 866 17.278 34.378 26.928 1.00 52.94 O ATOM 2911 CB LYS A 866 15.896 37.001 28.248 1.00 51.13 C ATOM 2912 CG LYS A 866 15.183 38.351 28.119 1.00 59.94 C ATOM 2913 CD LYS A 866 15.415 39.251 29.346 1.00 68.56 C ATOM 2914 CE LYS A 866 14.397 38.984 30.434 1.00 69.85 C ATOM 2915 NZ LYS A 866 14.151 40.102 31.388 1.00 68.51 N ATOM 2916 HZ1 LYS A 866 15.038 40.342 31.875 1.00 0.00 H ATOM 2917 HZ2 LYS A 866 13.805 40.932 30.866 1.00 0.00 H ATOM 2918 HZ3 LYS A 866 13.439 39.809 32.087 1.00 0.00 H ATOM 2919 H LYS A 866 13.433 36.045 28.092 1.00 0.00 H ATOM 2920 N SER A 867 15.658 33.748 28.359 1.00 49.67 N ATOM 2921 CA SER A 867 16.229 32.428 28.597 1.00 49.78 C ATOM 2922 C SER A 867 16.050 31.550 27.365 1.00 43.02 C ATOM 2923 O SER A 867 16.920 30.750 27.023 1.00 46.96 O ATOM 2924 CB SER A 867 15.580 31.772 29.816 1.00 51.00 C ATOM 2925 OG SER A 867 15.797 32.546 30.983 1.00 56.31 O ATOM 2926 HG SER A 867 15.404 33.446 30.858 1.00 0.00 H ATOM 2927 H SER A 867 14.794 34.026 28.866 1.00 0.00 H ATOM 2928 N TYR A 868 14.915 31.717 26.697 1.00 36.49 N ATOM 2929 CA TYR A 868 14.605 30.940 25.505 1.00 30.87 C ATOM 2930 C TYR A 868 15.531 31.262 24.338 1.00 39.62 C ATOM 2931 O TYR A 868 15.957 30.362 23.620 1.00 40.28 O ATOM 2932 CB TYR A 868 13.153 31.165 25.079 1.00 29.54 C ATOM 2933 CG TYR A 868 12.838 30.599 23.709 1.00 29.75 C ATOM 2934 CD1 TYR A 868 12.738 29.229 23.509 1.00 26.34 C ATOM 2935 CD2 TYR A 868 12.645 31.438 22.617 1.00 32.81 C ATOM 2936 CE1 TYR A 868 12.455 28.708 22.259 1.00 34.86 C ATOM 2937 CE2 TYR A 868 12.358 30.929 21.365 1.00 28.63 C ATOM 2938 CZ TYR A 868 12.268 29.562 21.191 1.00 35.78 C ATOM 2939 OH TYR A 868 11.989 29.050 19.945 1.00 40.60 O ATOM 2940 HH TYR A 868 11.960 28.062 19.994 1.00 0.00 H ATOM 2941 H TYR A 868 14.229 32.422 27.034 1.00 0.00 H ATOM 2942 N ARG A 869 15.848 32.542 24.160 1.00 47.27 N ATOM 2943 CA ARG A 869 16.575 33.009 22.978 1.00 52.31 C ATOM 2944 C ARG A 869 18.008 32.480 22.867 1.00 51.34 C ATOM 2945 O ARG A 869 18.617 32.547 21.799 1.00 55.76 O ATOM 2946 CB ARG A 869 16.596 34.539 22.945 1.00 59.03 C ATOM 2947 CG ARG A 869 16.884 35.114 21.564 1.00 64.43 C ATOM 2948 CD ARG A 869 16.918 36.638 21.556 1.00 71.21 C ATOM 2949 NE ARG A 869 17.143 37.224 22.875 1.00 75.63 N ATOM 2950 CZ ARG A 869 16.195 37.800 23.610 1.00 80.17 C ATOM 2951 NH1 ARG A 869 14.947 37.860 23.161 1.00 84.13 N ATOM 2952 NH2 ARG A 869 16.492 38.314 24.798 1.00 75.87 N ATOM 2953 HE ARG A 869 18.107 37.189 23.265 1.00 0.00 H ATOM 2954 HH12 ARG A 869 14.208 38.311 23.738 1.00 0.00 H ATOM 2955 HH11 ARG A 869 14.708 37.456 22.233 1.00 0.00 H ATOM 2956 HH22 ARG A 869 15.749 38.764 25.370 1.00 0.00 H ATOM 2957 HH21 ARG A 869 17.467 38.267 25.156 1.00 0.00 H ATOM 2958 H ARG A 869 15.570 33.234 24.885 1.00 0.00 H ATOM 2959 N ASN A 870 18.547 31.952 23.959 1.00 49.66 N ATOM 2960 CA ASN A 870 19.895 31.395 23.932 1.00 48.81 C ATOM 2961 C ASN A 870 19.916 29.961 23.405 1.00 51.48 C ATOM 2962 O ASN A 870 20.977 29.348 23.285 1.00 59.62 O ATOM 2963 CB ASN A 870 20.523 31.452 25.324 1.00 55.87 C ATOM 2964 CG ASN A 870 20.973 32.853 25.702 1.00 63.26 C ATOM 2965 OD1 ASN A 870 21.436 33.621 24.857 1.00 61.05 O ATOM 2966 ND2 ASN A 870 20.840 33.192 26.979 1.00 68.51 N ATOM 2967 HD22 ASN A 870 20.444 32.512 27.659 1.00 0.00 H ATOM 2968 HD21 ASN A 870 21.132 34.137 27.299 1.00 0.00 H ATOM 2969 H ASN A 870 18.002 31.935 24.844 1.00 0.00 H ATOM 2970 N GLN A 871 18.738 29.429 23.092 1.00 41.58 N ATOM 2971 CA GLN A 871 18.633 28.105 22.487 1.00 43.89 C ATOM 2972 C GLN A 871 18.881 28.194 20.977 1.00 49.14 C ATOM 2973 O GLN A 871 18.497 29.177 20.343 1.00 45.69 O ATOM 2974 CB GLN A 871 17.264 27.483 22.778 1.00 34.17 C ATOM 2975 CG GLN A 871 17.002 27.222 24.252 1.00 38.98 C ATOM 2976 CD GLN A 871 15.826 26.286 24.484 1.00 43.28 C ATOM 2977 OE1 GLN A 871 15.218 25.783 23.537 1.00 38.75 O ATOM 2978 NE2 GLN A 871 15.504 26.046 25.751 1.00 45.44 N ATOM 2979 HE22 GLN A 871 16.045 26.493 26.519 1.00 0.00 H ATOM 2980 HE21 GLN A 871 14.711 25.412 25.975 1.00 0.00 H ATOM 2981 H GLN A 871 17.870 29.970 23.283 1.00 0.00 H ATOM 2982 N PRO A 872 19.528 27.166 20.401 1.00 51.96 N ATOM 2983 CA PRO A 872 19.976 27.184 19.001 1.00 49.28 C ATOM 2984 C PRO A 872 18.873 27.488 17.990 1.00 44.26 C ATOM 2985 O PRO A 872 19.108 28.230 17.039 1.00 47.81 O ATOM 2986 CB PRO A 872 20.513 25.763 18.790 1.00 49.13 C ATOM 2987 CG PRO A 872 20.905 25.304 20.145 1.00 53.31 C ATOM 2988 CD PRO A 872 19.899 25.911 21.079 1.00 54.64 C ATOM 2989 N GLN A 873 17.688 26.923 18.189 1.00 40.63 N ATOM 2990 CA GLN A 873 16.604 27.091 17.229 1.00 35.26 C ATOM 2991 C GLN A 873 15.924 28.443 17.393 1.00 34.06 C ATOM 2992 O GLN A 873 15.200 28.897 16.509 1.00 29.76 O ATOM 2993 CB GLN A 873 15.572 25.964 17.376 1.00 29.56 C ATOM 2994 CG GLN A 873 14.673 26.077 18.607 1.00 27.72 C ATOM 2995 CD GLN A 873 15.391 25.758 19.904 1.00 26.51 C ATOM 2996 OE1 GLN A 873 16.589 25.494 19.914 1.00 29.26 O ATOM 2997 NE2 GLN A 873 14.655 25.777 21.007 1.00 25.82 N ATOM 2998 HE22 GLN A 873 13.642 26.006 20.952 1.00 0.00 H ATOM 2999 HE21 GLN A 873 15.091 25.563 21.927 1.00 0.00 H ATOM 3000 H GLN A 873 17.531 26.351 19.043 1.00 0.00 H ATOM 3001 N ALA A 874 16.178 29.101 18.517 1.00 40.19 N ATOM 3002 CA ALA A 874 15.430 30.301 18.848 1.00 45.49 C ATOM 3003 C ALA A 874 15.849 31.473 17.975 1.00 50.36 C ATOM 3004 O ALA A 874 17.003 31.893 17.976 1.00 54.65 O ATOM 3005 CB ALA A 874 15.609 30.648 20.317 1.00 43.86 C ATOM 3006 H ALA A 874 16.916 28.756 19.164 1.00 0.00 H ATOM 3007 N ASN A 875 14.879 31.994 17.233 1.00 48.59 N ATOM 3008 CA ASN A 875 15.052 33.204 16.451 1.00 43.92 C ATOM 3009 C ASN A 875 13.999 34.195 16.907 1.00 50.19 C ATOM 3010 O ASN A 875 13.001 33.800 17.510 1.00 53.74 O ATOM 3011 CB ASN A 875 14.933 32.921 14.951 1.00 38.36 C ATOM 3012 CG ASN A 875 16.078 32.079 14.424 1.00 43.46 C ATOM 3013 OD1 ASN A 875 15.957 30.859 14.284 1.00 40.40 O ATOM 3014 ND2 ASN A 875 17.203 32.727 14.133 1.00 47.21 N ATOM 3015 HD22 ASN A 875 17.259 33.757 14.267 1.00 0.00 H ATOM 3016 HD21 ASN A 875 18.026 32.204 13.772 1.00 0.00 H ATOM 3017 H ASN A 875 13.956 31.515 17.211 1.00 0.00 H ATOM 3018 N SER A 876 14.220 35.474 16.627 1.00 47.57 N ATOM 3019 CA SER A 876 13.347 36.525 17.133 1.00 47.01 C ATOM 3020 C SER A 876 11.891 36.318 16.723 1.00 39.63 C ATOM 3021 O SER A 876 10.984 36.563 17.516 1.00 36.23 O ATOM 3022 CB SER A 876 13.836 37.902 16.661 1.00 48.84 C ATOM 3023 OG SER A 876 13.785 38.024 15.249 1.00 45.18 O ATOM 3024 HG SER A 876 14.107 38.922 14.985 1.00 0.00 H ATOM 3025 H SER A 876 15.034 35.731 16.033 1.00 0.00 H ATOM 3026 N HIS A 877 11.673 35.840 15.501 1.00 32.66 N ATOM 3027 CA HIS A 877 10.323 35.751 14.952 1.00 37.61 C ATOM 3028 C HIS A 877 9.434 34.777 15.722 1.00 43.38 C ATOM 3029 O HIS A 877 8.209 34.861 15.650 1.00 41.18 O ATOM 3030 CB HIS A 877 10.372 35.352 13.472 1.00 39.46 C ATOM 3031 CG HIS A 877 10.738 33.919 13.236 1.00 47.32 C ATOM 3032 ND1 HIS A 877 9.824 32.891 13.331 1.00 52.63 N ATOM 3033 CD2 HIS A 877 11.917 33.344 12.897 1.00 50.06 C ATOM 3034 CE1 HIS A 877 10.425 31.744 13.067 1.00 50.82 C ATOM 3035 NE2 HIS A 877 11.695 31.991 12.801 1.00 52.42 N ATOM 3036 H HIS A 877 12.480 35.524 14.926 1.00 0.00 H ATOM 3037 N VAL A 878 10.049 33.861 16.463 1.00 37.30 N ATOM 3038 CA VAL A 878 9.289 32.841 17.173 1.00 34.24 C ATOM 3039 C VAL A 878 8.363 33.451 18.231 1.00 33.07 C ATOM 3040 O VAL A 878 7.194 33.077 18.306 1.00 29.65 O ATOM 3041 CB VAL A 878 10.222 31.796 17.822 1.00 29.86 C ATOM 3042 CG1 VAL A 878 9.431 30.826 18.693 1.00 24.70 C ATOM 3043 CG2 VAL A 878 10.987 31.038 16.739 1.00 28.25 C ATOM 3044 H VAL A 878 11.086 33.873 16.537 1.00 0.00 H ATOM 3045 N TYR A 879 8.877 34.342 19.077 1.00 32.72 N ATOM 3046 CA TYR A 879 8.004 35.051 20.019 1.00 34.64 C ATOM 3047 C TYR A 879 7.574 36.456 19.576 1.00 37.61 C ATOM 3048 O TYR A 879 6.659 37.039 20.157 1.00 40.75 O ATOM 3049 CB TYR A 879 8.689 35.146 21.382 1.00 33.69 C ATOM 3050 CG TYR A 879 10.103 35.647 21.282 1.00 42.76 C ATOM 3051 CD1 TYR A 879 10.371 37.007 21.245 1.00 42.60 C ATOM 3052 CD2 TYR A 879 11.172 34.763 21.205 1.00 46.94 C ATOM 3053 CE1 TYR A 879 11.658 37.474 21.147 1.00 45.21 C ATOM 3054 CE2 TYR A 879 12.467 35.222 21.105 1.00 49.57 C ATOM 3055 CZ TYR A 879 12.701 36.581 21.076 1.00 48.96 C ATOM 3056 OH TYR A 879 13.983 37.056 20.976 1.00 48.95 O ATOM 3057 HH TYR A 879 13.967 38.046 20.969 1.00 0.00 H ATOM 3058 H TYR A 879 9.899 34.535 19.070 1.00 0.00 H ATOM 3059 N ARG A 880 8.250 37.013 18.576 1.00 36.64 N ATOM 3060 CA ARG A 880 7.867 38.318 18.037 1.00 42.08 C ATOM 3061 C ARG A 880 6.797 38.233 16.947 1.00 40.78 C ATOM 3062 O ARG A 880 5.909 39.079 16.888 1.00 35.51 O ATOM 3063 CB ARG A 880 9.103 39.071 17.534 1.00 47.10 C ATOM 3064 CG ARG A 880 10.012 39.523 18.681 1.00 47.13 C ATOM 3065 CD ARG A 880 11.069 40.528 18.257 1.00 55.55 C ATOM 3066 NE ARG A 880 11.733 41.122 19.420 1.00 67.23 N ATOM 3067 CZ ARG A 880 12.970 40.832 19.818 1.00 71.99 C ATOM 3068 NH1 ARG A 880 13.707 39.963 19.143 1.00 74.63 N ATOM 3069 NH2 ARG A 880 13.479 41.423 20.891 1.00 71.25 N ATOM 3070 HE ARG A 880 11.199 41.821 19.975 1.00 0.00 H ATOM 3071 HH12 ARG A 880 14.672 39.742 19.461 1.00 0.00 H ATOM 3072 HH11 ARG A 880 13.320 39.501 18.295 1.00 0.00 H ATOM 3073 HH22 ARG A 880 14.445 41.196 21.201 1.00 0.00 H ATOM 3074 HH21 ARG A 880 12.912 42.114 21.422 1.00 0.00 H ATOM 3075 H ARG A 880 9.066 36.512 18.170 1.00 0.00 H ATOM 3076 N SER A 881 6.902 37.243 16.062 1.00 40.82 N ATOM 3077 CA SER A 881 5.901 37.076 15.010 1.00 36.97 C ATOM 3078 C SER A 881 5.140 35.759 15.141 1.00 36.97 C ATOM 3079 O SER A 881 5.637 34.699 14.765 1.00 40.10 O ATOM 3080 CB SER A 881 6.569 37.158 13.636 1.00 31.81 C ATOM 3081 OG SER A 881 5.609 37.073 12.598 1.00 33.85 O ATOM 3082 HG SER A 881 6.066 37.128 11.722 1.00 0.00 H ATOM 3083 H SER A 881 7.704 36.583 16.120 1.00 0.00 H ATOM 3084 N VAL A 882 3.900 35.840 15.603 1.00 32.43 N ATOM 3085 CA VAL A 882 3.122 34.648 15.898 1.00 31.14 C ATOM 3086 C VAL A 882 1.762 34.734 15.215 1.00 30.22 C ATOM 3087 O VAL A 882 1.160 35.803 15.153 1.00 29.32 O ATOM 3088 CB VAL A 882 2.931 34.456 17.419 1.00 33.47 C ATOM 3089 CG1 VAL A 882 2.202 33.148 17.713 1.00 27.24 C ATOM 3090 CG2 VAL A 882 4.273 34.486 18.131 1.00 37.27 C ATOM 3091 H VAL A 882 3.475 36.776 15.758 1.00 0.00 H ATOM 3092 N LEU A 883 1.284 33.609 14.695 1.00 30.17 N ATOM 3093 CA LEU A 883 0.002 33.588 14.009 1.00 23.28 C ATOM 3094 C LEU A 883 -1.145 33.801 14.990 1.00 29.34 C ATOM 3095 O LEU A 883 -1.268 33.074 15.976 1.00 25.49 O ATOM 3096 CB LEU A 883 -0.178 32.270 13.262 1.00 23.45 C ATOM 3097 CG LEU A 883 -1.502 32.104 12.520 1.00 30.30 C ATOM 3098 CD1 LEU A 883 -1.580 33.069 11.339 1.00 29.53 C ATOM 3099 CD2 LEU A 883 -1.668 30.664 12.069 1.00 23.44 C ATOM 3100 H LEU A 883 1.834 32.731 14.780 1.00 0.00 H ATOM 3101 N LEU A 884 -1.977 34.805 14.716 1.00 33.20 N ATOM 3102 CA LEU A 884 -3.137 35.103 15.552 1.00 36.85 C ATOM 3103 C LEU A 884 -4.420 34.545 14.938 1.00 51.93 C ATOM 3104 O LEU A 884 -5.070 33.679 15.519 1.00 55.76 O ATOM 3105 CB LEU A 884 -3.269 36.612 15.774 1.00 34.59 C ATOM 3106 CG LEU A 884 -2.120 37.265 16.547 1.00 35.91 C ATOM 3107 CD1 LEU A 884 -2.443 38.712 16.879 1.00 31.47 C ATOM 3108 CD2 LEU A 884 -1.777 36.474 17.813 1.00 28.34 C ATOM 3109 H LEU A 884 -1.795 35.396 13.880 1.00 0.00 H ATOM 3110 N LYS A 885 -4.789 35.048 13.766 1.00 59.17 N ATOM 3111 CA LYS A 885 -5.988 34.575 13.084 1.00 63.50 C ATOM 3112 C LYS A 885 -5.903 34.812 11.582 1.00 65.31 C ATOM 3113 O LYS A 885 -6.679 35.595 11.029 1.00 69.47 O ATOM 3114 CB LYS A 885 -7.231 35.261 13.653 1.00 20.00 C ATOM 3115 H LYS A 885 -4.212 35.793 13.326 1.00 0.00 H TER 3116 LYS A 885 ATOM 3117 N GLU A 926 -2.900 37.933 9.962 1.00 51.62 N ATOM 3118 CA GLU A 926 -2.650 38.748 11.147 1.00 55.87 C ATOM 3119 C GLU A 926 -1.684 38.061 12.108 1.00 52.15 C ATOM 3120 O GLU A 926 -1.856 36.885 12.456 1.00 35.47 O ATOM 3121 CB GLU A 926 -3.963 39.076 11.858 1.00 60.05 C ATOM 3122 CG GLU A 926 -4.544 40.426 11.463 1.00 70.07 C ATOM 3123 CD GLU A 926 -6.020 40.550 11.785 1.00 72.89 C ATOM 3124 OE1 GLU A 926 -6.629 39.536 12.187 1.00 75.44 O ATOM 3125 OE2 GLU A 926 -6.571 41.661 11.634 1.00 72.27 O ATOM 3126 HN3 GLU A 926 -3.314 37.023 10.249 1.00 0.00 H ATOM 3127 HN2 GLU A 926 -2.003 37.765 9.463 1.00 0.00 H ATOM 3128 HN1 GLU A 926 -3.561 38.432 9.333 1.00 0.00 H ATOM 3129 N ARG A 927 -0.658 38.802 12.519 1.00 49.08 N ATOM 3130 CA ARG A 927 0.365 38.271 13.413 1.00 42.24 C ATOM 3131 C ARG A 927 0.688 39.268 14.516 1.00 42.35 C ATOM 3132 O ARG A 927 0.539 40.476 14.340 1.00 49.26 O ATOM 3133 CB ARG A 927 1.636 37.911 12.635 1.00 31.41 C ATOM 3134 CG ARG A 927 1.390 37.026 11.411 1.00 29.84 C ATOM 3135 CD ARG A 927 2.684 36.592 10.744 1.00 29.68 C ATOM 3136 NE ARG A 927 3.407 35.600 11.534 1.00 31.85 N ATOM 3137 CZ ARG A 927 3.212 34.286 11.449 1.00 39.29 C ATOM 3138 NH1 ARG A 927 2.311 33.795 10.609 1.00 39.80 N ATOM 3139 NH2 ARG A 927 3.918 33.458 12.204 1.00 34.65 N ATOM 3140 HE ARG A 927 4.122 35.942 12.208 1.00 0.00 H ATOM 3141 HH12 ARG A 927 2.163 32.767 10.547 1.00 0.00 H ATOM 3142 HH11 ARG A 927 1.752 34.438 10.012 1.00 0.00 H ATOM 3143 HH22 ARG A 927 3.763 32.432 12.135 1.00 0.00 H ATOM 3144 HH21 ARG A 927 4.627 33.834 12.866 1.00 0.00 H ATOM 3145 H ARG A 927 -0.583 39.787 12.194 1.00 0.00 H ATOM 3146 N GLY A 928 1.127 38.752 15.657 1.00 35.99 N ATOM 3147 CA GLY A 928 1.470 39.578 16.797 1.00 36.48 C ATOM 3148 C GLY A 928 2.535 38.861 17.592 1.00 38.20 C ATOM 3149 O GLY A 928 2.912 37.747 17.238 1.00 39.24 O ATOM 3150 H GLY A 928 1.228 37.720 15.736 1.00 0.00 H ATOM 3151 N ASP A 929 3.032 39.479 18.658 1.00 40.50 N ATOM 3152 CA ASP A 929 4.069 38.822 19.445 1.00 42.86 C ATOM 3153 C ASP A 929 3.458 37.725 20.311 1.00 38.38 C ATOM 3154 O ASP A 929 2.240 37.516 20.292 1.00 31.79 O ATOM 3155 CB ASP A 929 4.853 39.835 20.290 1.00 44.06 C ATOM 3156 CG ASP A 929 3.980 40.631 21.244 1.00 48.24 C ATOM 3157 OD1 ASP A 929 3.140 40.038 21.950 1.00 47.33 O ATOM 3158 OD2 ASP A 929 4.155 41.867 21.304 1.00 60.77 O ATOM 3159 H ASP A 929 2.685 40.421 18.928 1.00 0.00 H ATOM 3160 N LEU A 930 4.299 37.028 21.070 1.00 29.58 N ATOM 3161 CA LEU A 930 3.852 35.841 21.796 1.00 32.12 C ATOM 3162 C LEU A 930 2.850 36.186 22.893 1.00 34.26 C ATOM 3163 O LEU A 930 1.947 35.401 23.189 1.00 35.45 O ATOM 3164 CB LEU A 930 5.047 35.100 22.395 1.00 28.03 C ATOM 3165 CG LEU A 930 4.746 33.700 22.940 1.00 27.15 C ATOM 3166 CD1 LEU A 930 4.144 32.812 21.859 1.00 26.56 C ATOM 3167 CD2 LEU A 930 6.009 33.069 23.506 1.00 35.56 C ATOM 3168 H LEU A 930 5.290 37.333 21.148 1.00 0.00 H ATOM 3169 N ILE A 931 3.018 37.365 23.484 1.00 33.91 N ATOM 3170 CA ILE A 931 2.172 37.820 24.581 1.00 38.13 C ATOM 3171 C ILE A 931 0.732 38.025 24.120 1.00 39.19 C ATOM 3172 O ILE A 931 -0.213 37.661 24.821 1.00 36.50 O ATOM 3173 CB ILE A 931 2.709 39.134 25.188 1.00 41.87 C ATOM 3174 CG1 ILE A 931 4.157 38.947 25.659 1.00 45.47 C ATOM 3175 CG2 ILE A 931 1.812 39.620 26.327 1.00 38.20 C ATOM 3176 CD1 ILE A 931 4.802 40.221 26.182 1.00 48.96 C ATOM 3177 H ILE A 931 3.782 37.987 23.151 1.00 0.00 H ATOM 3178 N LYS A 932 0.573 38.604 22.935 1.00 39.07 N ATOM 3179 CA LYS A 932 -0.750 38.823 22.374 1.00 36.81 C ATOM 3180 C LYS A 932 -1.405 37.485 22.037 1.00 40.25 C ATOM 3181 O LYS A 932 -2.612 37.314 22.214 1.00 41.77 O ATOM 3182 CB LYS A 932 -0.673 39.714 21.132 1.00 35.48 C ATOM 3183 CG LYS A 932 -2.035 40.119 20.587 1.00 41.01 C ATOM 3184 CD LYS A 932 -1.924 41.251 19.579 1.00 49.13 C ATOM 3185 CE LYS A 932 -3.295 41.638 19.045 1.00 55.73 C ATOM 3186 NZ LYS A 932 -3.232 42.787 18.097 1.00 61.71 N ATOM 3187 HZ1 LYS A 932 -2.831 43.614 18.583 1.00 0.00 H ATOM 3188 HZ2 LYS A 932 -2.631 42.534 17.287 1.00 0.00 H ATOM 3189 HZ3 LYS A 932 -4.191 43.011 17.762 1.00 0.00 H ATOM 3190 H LYS A 932 1.411 38.906 22.398 1.00 0.00 H ATOM 3191 N PHE A 933 -0.601 36.538 21.560 1.00 36.30 N ATOM 3192 CA PHE A 933 -1.094 35.192 21.275 1.00 34.74 C ATOM 3193 C PHE A 933 -1.614 34.529 22.544 1.00 33.48 C ATOM 3194 O PHE A 933 -2.693 33.938 22.554 1.00 31.67 O ATOM 3195 CB PHE A 933 -0.001 34.325 20.645 1.00 26.37 C ATOM 3196 CG PHE A 933 -0.310 32.851 20.666 1.00 30.13 C ATOM 3197 CD1 PHE A 933 -1.232 32.309 19.785 1.00 32.25 C ATOM 3198 CD2 PHE A 933 0.318 32.008 21.570 1.00 30.62 C ATOM 3199 CE1 PHE A 933 -1.522 30.949 19.804 1.00 32.92 C ATOM 3200 CE2 PHE A 933 0.036 30.648 21.592 1.00 31.93 C ATOM 3201 CZ PHE A 933 -0.886 30.120 20.708 1.00 28.14 C ATOM 3202 H PHE A 933 0.400 36.761 21.386 1.00 0.00 H ATOM 3203 N TYR A 934 -0.831 34.636 23.610 1.00 32.74 N ATOM 3204 CA TYR A 934 -1.194 34.070 24.901 1.00 29.27 C ATOM 3205 C TYR A 934 -2.532 34.606 25.403 1.00 32.25 C ATOM 3206 O TYR A 934 -3.420 33.838 25.768 1.00 34.27 O ATOM 3207 CB TYR A 934 -0.093 34.358 25.925 1.00 36.30 C ATOM 3208 CG TYR A 934 -0.438 33.926 27.328 1.00 33.87 C ATOM 3209 CD1 TYR A 934 -0.310 32.599 27.716 1.00 36.31 C ATOM 3210 CD2 TYR A 934 -0.889 34.843 28.265 1.00 33.04 C ATOM 3211 CE1 TYR A 934 -0.625 32.198 28.996 1.00 33.62 C ATOM 3212 CE2 TYR A 934 -1.200 34.452 29.543 1.00 34.05 C ATOM 3213 CZ TYR A 934 -1.072 33.128 29.903 1.00 33.08 C ATOM 3214 OH TYR A 934 -1.386 32.734 31.180 1.00 47.61 O ATOM 3215 HH TYR A 934 -2.336 32.944 31.365 1.00 0.00 H ATOM 3216 H TYR A 934 0.073 35.142 23.520 1.00 0.00 H ATOM 3217 N ASN A 935 -2.675 35.927 25.403 1.00 36.99 N ATOM 3218 CA ASN A 935 -3.873 36.571 25.930 1.00 34.24 C ATOM 3219 C ASN A 935 -5.137 36.272 25.123 1.00 36.91 C ATOM 3220 O ASN A 935 -6.153 35.868 25.683 1.00 38.78 O ATOM 3221 CB ASN A 935 -3.666 38.088 26.007 1.00 36.19 C ATOM 3222 CG ASN A 935 -2.771 38.500 27.162 1.00 40.55 C ATOM 3223 OD1 ASN A 935 -2.935 38.029 28.287 1.00 40.40 O ATOM 3224 ND2 ASN A 935 -1.818 39.386 26.888 1.00 44.96 N ATOM 3225 HD22 ASN A 935 -1.716 39.758 25.922 1.00 0.00 H ATOM 3226 HD21 ASN A 935 -1.175 39.707 27.640 1.00 0.00 H ATOM 3227 H ASN A 935 -1.912 36.518 25.017 1.00 0.00 H ATOM 3228 N THR A 936 -5.073 36.468 23.810 1.00 37.35 N ATOM 3229 CA THR A 936 -6.272 36.397 22.979 1.00 33.20 C ATOM 3230 C THR A 936 -6.640 34.980 22.531 1.00 41.37 C ATOM 3231 O THR A 936 -7.749 34.744 22.057 1.00 43.83 O ATOM 3232 CB THR A 936 -6.127 37.278 21.720 1.00 33.47 C ATOM 3233 OG1 THR A 936 -4.997 36.842 20.956 1.00 38.19 O ATOM 3234 CG2 THR A 936 -5.947 38.747 22.101 1.00 35.58 C ATOM 3235 HG1 THR A 936 -4.178 36.918 21.507 1.00 0.00 H ATOM 3236 H THR A 936 -4.155 36.675 23.367 1.00 0.00 H ATOM 3237 N ILE A 937 -5.718 34.038 22.674 1.00 41.59 N ATOM 3238 CA ILE A 937 -5.952 32.685 22.172 1.00 39.39 C ATOM 3239 C ILE A 937 -5.688 31.610 23.219 1.00 37.58 C ATOM 3240 O ILE A 937 -6.595 30.874 23.613 1.00 39.00 O ATOM 3241 CB ILE A 937 -5.081 32.387 20.936 1.00 38.25 C ATOM 3242 CG1 ILE A 937 -5.368 33.392 19.821 1.00 43.69 C ATOM 3243 CG2 ILE A 937 -5.324 30.971 20.445 1.00 37.42 C ATOM 3244 CD1 ILE A 937 -4.473 33.227 18.617 1.00 47.00 C ATOM 3245 H ILE A 937 -4.820 34.264 23.148 1.00 0.00 H ATOM 3246 N TYR A 938 -4.435 31.525 23.654 1.00 30.53 N ATOM 3247 CA TYR A 938 -3.982 30.444 24.519 1.00 30.96 C ATOM 3248 C TYR A 938 -4.737 30.346 25.847 1.00 28.18 C ATOM 3249 O TYR A 938 -5.122 29.254 26.256 1.00 29.83 O ATOM 3250 CB TYR A 938 -2.485 30.595 24.794 1.00 35.73 C ATOM 3251 CG TYR A 938 -1.878 29.413 25.518 1.00 34.15 C ATOM 3252 CD1 TYR A 938 -1.374 28.330 24.815 1.00 27.56 C ATOM 3253 CD2 TYR A 938 -1.813 29.383 26.907 1.00 36.06 C ATOM 3254 CE1 TYR A 938 -0.816 27.249 25.474 1.00 31.28 C ATOM 3255 CE2 TYR A 938 -1.263 28.309 27.572 1.00 34.44 C ATOM 3256 CZ TYR A 938 -0.767 27.246 26.853 1.00 29.04 C ATOM 3257 OH TYR A 938 -0.211 26.181 27.518 1.00 26.43 O ATOM 3258 HH TYR A 938 0.095 25.507 26.861 1.00 0.00 H ATOM 3259 H TYR A 938 -3.754 32.256 23.367 1.00 0.00 H ATOM 3260 N VAL A 939 -4.938 31.475 26.520 1.00 29.87 N ATOM 3261 CA VAL A 939 -5.594 31.465 27.827 1.00 36.88 C ATOM 3262 C VAL A 939 -6.987 30.859 27.743 1.00 39.23 C ATOM 3263 O VAL A 939 -7.314 29.944 28.493 1.00 46.69 O ATOM 3264 CB VAL A 939 -5.708 32.876 28.430 1.00 46.06 C ATOM 3265 CG1 VAL A 939 -6.516 32.835 29.719 1.00 52.14 C ATOM 3266 CG2 VAL A 939 -4.335 33.446 28.701 1.00 46.12 C ATOM 3267 H VAL A 939 -4.624 32.378 26.111 1.00 0.00 H ATOM 3268 N GLY A 940 -7.794 31.359 26.815 1.00 37.27 N ATOM 3269 CA GLY A 940 -9.154 30.880 26.651 1.00 42.67 C ATOM 3270 C GLY A 940 -9.248 29.371 26.512 1.00 41.64 C ATOM 3271 O GLY A 940 -10.147 28.744 27.070 1.00 45.28 O ATOM 3272 H GLY A 940 -7.443 32.113 26.190 1.00 0.00 H ATOM 3273 N ARG A 941 -8.307 28.785 25.781 1.00 41.93 N ATOM 3274 CA ARG A 941 -8.340 27.353 25.512 1.00 37.50 C ATOM 3275 C ARG A 941 -7.835 26.512 26.685 1.00 42.71 C ATOM 3276 O ARG A 941 -8.430 25.487 27.016 1.00 53.48 O ATOM 3277 CB ARG A 941 -7.525 27.039 24.256 1.00 32.62 C ATOM 3278 CG ARG A 941 -8.056 27.688 22.983 1.00 27.71 C ATOM 3279 CD ARG A 941 -9.352 27.038 22.516 1.00 30.19 C ATOM 3280 NE ARG A 941 -9.202 25.597 22.301 1.00 31.25 N ATOM 3281 CZ ARG A 941 -8.718 25.046 21.188 1.00 36.08 C ATOM 3282 NH1 ARG A 941 -8.324 25.807 20.175 1.00 35.15 N ATOM 3283 NH2 ARG A 941 -8.619 23.726 21.089 1.00 34.08 N ATOM 3284 HE ARG A 941 -9.493 24.960 23.070 1.00 0.00 H ATOM 3285 HH12 ARG A 941 -7.948 25.368 19.311 1.00 0.00 H ATOM 3286 HH11 ARG A 941 -8.392 26.842 20.245 1.00 0.00 H ATOM 3287 HH22 ARG A 941 -8.241 23.297 20.220 1.00 0.00 H ATOM 3288 HH21 ARG A 941 -8.919 23.121 21.880 1.00 0.00 H ATOM 3289 H ARG A 941 -7.531 29.359 25.393 1.00 0.00 H ATOM 3290 N VAL A 942 -6.737 26.938 27.303 1.00 39.66 N ATOM 3291 CA VAL A 942 -6.074 26.130 28.329 1.00 37.93 C ATOM 3292 C VAL A 942 -6.395 26.507 29.789 1.00 43.70 C ATOM 3293 O VAL A 942 -5.985 25.804 30.715 1.00 44.10 O ATOM 3294 CB VAL A 942 -4.540 26.190 28.125 1.00 35.86 C ATOM 3295 CG1 VAL A 942 -3.851 24.987 28.759 1.00 40.85 C ATOM 3296 CG2 VAL A 942 -4.217 26.230 26.634 1.00 33.43 C ATOM 3297 H VAL A 942 -6.340 27.866 27.052 1.00 0.00 H ATOM 3298 N LYS A 943 -7.147 27.581 30.010 1.00 44.17 N ATOM 3299 CA LYS A 943 -7.313 28.085 31.378 1.00 56.49 C ATOM 3300 C LYS A 943 -8.091 27.110 32.258 1.00 62.36 C ATOM 3301 O LYS A 943 -7.856 27.037 33.462 1.00 64.63 O ATOM 3302 CB LYS A 943 -7.996 29.459 31.387 1.00 55.81 C ATOM 3303 CG LYS A 943 -9.508 29.443 31.531 1.00 58.46 C ATOM 3304 CD LYS A 943 -10.113 30.769 31.090 1.00 62.72 C ATOM 3305 CE LYS A 943 -11.476 31.005 31.726 1.00 66.61 C ATOM 3306 NZ LYS A 943 -11.438 30.902 33.216 1.00 66.99 N ATOM 3307 HZ1 LYS A 943 -11.117 29.951 33.488 1.00 0.00 H ATOM 3308 HZ2 LYS A 943 -10.780 31.613 33.595 1.00 0.00 H ATOM 3309 HZ3 LYS A 943 -12.390 31.071 33.598 1.00 0.00 H ATOM 3310 H LYS A 943 -7.616 28.062 29.216 1.00 0.00 H ATOM 3311 N SER A 944 -9.000 26.352 31.654 1.00 65.44 N ATOM 3312 CA SER A 944 -9.767 25.362 32.397 1.00 62.15 C ATOM 3313 C SER A 944 -8.824 24.294 32.944 1.00 53.10 C ATOM 3314 O SER A 944 -8.902 23.927 34.113 1.00 52.90 O ATOM 3315 CB SER A 944 -10.846 24.733 31.514 1.00 66.98 C ATOM 3316 OG SER A 944 -11.738 23.949 32.286 1.00 74.22 O ATOM 3317 HG SER A 944 -12.425 23.554 31.693 1.00 0.00 H ATOM 3318 H SER A 944 -9.166 26.468 30.634 1.00 0.00 H ATOM 3319 N PHE A 945 -7.935 23.801 32.088 1.00 51.12 N ATOM 3320 CA PHE A 945 -6.979 22.774 32.483 1.00 43.36 C ATOM 3321 C PHE A 945 -5.957 23.321 33.473 1.00 43.79 C ATOM 3322 O PHE A 945 -5.570 22.639 34.422 1.00 48.33 O ATOM 3323 CB PHE A 945 -6.267 22.204 31.254 1.00 41.21 C ATOM 3324 CG PHE A 945 -5.119 21.294 31.586 1.00 37.85 C ATOM 3325 CD1 PHE A 945 -5.301 19.922 31.651 1.00 41.29 C ATOM 3326 CD2 PHE A 945 -3.858 21.810 31.834 1.00 37.20 C ATOM 3327 CE1 PHE A 945 -4.247 19.083 31.957 1.00 44.21 C ATOM 3328 CE2 PHE A 945 -2.800 20.975 32.140 1.00 40.63 C ATOM 3329 CZ PHE A 945 -2.995 19.610 32.201 1.00 39.47 C ATOM 3330 H PHE A 945 -7.921 24.157 31.111 1.00 0.00 H ATOM 3331 N ALA A 946 -5.522 24.556 33.246 1.00 43.40 N ATOM 3332 CA ALA A 946 -4.544 25.197 34.117 1.00 46.69 C ATOM 3333 C ALA A 946 -5.126 25.461 35.502 1.00 48.31 C ATOM 3334 O ALA A 946 -4.625 24.950 36.504 1.00 49.80 O ATOM 3335 CB ALA A 946 -4.046 26.492 33.493 1.00 45.77 C ATOM 3336 H ALA A 946 -5.889 25.079 32.425 1.00 0.00 H ATOM 3337 N LEU A 947 -6.185 26.261 35.550 1.00 51.36 N ATOM 3338 CA LEU A 947 -6.836 26.595 36.812 1.00 58.00 C ATOM 3339 C LEU A 947 -7.031 25.356 37.678 1.00 60.30 C ATOM 3340 O LEU A 947 -7.418 25.455 38.842 1.00 63.14 O ATOM 3341 CB LEU A 947 -8.183 27.275 36.556 1.00 58.87 C ATOM 3342 CG LEU A 947 -8.135 28.763 36.203 1.00 57.87 C ATOM 3343 CD1 LEU A 947 -9.539 29.344 36.133 1.00 60.43 C ATOM 3344 CD2 LEU A 947 -7.283 29.527 37.205 1.00 53.45 C ATOM 3345 H LEU A 947 -6.560 26.659 34.665 1.00 0.00 H ATOM 3346 N LYS A 948 -6.760 24.189 37.103 1.00 58.31 N ATOM 3347 CA LYS A 948 -6.905 22.928 37.821 1.00 57.26 C ATOM 3348 C LYS A 948 -5.630 22.575 38.579 1.00 66.23 C ATOM 3349 O LYS A 948 -5.453 21.439 39.019 1.00 72.77 O ATOM 3350 CB LYS A 948 -7.272 21.800 36.855 1.00 20.00 C ATOM 3351 H LYS A 948 -6.436 24.175 36.115 1.00 0.00 H ATOM 3352 N TYR A 949 -4.746 23.555 38.729 1.00 66.59 N ATOM 3353 CA TYR A 949 -3.486 23.349 39.434 1.00 65.27 C ATOM 3354 C TYR A 949 -3.135 24.555 40.299 1.00 67.27 C ATOM 3355 O TYR A 949 -3.489 25.688 39.975 1.00 66.73 O ATOM 3356 CB TYR A 949 -2.356 23.068 38.441 1.00 20.00 C ATOM 3357 CG TYR A 949 -2.505 21.760 37.698 1.00 20.00 C ATOM 3358 CD1 TYR A 949 -1.697 20.672 37.999 1.00 20.00 C ATOM 3359 CD2 TYR A 949 -3.455 21.613 36.695 1.00 20.00 C ATOM 3360 CE1 TYR A 949 -1.830 19.474 37.322 1.00 20.00 C ATOM 3361 CE2 TYR A 949 -3.595 20.419 36.013 1.00 20.00 C ATOM 3362 CZ TYR A 949 -2.780 19.353 36.331 1.00 20.00 C ATOM 3363 OH TYR A 949 -2.916 18.163 35.654 1.00 20.00 O ATOM 3364 HH TYR A 949 -2.260 17.509 36.003 1.00 0.00 H ATOM 3365 H TYR A 949 -4.958 24.493 38.334 1.00 0.00 H TER 3366 TYR A 949 ATOM 3367 N PRO A 962 -3.917 14.537 37.475 1.00 73.20 N ATOM 3368 CA PRO A 962 -2.742 13.682 37.273 1.00 72.91 C ATOM 3369 C PRO A 962 -1.672 14.356 36.418 1.00 68.86 C ATOM 3370 O PRO A 962 -1.999 15.124 35.512 1.00 71.16 O ATOM 3371 CB PRO A 962 -3.320 12.457 36.557 1.00 72.13 C ATOM 3372 CG PRO A 962 -4.523 12.975 35.847 1.00 69.13 C ATOM 3373 CD PRO A 962 -5.096 14.041 36.742 1.00 70.95 C ATOM 3374 HN2 PRO A 962 -3.695 15.497 37.143 1.00 0.00 H ATOM 3375 HN1 PRO A 962 -4.141 14.566 38.490 1.00 0.00 H ATOM 3376 N LEU A 963 -0.407 14.067 36.704 1.00 62.48 N ATOM 3377 CA LEU A 963 0.693 14.655 35.952 1.00 57.67 C ATOM 3378 C LEU A 963 1.317 13.635 35.004 1.00 59.26 C ATOM 3379 O LEU A 963 1.359 12.439 35.296 1.00 63.78 O ATOM 3380 CB LEU A 963 1.753 15.221 36.898 1.00 57.08 C ATOM 3381 CG LEU A 963 1.324 16.431 37.732 1.00 63.04 C ATOM 3382 CD1 LEU A 963 2.478 16.955 38.574 1.00 64.15 C ATOM 3383 CD2 LEU A 963 0.762 17.529 36.838 1.00 62.52 C ATOM 3384 H LEU A 963 -0.198 13.408 37.481 1.00 0.00 H ATOM 3385 N SER A 964 1.793 14.122 33.863 1.00 55.86 N ATOM 3386 CA SER A 964 2.367 13.269 32.830 1.00 52.03 C ATOM 3387 C SER A 964 3.833 12.939 33.115 1.00 57.89 C ATOM 3388 O SER A 964 4.533 13.714 33.764 1.00 58.79 O ATOM 3389 CB SER A 964 2.237 13.947 31.463 1.00 45.41 C ATOM 3390 OG SER A 964 0.881 14.210 31.151 1.00 48.17 O ATOM 3391 HG SER A 964 0.826 14.647 30.264 1.00 0.00 H ATOM 3392 H SER A 964 1.755 15.149 33.701 1.00 0.00 H ATOM 3393 N PRO A 965 4.299 11.776 32.636 1.00 63.58 N ATOM 3394 CA PRO A 965 5.713 11.420 32.797 1.00 70.39 C ATOM 3395 C PRO A 965 6.637 12.300 31.957 1.00 66.39 C ATOM 3396 O PRO A 965 6.380 12.535 30.769 1.00 57.66 O ATOM 3397 CB PRO A 965 5.765 9.964 32.317 1.00 73.27 C ATOM 3398 CG PRO A 965 4.612 9.839 31.374 1.00 71.43 C ATOM 3399 CD PRO A 965 3.535 10.711 31.962 1.00 68.25 C ATOM 3400 N PHE A 966 7.714 12.770 32.576 1.00 68.00 N ATOM 3401 CA PHE A 966 8.698 13.585 31.878 1.00 58.10 C ATOM 3402 C PHE A 966 9.838 12.710 31.362 1.00 55.47 C ATOM 3403 O PHE A 966 10.538 12.072 32.148 1.00 61.11 O ATOM 3404 CB PHE A 966 9.231 14.687 32.798 1.00 53.39 C ATOM 3405 CG PHE A 966 10.000 15.752 32.076 1.00 51.72 C ATOM 3406 CD1 PHE A 966 11.321 16.011 32.394 1.00 55.90 C ATOM 3407 CD2 PHE A 966 9.405 16.479 31.060 1.00 43.42 C ATOM 3408 CE1 PHE A 966 12.029 16.988 31.720 1.00 53.06 C ATOM 3409 CE2 PHE A 966 10.108 17.454 30.386 1.00 38.56 C ATOM 3410 CZ PHE A 966 11.419 17.710 30.714 1.00 43.48 C ATOM 3411 H PHE A 966 7.858 12.551 33.582 1.00 0.00 H ATOM 3412 N PRO A 967 10.018 12.675 30.032 1.00 54.54 N ATOM 3413 CA PRO A 967 11.006 11.832 29.343 1.00 57.40 C ATOM 3414 C PRO A 967 12.425 11.992 29.884 1.00 58.71 C ATOM 3415 O PRO A 967 12.753 13.068 30.378 1.00 58.87 O ATOM 3416 CB PRO A 967 10.927 12.318 27.893 1.00 53.07 C ATOM 3417 CG PRO A 967 9.545 12.849 27.756 1.00 51.16 C ATOM 3418 CD PRO A 967 9.218 13.470 29.082 1.00 49.88 C TER 3419 PRO A 967 HETATM 3420 O HOH 1 12.650 25.464 8.948 1.00 46.37 O HETATM 3421 O HOH 2 29.065 -3.164 -3.010 1.00 42.66 O HETATM 3422 O HOH 3 15.404 30.023 -8.329 1.00 35.33 O HETATM 3423 O HOH 4 31.568 6.035 3.825 1.00 31.40 O HETATM 3424 O HOH 5 12.333 -13.632 -4.199 1.00 30.76 O HETATM 3425 O HOH 6 28.006 0.627 -3.001 1.00 29.41 O HETATM 3426 O HOH 7 13.167 6.965 10.658 1.00 33.68 O HETATM 3427 O HOH 8 11.427 25.748 12.047 1.00 30.68 O HETATM 3428 O HOH 9 14.663 11.064 11.141 1.00 23.45 O HETATM 3429 O HOH 10 -0.603 10.998 6.247 1.00 28.02 O HETATM 3430 O HOH 11 26.510 9.366 10.096 1.00 23.40 O HETATM 3431 O HOH 12 8.548 16.655 -9.931 1.00 22.35 O HETATM 3432 O HOH 13 -0.908 17.758 18.611 1.00 19.57 O HETATM 3433 O HOH 14 -3.146 11.943 0.774 1.00 29.92 O HETATM 3434 O HOH 15 -8.868 4.550 10.511 1.00 19.91 O HETATM 3435 O HOH 16 31.891 24.033 0.764 1.00 28.24 O HETATM 3436 O HOH 17 19.067 -1.584 7.068 1.00 26.00 O HETATM 3437 O HOH 18 16.269 -3.623 9.703 1.00 41.80 O HETATM 3438 O HOH 19 -3.204 7.360 11.508 1.00 22.60 O HETATM 3439 O HOH 20 14.675 28.181 4.903 1.00 43.21 O HETATM 3440 O HOH 21 9.609 2.591 -5.556 1.00 20.15 O HETATM 3441 O HOH 22 -9.150 23.815 28.862 1.00 42.70 O HETATM 3442 O HOH 23 2.054 30.972 10.591 1.00 30.69 O HETATM 3443 O HOH 24 27.043 4.785 -5.621 1.00 18.01 O HETATM 3444 O HOH 25 1.151 24.629 25.912 1.00 24.31 O HETATM 3445 O HOH 26 2.466 27.218 7.539 1.00 31.66 O HETATM 3446 O HOH 27 7.700 18.411 -7.462 1.00 23.44 O HETATM 3447 O HOH 28 29.257 1.962 1.275 1.00 33.85 O HETATM 3448 O HOH 29 -1.014 8.737 28.933 1.00 47.27 O HETATM 3449 O HOH 30 9.249 0.471 -14.795 1.00 44.91 O HETATM 3450 O HOH 31 -6.614 16.087 11.536 1.00 21.52 O HETATM 3451 O HOH 32 21.285 1.123 8.107 1.00 42.22 O HETATM 3452 O HOH 33 11.195 -1.718 -11.270 1.00 24.91 O HETATM 3453 O HOH 34 19.441 5.978 -11.983 1.00 34.80 O HETATM 3454 O HOH 35 5.044 3.722 -3.318 1.00 30.36 O HETATM 3455 O HOH 36 -9.626 -2.376 13.328 1.00 34.62 O HETATM 3456 O HOH 37 16.853 25.613 6.968 1.00 32.47 O HETATM 3457 O HOH 38 7.102 32.654 13.735 1.00 32.11 O HETATM 3458 O HOH 39 -9.625 24.108 25.001 1.00 45.41 O HETATM 3459 O HOH 40 10.219 -4.069 -5.292 1.00 31.13 O HETATM 3460 O HOH 41 -7.926 33.830 25.332 1.00 43.27 O HETATM 3461 O HOH 42 12.722 -2.299 7.517 1.00 48.92 O HETATM 3462 O HOH 43 24.953 30.232 1.059 1.00 24.54 O HETATM 3463 O HOH 44 33.368 9.099 -7.691 1.00 46.72 O HETATM 3464 O HOH 45 -3.931 27.843 13.183 1.00 27.53 O HETATM 3465 O HOH 46 3.570 25.364 11.280 1.00 15.53 O HETATM 3466 O HOH 47 16.994 27.795 -7.891 1.00 21.69 O HETATM 3467 O HOH 48 16.335 -10.690 0.993 1.00 35.00 O HETATM 3468 O HOH 49 1.915 11.332 29.157 1.00 36.96 O HETATM 3469 O HOH 50 16.913 22.696 0.474 1.00 12.02 O HETATM 3470 O HOH 51 -8.408 6.449 17.315 1.00 31.10 O HETATM 3471 O HOH 52 17.821 16.549 17.082 1.00 41.00 O HETATM 3472 O HOH 53 27.215 0.926 0.255 1.00 32.00 O HETATM 3473 O HOH 54 3.104 31.114 14.892 1.00 26.73 O HETATM 3474 O HOH 55 24.866 0.696 -5.016 1.00 29.52 O HETATM 3475 O HOH 56 18.467 20.080 27.532 1.00 47.40 O HETATM 3476 O HOH 57 26.429 4.216 2.885 1.00 32.37 O HETATM 3477 O HOH 58 7.347 20.366 1.327 1.00 29.02 O HETATM 3478 O HOH 59 10.425 -8.279 -11.367 1.00 35.08 O HETATM 3479 O HOH 60 14.076 28.615 -6.396 1.00 30.55 O HETATM 3480 O HOH 61 18.136 -12.301 1.196 1.00 19.17 O HETATM 3481 O HOH 62 14.449 28.392 0.775 1.00 36.38 O HETATM 3482 O HOH 63 27.809 2.226 -7.541 1.00 28.58 O HETATM 3483 O HOH 64 29.259 -5.137 -5.950 1.00 44.07 O HETATM 3484 O HOH 65 5.455 22.332 -3.549 1.00 30.41 O HETATM 3485 O HOH 66 18.886 9.551 -13.482 1.00 31.56 O HETATM 3486 O HOH 67 5.512 8.994 -2.695 1.00 28.50 O HETATM 3487 O HOH 68 13.532 14.537 18.456 1.00 33.39 O HETATM 3488 O HOH 69 12.293 27.597 -8.733 1.00 42.88 O HETATM 3489 O HOH 70 8.612 18.699 -13.736 1.00 31.43 O HETATM 3490 O HOH 71 -6.680 13.504 21.463 1.00 25.08 O HETATM 3491 O HOH 72 8.320 19.339 -15.815 1.00 37.32 O HETATM 3492 O HOH 73 5.104 13.728 -0.337 1.00 26.92 O HETATM 3493 O HOH 74 4.705 30.564 12.642 1.00 40.05 O HETATM 3494 O HOH 75 16.558 21.632 20.658 1.00 47.18 O HETATM 3495 O HOH 76 -4.504 26.973 42.555 1.00 47.38 O HETATM 3496 O HOH 77 17.088 15.873 36.324 1.00 50.36 O HETATM 3497 O HOH 78 9.551 -6.653 1.836 1.00 31.18 O HETATM 3498 O HOH 79 5.527 9.847 9.560 1.00 29.84 O HETATM 3499 O HOH 80 3.583 19.250 -1.414 1.00 42.88 O HETATM 3500 O HOH 81 14.808 -9.178 -12.515 1.00 30.77 O HETATM 3501 O HOH 82 20.829 23.756 2.188 1.00 36.70 O HETATM 3502 O HOH 83 25.798 22.266 10.834 1.00 27.40 O HETATM 3503 O HOH 84 6.978 0.860 -18.341 1.00 41.98 O HETATM 3504 O HOH 85 41.483 19.395 -1.640 1.00 34.03 O HETATM 3505 O HOH 86 0.000 19.508 0.000 1.00 48.94 O HETATM 3506 O HOH 87 34.607 8.498 2.953 1.00 45.49 O HETATM 3507 O HOH 88 3.132 2.490 25.995 1.00 44.45 O HETATM 3508 O HOH 89 21.720 24.382 9.710 1.00 41.38 O HETATM 3509 O HOH 90 32.711 18.468 10.754 1.00 36.68 O HETATM 3510 O HOH 91 6.049 22.831 5.333 1.00 28.94 O HETATM 3511 O HOH 92 38.122 13.887 3.994 1.00 37.82 O HETATM 3512 O HOH 93 28.625 9.824 11.606 1.00 51.13 O HETATM 3513 O HOH 94 17.103 37.051 15.137 1.00 40.87 O HETATM 3514 O HOH 95 38.678 11.834 -2.830 1.00 43.85 O HETATM 3515 O HOH 96 26.216 8.259 14.282 1.00 56.63 O HETATM 3516 O HOH 97 24.492 27.276 27.284 1.00 67.59 O HETATM 3517 O HOH 98 9.216 -6.747 7.174 1.00 55.34 O HETATM 3518 O HOH 99 44.048 28.053 1.891 1.00 52.05 O HETATM 3519 O HOH 100 7.758 22.450 3.346 1.00 37.33 O HETATM 3520 O HOH 101 12.249 18.896 42.954 1.00 43.31 O HETATM 3521 O HOH 102 17.887 23.120 23.845 1.00 57.19 O HETATM 3522 O HOH 103 27.301 2.074 -4.897 1.00 21.20 O HETATM 3523 O HOH 104 3.990 27.084 9.414 1.00 37.77 O HETATM 3524 O HOH 105 41.105 18.644 0.706 1.00 43.50 O HETATM 3525 O HOH 106 10.247 26.527 -4.311 1.00 36.48 O HETATM 3526 O HOH 107 30.398 -0.860 -4.211 1.00 37.53 O HETATM 3527 O HOH 108 -3.061 9.166 5.441 1.00 43.50 O HETATM 3528 O HOH 109 33.327 2.916 -1.124 1.00 37.42 O HETATM 3529 O HOH 110 18.764 12.081 18.861 1.00 49.35 O HETATM 3530 O HOH 111 -3.964 42.998 28.302 1.00 39.94 O HETATM 3531 N ASP A 112 -6.793 37.955 35.304 1.00 0.24 N HETATM 3532 CA ASP A 112 -5.889 37.393 36.301 1.00 0.08 C HETATM 3533 C ASP A 112 -4.802 36.543 35.654 1.00 0.23 C HETATM 3534 O ASP A 112 -3.615 36.728 35.925 1.00 -0.39 O HETATM 3535 N ASP A 112 -5.210 35.613 34.797 1.00 -0.26 N HETATM 3536 CA ASP A 112 -4.257 34.755 34.102 1.00 0.13 C HETATM 3537 C ASP A 112 -3.691 35.440 32.863 1.00 0.20 C HETATM 3538 O ASP A 112 -2.863 34.871 32.154 1.00 -0.39 O HETATM 3539 N ASP A 112 -4.145 36.661 32.607 1.00 -0.26 N HETATM 3540 CA ASP A 112 -3.668 37.428 31.466 1.00 0.14 C HETATM 3541 C ASP A 112 -2.292 38.027 31.747 1.00 0.21 C HETATM 3542 O ASP A 112 -1.926 38.255 32.900 1.00 -0.39 O HETATM 3543 N ASP A 112 -1.527 38.267 30.687 1.00 -0.26 N HETATM 3544 CA ASP A 112 -0.179 38.807 30.826 1.00 0.14 C HETATM 3545 C ASP A 112 -0.144 40.297 30.492 1.00 0.20 C HETATM 3546 O ASP A 112 -0.449 40.706 29.373 1.00 -0.39 O HETATM 3547 N ASP A 112 0.230 41.101 31.477 1.00 -0.26 N HETATM 3548 CA ASP A 112 0.176 42.550 31.347 1.00 0.14 C HETATM 3549 C ASP A 112 1.518 43.145 30.941 1.00 0.21 C HETATM 3550 O ASP A 112 1.679 44.362 30.891 1.00 -0.39 O HETATM 3551 N ASP A 112 2.482 42.273 30.667 1.00 -0.26 N HETATM 3552 CA ASP A 112 3.784 42.694 30.169 1.00 0.13 C HETATM 3553 C ASP A 112 3.702 43.118 28.705 1.00 0.20 C HETATM 3554 O ASP A 112 2.770 42.746 27.995 1.00 -0.39 O HETATM 3555 N ASP A 112 4.681 43.909 28.270 1.00 -0.26 N HETATM 3556 CA ASP A 112 4.838 44.298 26.868 1.00 0.13 C HETATM 3557 C ASP A 112 6.305 44.070 26.445 1.00 0.20 C HETATM 3558 O ASP A 112 7.101 43.558 27.233 1.00 -0.39 O HETATM 3559 N ASP A 112 6.666 44.451 25.220 1.00 -0.26 N HETATM 3560 CA ASP A 112 8.014 44.180 24.699 1.00 0.13 C HETATM 3561 C ASP A 112 8.651 45.456 24.082 1.00 0.20 C HETATM 3562 O ASP A 112 7.943 46.448 23.903 1.00 -0.39 O HETATM 3563 N ASP A 112 9.961 45.487 23.784 1.00 -0.27 N HETATM 3564 CA ASP A 112 10.911 44.360 23.808 1.00 0.11 C HETATM 3565 C ASP A 112 11.226 43.794 25.187 1.00 0.06 C HETATM 3566 O ASP A 112 11.442 44.533 26.145 1.00 -0.57 O HETATM 3567 OXT ASP A 112 11.273 42.582 25.383 1.00 -0.57 O HETATM 3568 CB ASP A 112 12.224 44.771 23.129 1.00 0.07 C HETATM 3569 CG ASP A 112 12.005 45.368 21.751 1.00 0.18 C HETATM 3570 OD1 ASP A 112 10.871 45.501 21.303 1.00 -0.40 O HETATM 3571 ND2 ASP A 112 13.093 45.693 21.055 1.00 -0.30 N HETATM 3572 H70 ASP A 112 13.002 46.090 20.142 1.00 0.18 H HETATM 3573 H71 ASP A 112 14.001 45.540 21.446 1.00 0.18 H HETATM 3574 H68 ASP A 112 12.863 43.881 23.030 1.00 0.05 H HETATM 3575 H69 ASP A 112 12.729 45.517 23.760 1.00 0.05 H HETATM 3576 H67 ASP A 112 10.459 43.547 23.220 1.00 0.08 H HETATM 3577 H66 ASP A 112 10.334 46.375 23.515 1.00 0.19 H HETATM 3578 CB ASP A 112 7.955 42.992 23.710 1.00 -0.01 C HETATM 3579 CG ASP A 112 7.474 42.899 22.260 1.00 -0.04 C HETATM 3580 CD1 ASP A 112 8.400 43.567 21.274 1.00 -0.06 C HETATM 3581 H60 ASP A 112 7.992 43.461 20.258 1.00 0.02 H HETATM 3582 H61 ASP A 112 9.391 43.093 21.323 1.00 0.02 H HETATM 3583 H62 ASP A 112 8.492 44.635 21.522 1.00 0.02 H HETATM 3584 CD2 ASP A 112 7.398 41.427 21.944 1.00 -0.06 C HETATM 3585 H63 ASP A 112 6.724 40.933 22.659 1.00 0.02 H HETATM 3586 H64 ASP A 112 8.402 40.983 22.019 1.00 0.02 H HETATM 3587 H65 ASP A 112 7.013 41.291 20.923 1.00 0.02 H HETATM 3588 H59 ASP A 112 6.478 43.358 22.176 1.00 0.03 H HETATM 3589 H57 ASP A 112 7.341 42.246 24.236 1.00 0.03 H HETATM 3590 H58 ASP A 112 8.997 42.642 23.662 1.00 0.03 H HETATM 3591 H56 ASP A 112 8.649 43.877 25.545 1.00 0.08 H HETATM 3592 H55 ASP A 112 6.006 44.932 24.643 1.00 0.19 H HETATM 3593 CB ASP A 112 4.414 45.758 26.669 1.00 0.00 C HETATM 3594 CG ASP A 112 3.545 46.308 27.808 1.00 0.04 C HETATM 3595 CD ASP A 112 3.424 47.820 27.796 1.00 0.17 C HETATM 3596 OE1 ASP A 112 3.780 48.472 26.816 1.00 -0.40 O HETATM 3597 NE2 ASP A 112 2.943 48.388 28.899 1.00 -0.30 N HETATM 3598 H53 ASP A 112 2.842 49.382 28.946 1.00 0.18 H HETATM 3599 H54 ASP A 112 2.683 47.821 29.681 1.00 0.18 H HETATM 3600 H51 ASP A 112 3.990 46.001 28.766 1.00 0.05 H HETATM 3601 H52 ASP A 112 2.537 45.877 27.717 1.00 0.05 H HETATM 3602 H49 ASP A 112 3.844 45.829 25.731 1.00 0.03 H HETATM 3603 H50 ASP A 112 5.321 46.376 26.594 1.00 0.03 H HETATM 3604 H48 ASP A 112 4.190 43.661 26.247 1.00 0.08 H HETATM 3605 H47 ASP A 112 5.343 44.255 28.935 1.00 0.19 H HETATM 3606 CB ASP A 112 4.802 41.563 30.330 1.00 -0.00 C HETATM 3607 CG ASP A 112 4.772 40.902 31.694 1.00 0.00 C HETATM 3608 CD ASP A 112 5.613 39.640 31.754 1.00 0.04 C HETATM 3609 OE1 ASP A 112 6.743 39.653 31.222 1.00 -0.57 O HETATM 3610 OE2 ASP A 112 5.143 38.636 32.330 1.00 -0.57 O HETATM 3611 H45 ASP A 112 3.731 40.642 31.936 1.00 0.04 H HETATM 3612 H46 ASP A 112 5.155 41.615 32.439 1.00 0.04 H HETATM 3613 H43 ASP A 112 5.808 41.976 30.167 1.00 0.03 H HETATM 3614 H44 ASP A 112 4.593 40.797 29.569 1.00 0.03 H HETATM 3615 H42 ASP A 112 4.121 43.557 30.763 1.00 0.08 H HETATM 3616 H41 ASP A 112 2.308 41.298 30.807 1.00 0.19 H HETATM 3617 CB ASP A 112 -0.329 43.153 32.654 1.00 0.02 C HETATM 3618 CG ASP A 112 -1.729 42.680 32.960 1.00 -0.05 C HETATM 3619 CD1 ASP A 112 -2.837 43.382 32.496 1.00 -0.07 C HETATM 3620 CE1 ASP A 112 -4.125 42.939 32.753 1.00 -0.04 C HETATM 3621 CZ ASP A 112 -4.314 41.772 33.467 1.00 0.08 C HETATM 3622 CE2 ASP A 112 -3.228 41.049 33.922 1.00 -0.04 C HETATM 3623 CD2 ASP A 112 -1.947 41.501 33.663 1.00 -0.07 C HETATM 3624 H37 ASP A 112 -1.098 40.926 34.014 1.00 0.05 H HETATM 3625 H39 ASP A 112 -3.379 40.132 34.479 1.00 0.05 H HETATM 3626 OH ASP A 112 -5.589 41.323 33.728 1.00 -0.34 O HETATM 3627 H40 ASP A 112 -6.219 41.926 33.352 1.00 0.25 H HETATM 3628 H38 ASP A 112 -4.978 43.505 32.396 1.00 0.05 H HETATM 3629 H36 ASP A 112 -2.691 44.291 31.924 1.00 0.05 H HETATM 3630 H34 ASP A 112 -0.330 44.250 32.568 1.00 0.05 H HETATM 3631 H35 ASP A 112 0.340 42.850 33.473 1.00 0.05 H HETATM 3632 H33 ASP A 112 -0.548 42.793 30.555 1.00 0.08 H HETATM 3633 H32 ASP A 112 0.558 40.701 32.333 1.00 0.19 H HETATM 3634 CB ASP A 112 0.801 38.046 29.938 1.00 0.03 C HETATM 3635 SG ASP A 112 2.489 38.665 30.039 1.00 -0.17 S HETATM 3636 H31 ASP A 112 3.082 38.121 29.431 1.00 0.10 H HETATM 3637 H29 ASP A 112 0.462 38.128 28.895 1.00 0.04 H HETATM 3638 H30 ASP A 112 0.799 36.989 30.243 1.00 0.04 H HETATM 3639 H28 ASP A 112 0.134 38.681 31.873 1.00 0.08 H HETATM 3640 H27 ASP A 112 -1.884 38.073 29.773 1.00 0.19 H HETATM 3641 CB ASP A 112 -4.671 38.528 31.108 1.00 0.02 C HETATM 3642 CG ASP A 112 -6.009 37.999 30.635 1.00 -0.05 C HETATM 3643 CD1 ASP A 112 -6.117 37.298 29.438 1.00 -0.07 C HETATM 3644 CE1 ASP A 112 -7.336 36.813 28.998 1.00 -0.04 C HETATM 3645 CZ ASP A 112 -8.468 37.029 29.755 1.00 0.08 C HETATM 3646 CE2 ASP A 112 -8.391 37.723 30.946 1.00 -0.04 C HETATM 3647 CD2 ASP A 112 -7.167 38.205 31.379 1.00 -0.07 C HETATM 3648 H23 ASP A 112 -7.110 38.752 32.313 1.00 0.05 H HETATM 3649 H25 ASP A 112 -9.283 37.890 31.539 1.00 0.05 H HETATM 3650 OH ASP A 112 -9.682 36.548 29.316 1.00 -0.34 O HETATM 3651 H26 ASP A 112 -9.562 36.098 28.488 1.00 0.25 H HETATM 3652 H24 ASP A 112 -7.401 36.267 28.064 1.00 0.05 H HETATM 3653 H22 ASP A 112 -5.230 37.129 28.839 1.00 0.05 H HETATM 3654 H20 ASP A 112 -4.239 39.145 30.307 1.00 0.05 H HETATM 3655 H21 ASP A 112 -4.839 39.149 32.000 1.00 0.05 H HETATM 3656 H19 ASP A 112 -3.578 36.748 30.606 1.00 0.08 H HETATM 3657 H18 ASP A 112 -4.831 37.063 33.213 1.00 0.19 H HETATM 3658 CB ASP A 112 -4.903 33.424 33.717 1.00 -0.01 C HETATM 3659 CG ASP A 112 -4.712 32.284 34.718 1.00 -0.04 C HETATM 3660 CD1 ASP A 112 -5.274 30.976 34.174 1.00 -0.06 C HETATM 3661 H12 ASP A 112 -5.123 30.176 34.914 1.00 0.02 H HETATM 3662 H13 ASP A 112 -4.755 30.714 33.240 1.00 0.02 H HETATM 3663 H14 ASP A 112 -6.350 31.093 33.976 1.00 0.02 H HETATM 3664 CD2 ASP A 112 -3.239 32.142 35.065 1.00 -0.06 C HETATM 3665 H15 ASP A 112 -2.860 33.099 35.454 1.00 0.02 H HETATM 3666 H16 ASP A 112 -2.675 31.864 34.163 1.00 0.02 H HETATM 3667 H17 ASP A 112 -3.116 31.361 35.829 1.00 0.02 H HETATM 3668 H11 ASP A 112 -5.261 32.536 35.637 1.00 0.03 H HETATM 3669 H9 ASP A 112 -4.475 33.105 32.755 1.00 0.03 H HETATM 3670 H10 ASP A 112 -5.983 33.593 33.599 1.00 0.03 H HETATM 3671 H8 ASP A 112 -3.424 34.547 34.789 1.00 0.08 H HETATM 3672 H7 ASP A 112 -6.189 35.499 34.625 1.00 0.19 H HETATM 3673 CB ASP A 112 -6.667 36.560 37.320 1.00 0.06 C HETATM 3674 CG ASP A 112 -7.608 37.399 38.162 1.00 0.04 C HETATM 3675 OD1 ASP A 112 -7.240 37.736 39.308 1.00 -0.57 O HETATM 3676 OD2 ASP A 112 -8.715 37.724 37.681 1.00 -0.57 O HETATM 3677 H5 ASP A 112 -5.950 36.059 37.987 1.00 0.05 H HETATM 3678 H6 ASP A 112 -7.256 35.804 36.781 1.00 0.05 H HETATM 3679 H4 ASP A 112 -5.404 38.226 36.831 1.00 0.11 H HETATM 3680 H1 ASP A 112 -7.498 38.510 35.764 1.00 0.20 H HETATM 3681 H2 ASP A 112 -7.235 37.208 34.792 1.00 0.20 H HETATM 3682 H3 ASP A 112 -6.271 38.536 34.667 1.00 0.20 H CONECT 1 2 10 11 12 CONECT 10 1 CONECT 11 1 CONECT 12 1 CONECT 2009 2010 2019 2020 2021 CONECT 2019 2009 CONECT 2020 2009 CONECT 2021 2009 CONECT 3117 3118 3126 3127 3128 CONECT 3126 3117 CONECT 3127 3117 CONECT 3128 3117 CONECT 3367 3368 3373 3374 3375 CONECT 3374 3367 CONECT 3375 3367 CONECT 3531 3532 3680 3681 3682 CONECT 3532 3531 3533 3673 3679 CONECT 3533 3532 3534 3535 CONECT 3534 3533 CONECT 3535 3533 3536 3672 CONECT 3536 3535 3537 3658 3671 CONECT 3537 3536 3538 3539 CONECT 3538 3537 CONECT 3539 3537 3540 3657 CONECT 3540 3539 3541 3641 3656 CONECT 3541 3540 3542 3543 CONECT 3542 3541 CONECT 3543 3541 3544 3640 CONECT 3544 3543 3545 3634 3639 CONECT 3545 3544 3546 3547 CONECT 3546 3545 CONECT 3547 3545 3548 3633 CONECT 3548 3547 3549 3617 3632 CONECT 3549 3548 3550 3551 CONECT 3550 3549 CONECT 3551 3549 3552 3616 CONECT 3552 3551 3553 3606 3615 CONECT 3553 3552 3554 3555 CONECT 3554 3553 CONECT 3555 3553 3556 3605 CONECT 3556 3555 3557 3593 3604 CONECT 3557 3556 3558 3559 CONECT 3558 3557 CONECT 3559 3557 3560 3592 CONECT 3560 3559 3561 3578 3591 CONECT 3561 3560 3562 3563 CONECT 3562 3561 CONECT 3563 3561 3564 3577 CONECT 3564 3563 3565 3568 3576 CONECT 3565 3564 3566 3567 CONECT 3566 3565 CONECT 3567 3565 CONECT 3568 3564 3569 3574 3575 CONECT 3569 3568 3570 3571 CONECT 3570 3569 CONECT 3571 3569 3572 3573 CONECT 3572 3571 CONECT 3573 3571 CONECT 3574 3568 CONECT 3575 3568 CONECT 3576 3564 CONECT 3577 3563 CONECT 3578 3560 3579 3589 3590 CONECT 3579 3578 3580 3584 3588 CONECT 3580 3579 3581 3582 3583 CONECT 3581 3580 CONECT 3582 3580 CONECT 3583 3580 CONECT 3584 3579 3585 3586 3587 CONECT 3585 3584 CONECT 3586 3584 CONECT 3587 3584 CONECT 3588 3579 CONECT 3589 3578 CONECT 3590 3578 CONECT 3591 3560 CONECT 3592 3559 CONECT 3593 3556 3594 3602 3603 CONECT 3594 3593 3595 3600 3601 CONECT 3595 3594 3596 3597 CONECT 3596 3595 CONECT 3597 3595 3598 3599 CONECT 3598 3597 CONECT 3599 3597 CONECT 3600 3594 CONECT 3601 3594 CONECT 3602 3593 CONECT 3603 3593 CONECT 3604 3556 CONECT 3605 3555 CONECT 3606 3552 3607 3613 3614 CONECT 3607 3606 3608 3611 3612 CONECT 3608 3607 3609 3610 CONECT 3609 3608 CONECT 3610 3608 CONECT 3611 3607 CONECT 3612 3607 CONECT 3613 3606 CONECT 3614 3606 CONECT 3615 3552 CONECT 3616 3551 CONECT 3617 3548 3618 3630 3631 CONECT 3618 3617 3619 3623 CONECT 3619 3618 3620 3629 CONECT 3620 3619 3621 3628 CONECT 3621 3620 3622 3626 CONECT 3622 3621 3623 3625 CONECT 3623 3618 3622 3624 CONECT 3624 3623 CONECT 3625 3622 CONECT 3626 3621 3627 CONECT 3627 3626 CONECT 3628 3620 CONECT 3629 3619 CONECT 3630 3617 CONECT 3631 3617 CONECT 3632 3548 CONECT 3633 3547 CONECT 3634 3544 3635 3637 3638 CONECT 3635 3634 3636 CONECT 3636 3635 CONECT 3637 3634 CONECT 3638 3634 CONECT 3639 3544 CONECT 3640 3543 CONECT 3641 3540 3642 3654 3655 CONECT 3642 3641 3643 3647 CONECT 3643 3642 3644 3653 CONECT 3644 3643 3645 3652 CONECT 3645 3644 3646 3650 CONECT 3646 3645 3647 3649 CONECT 3647 3642 3646 3648 CONECT 3648 3647 CONECT 3649 3646 CONECT 3650 3645 3651 CONECT 3651 3650 CONECT 3652 3644 CONECT 3653 3643 CONECT 3654 3641 CONECT 3655 3641 CONECT 3656 3540 CONECT 3657 3539 CONECT 3658 3536 3659 3669 3670 CONECT 3659 3658 3660 3664 3668 CONECT 3660 3659 3661 3662 3663 CONECT 3661 3660 CONECT 3662 3660 CONECT 3663 3660 CONECT 3664 3659 3665 3666 3667 CONECT 3665 3664 CONECT 3666 3664 CONECT 3667 3664 CONECT 3668 3659 CONECT 3669 3658 CONECT 3670 3658 CONECT 3671 3536 CONECT 3672 3535 CONECT 3673 3532 3674 3677 3678 CONECT 3674 3673 3675 3676 CONECT 3675 3674 CONECT 3676 3674 CONECT 3677 3673 CONECT 3678 3673 CONECT 3679 3532 CONECT 3680 3531 CONECT 3681 3531 CONECT 3682 3531 MASTER 0 0 0 0 0 0 0 0 3678 4 167 28 END
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Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1bmb
RCSB PDB
PDBbind
9-mer
1f90
RCSB PDB
PDBbind
9-mer
1fzk
RCSB PDB
PDBbind
9-mer
1fzo
RCSB PDB
PDBbind
9-mer
1g3f
RCSB PDB
PDBbind
9-mer
1g7p
RCSB PDB
PDBbind
9-mer
1gux
RCSB PDB
PDBbind
9-mer
1gwq
RCSB PDB
PDBbind
9-mer
1h24
RCSB PDB
PDBbind
9-mer
1inq
RCSB PDB
PDBbind
9-mer
1jp5
RCSB PDB
PDBbind
9-mer
1juf
RCSB PDB
PDBbind
9-mer
1kl3
RCSB PDB
PDBbind
9-mer
1kl5
RCSB PDB
PDBbind
9-mer
1lb6
RCSB PDB
PDBbind
9-mer
1mfg
RCSB PDB
PDBbind
9-mer
1mpa
RCSB PDB
PDBbind
9-mer
1nlo
RCSB PDB
PDBbind
9-mer
1oai
RCSB PDB
PDBbind
9-mer
1oxn
RCSB PDB
PDBbind
9-mer
1oxq
RCSB PDB
PDBbind
9-mer
1oy7
RCSB PDB
PDBbind
9-mer
1pcg
RCSB PDB
PDBbind
9-mer
1prl
RCSB PDB
PDBbind
9-mer
1prm
RCSB PDB
PDBbind
9-mer
1rlp
RCSB PDB
PDBbind
9-mer
1rlq
RCSB PDB
PDBbind
9-mer
1rst
RCSB PDB
PDBbind
9-mer
1utc
RCSB PDB
PDBbind
9-mer
1vwf
RCSB PDB
PDBbind
9-mer
1vwl
RCSB PDB
PDBbind
9-mer
1x7q
RCSB PDB
PDBbind
9-mer
1xr8
RCSB PDB
PDBbind
9-mer
1xr9
RCSB PDB
PDBbind
9-mer
1zea
RCSB PDB
PDBbind
9-mer
2bgn
RCSB PDB
PDBbind
9-mer
2bgr
RCSB PDB
PDBbind
9-mer
2e7l
RCSB PDB
PDBbind
9-mer
2gv2
RCSB PDB
PDBbind
9-mer
2h6q
RCSB PDB
PDBbind
9-mer
2hkf
RCSB PDB
PDBbind
9-mer
2jo9
RCSB PDB
PDBbind
9-mer
2jup
RCSB PDB
PDBbind
9-mer
2kgi
RCSB PDB
PDBbind
9-mer
2khh
RCSB PDB
PDBbind
9-mer
2lnw
RCSB PDB
PDBbind
9-mer
2lsv
RCSB PDB
PDBbind
9-mer
2mpa
RCSB PDB
PDBbind
9-mer
2ms4
RCSB PDB
PDBbind
9-mer
2oei
RCSB PDB
PDBbind
9-mer
2oi9
RCSB PDB
PDBbind
9-mer
2q8y
RCSB PDB
PDBbind
9-mer
2qt5
RCSB PDB
PDBbind
9-mer
2rm0
RCSB PDB
PDBbind
9-mer
2v83
RCSB PDB
PDBbind
9-mer
2v86
RCSB PDB
PDBbind
9-mer
2vpe
RCSB PDB
PDBbind
9-mer
2w0z
RCSB PDB
PDBbind
9-mer
2x3t
RCSB PDB
PDBbind
9-mer
2x4o
RCSB PDB
PDBbind
9-mer
2x4r
RCSB PDB
PDBbind
9-mer
2x4s
RCSB PDB
PDBbind
9-mer
2x4t
RCSB PDB
PDBbind
9-mer
2x4u
RCSB PDB
PDBbind
9-mer
2xhs
RCSB PDB
PDBbind
9-mer
2ymt
RCSB PDB
PDBbind
9-mer
3ah8
RCSB PDB
PDBbind
9-mer
3bgm
RCSB PDB
PDBbind
9-mer
3bze
RCSB PDB
PDBbind
9-mer
3bzf
RCSB PDB
PDBbind
9-mer
3bzi
RCSB PDB
PDBbind
9-mer
3cii
RCSB PDB
PDBbind
9-mer
3cyy
RCSB PDB
PDBbind
9-mer
3d1f
RCSB PDB
PDBbind
9-mer
3d25
RCSB PDB
PDBbind
9-mer
3drg
RCSB PDB
PDBbind
9-mer
3ery
RCSB PDB
PDBbind
9-mer
3fbr
RCSB PDB
PDBbind
9-mer
3fn0
RCSB PDB
PDBbind
9-mer
3ft2
RCSB PDB
PDBbind
9-mer
3ft3
RCSB PDB
PDBbind
9-mer
3ft4
RCSB PDB
PDBbind
9-mer
3gl6
RCSB PDB
PDBbind
9-mer
3iet
RCSB PDB
PDBbind
9-mer
3k27
RCSB PDB
PDBbind
9-mer
3lqi
RCSB PDB
PDBbind
9-mer
3lqj
RCSB PDB
PDBbind
9-mer
3mxc
RCSB PDB
PDBbind
9-mer
3mxy
RCSB PDB
PDBbind
9-mer
3o4l
RCSB PDB
PDBbind
9-mer
3o6m
RCSB PDB
PDBbind
9-mer
3obq
RCSB PDB
PDBbind
9-mer
3obu
RCSB PDB
PDBbind
9-mer
3obx
RCSB PDB
PDBbind
9-mer
3qfd
RCSB PDB
PDBbind
9-mer
3r0h
RCSB PDB
PDBbind
9-mer
3r42
RCSB PDB
PDBbind
9-mer
3rwc
RCSB PDB
PDBbind
9-mer
3rwe
RCSB PDB
PDBbind
9-mer
3rwf
RCSB PDB
PDBbind
9-mer
3rwg
RCSB PDB
PDBbind
9-mer
3soq
RCSB PDB
PDBbind
9-mer
3sou
RCSB PDB
PDBbind
9-mer
3sov
RCSB PDB
PDBbind
9-mer
3sow
RCSB PDB
PDBbind
9-mer
3t5i
RCSB PDB
PDBbind
9-mer
3tf7
RCSB PDB
PDBbind
9-mer
3tfk
RCSB PDB
PDBbind
9-mer
3tjh
RCSB PDB
PDBbind
9-mer
3tpu
RCSB PDB
PDBbind
9-mer
3zhf
RCSB PDB
PDBbind
9-mer
4bt9
RCSB PDB
PDBbind
9-mer
4btb
RCSB PDB
PDBbind
9-mer
4cdr
RCSB PDB
PDBbind
9-mer
4ezq
RCSB PDB
PDBbind
9-mer
4ezt
RCSB PDB
PDBbind
9-mer
4fcm
RCSB PDB
PDBbind
9-mer
4fmn
RCSB PDB
PDBbind
9-mer
4i80
RCSB PDB
PDBbind
9-mer
4iho
RCSB PDB
PDBbind
9-mer
4j3u
RCSB PDB
PDBbind
9-mer
4mex
RCSB PDB
PDBbind
9-mer
4mnq
RCSB PDB
PDBbind
9-mer
4mzf
RCSB PDB
PDBbind
9-mer
4mzh
RCSB PDB
PDBbind
9-mer
4o2e
RCSB PDB
PDBbind
9-mer
4od7
RCSB PDB
PDBbind
9-mer
4pg9
RCSB PDB
PDBbind
9-mer
4pgb
RCSB PDB
PDBbind
9-mer
4pgc
RCSB PDB
PDBbind
9-mer
4pgd
RCSB PDB
PDBbind
9-mer
4pge
RCSB PDB
PDBbind
9-mer
4qbm
RCSB PDB
PDBbind
9-mer
4rh5
RCSB PDB
PDBbind
9-mer
4utn
RCSB PDB
PDBbind
9-mer
4utr
RCSB PDB
PDBbind
9-mer
4utv
RCSB PDB
PDBbind
9-mer
4utx
RCSB PDB
PDBbind
9-mer
4uu7
RCSB PDB
PDBbind
9-mer
4uu8
RCSB PDB
PDBbind
9-mer
4uua
RCSB PDB
PDBbind
9-mer
4uub
RCSB PDB
PDBbind
9-mer
4x3h
RCSB PDB
PDBbind
9-mer
4y5i
RCSB PDB
PDBbind
9-mer
5apr
RCSB PDB
PDBbind
9-mer
5brz
RCSB PDB
PDBbind
9-mer
5bs0
RCSB PDB
PDBbind
9-mer
5cvd
RCSB PDB
PDBbind
9-mer
5d0j
RCSB PDB
PDBbind
9-mer
5dms
RCSB PDB
PDBbind
9-mer
5e4w
RCSB PDB
PDBbind
9-mer
5eel
RCSB PDB
PDBbind
9-mer
5eok
RCSB PDB
PDBbind
9-mer
5fjw
RCSB PDB
PDBbind
9-mer
5gu4
RCSB PDB
PDBbind
9-mer
5hda
RCSB PDB
PDBbind
9-mer
5heb
RCSB PDB
PDBbind
9-mer
5hed
RCSB PDB
PDBbind
9-mer
5hey
RCSB PDB
PDBbind
9-mer
5hf1
RCSB PDB
PDBbind
9-mer
5hfb
RCSB PDB
PDBbind
9-mer
5hfc
RCSB PDB
PDBbind
9-mer
5hff
RCSB PDB
PDBbind
9-mer
5hjc
RCSB PDB
PDBbind
9-mer
5hkh
RCSB PDB
PDBbind
9-mer
5i8c
RCSB PDB
PDBbind
9-mer
5isz
RCSB PDB
PDBbind
9-mer
5jhd
RCSB PDB
PDBbind
9-mer
5lb7
RCSB PDB
PDBbind
9-mer
5lgs
RCSB PDB
PDBbind
9-mer
5nme
RCSB PDB
PDBbind
9-mer
5nmf
RCSB PDB
PDBbind
9-mer
5nmg
RCSB PDB
PDBbind
9-mer
5npr
RCSB PDB
PDBbind
9-mer
5nps
RCSB PDB
PDBbind
9-mer
5swf
RCSB PDB
PDBbind
9-mer
5u98
RCSB PDB
PDBbind
9-mer
5w1v
RCSB PDB
PDBbind
9-mer
5w1w
RCSB PDB
PDBbind
9-mer
5w7x
RCSB PDB
PDBbind
9-mer
5yc3
RCSB PDB
PDBbind
9-mer
5yc4
RCSB PDB
PDBbind
9-mer
5ygf
RCSB PDB
PDBbind
9-mer
5yvx
RCSB PDB
PDBbind
9-mer
5yy4
RCSB PDB
PDBbind
9-mer
5zia
RCSB PDB
PDBbind
9-mer
6bj2
RCSB PDB
PDBbind
9-mer
6bj3
RCSB PDB
PDBbind
9-mer
6c4u
RCSB PDB
PDBbind
9-mer
6evm
RCSB PDB
PDBbind
9-mer
6evn
RCSB PDB
PDBbind
9-mer
6evo
RCSB PDB
PDBbind
9-mer
6evp
RCSB PDB
PDBbind
9-mer
6fdp
RCSB PDB
PDBbind
9-mer
6fdt
RCSB PDB
PDBbind
9-mer
6qts
RCSB PDB
PDBbind
9-mer
6qtq
RCSB PDB
PDBbind
9-mer
6q38
RCSB PDB
PDBbind
9-mer
6o9c
RCSB PDB
PDBbind
9-mer
6o9b
RCSB PDB
PDBbind
9-mer
6ncp
RCSB PDB
PDBbind
9-mer
6mt6
RCSB PDB
PDBbind
9-mer
6mt5
RCSB PDB
PDBbind
9-mer
6mt4
RCSB PDB
PDBbind
9-mer
6i7a
RCSB PDB
PDBbind
9-mer
6i68
RCSB PDB
PDBbind
9-mer
6i5p
RCSB PDB
PDBbind
9-mer
6i41
RCSB PDB
PDBbind
9-mer
6hlb
RCSB PDB
PDBbind
9-mer
6eqa
RCSB PDB
PDBbind
9-mer
6d78
RCSB PDB
PDBbind
9-mer
6aee
RCSB PDB
PDBbind
9-mer
5y5w
RCSB PDB
PDBbind
9-mer
5wlg
RCSB PDB
PDBbind
9-mer
5u1q
RCSB PDB
PDBbind
9-mer
5u06
RCSB PDB
PDBbind
9-mer
5tyi
RCSB PDB
PDBbind
9-mer
5iza
RCSB PDB
PDBbind
9-mer
5iz9
RCSB PDB
PDBbind
9-mer
5iz6
RCSB PDB
PDBbind
9-mer
6a9c
RCSB PDB
PDBbind
9-mer
5b6g
RCSB PDB
PDBbind
9-mer
Entry Information
PDB ID
4yoz
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Retinoblastoma-like protein 1, p107 pocket domain
Ligand Name
9-mer
EC.Number
E.C.-.-.-.-
Resolution
2.25(Å)
Affinity (Kd/Ki/IC50)
Kd=0.16uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Genes Dev. Vol. 29: pp. 961-974
Ligand Properties
Formula
C
5
1
H
7
4
N
1
1
O
1
8
S
Molecular Weight
1161.260
Exact Mass
1160.490
No. of atoms
155
No. of bonds
156
Polar Surface Area
537.78
LOGP Value
-0.29 (
Computed with XLOGP3
)
0.49 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 18
No. of Rotatable Bonds: 44
No. of Nitrogen and Oxygen Atoms: 29
No. of Rings: 2
Canonical SMILES
SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)CC(C)C)CCC(=O)N)CCC(=O)O)Cc1ccc(cc1)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)[NH3+])CC(C)C)Cc1ccc(cc1)O
InChI String
InChI=1S/C51H73N11O18S/c1-24(2)17-33(57-43(71)30(52)21-42(69)70)46(74)59-36(20-27-7-11-29(64)12-8-27)49(77)62-38(23-81)50(78)60-35(19-26-5-9-28(63)10-6-26)48(76)56-32(14-16-41(67)68)44(72)55-31(13-15-39(53)65)45(73)58-34(18-25(3)4)47(75)61-37(51(79)80)22-40(54)66/h5-12,24-25,30-38,63-64,81H,13-23,52H2,1-4H3,(H2,53,65)(H2,54,66)(H,55,72)(H,56,76)(H,57,71)(H,58,73)(H,59,74)(H,60,78)(H,61,75)(H,62,77)(H,67,68)(H,69,70)(H,79,80)/p+1/t30-,31-,32-,33-,34-,35-,36-,37-,38-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03129
P28749
Entrez Gene ID
NCBI Entrez Gene ID:
1489079
5933
ASD
Information of known allosteric effects of PDB entries
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