Browse entries in the PDBbind-CN Database
HEADER 6MI6_COMPLEX COMPND 6MI6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 140 ILE ARG MET VAL PRO ILE SER PHE VAL PHE ASN ARG PHE SEQRES 2 A 140 PRO ARG MET VAL ARG ASP LEU ALA LYS LYS MET ASN LYS SEQRES 3 A 140 GLU VAL ASN PHE ILE MET ARG GLY GLU ASP THR GLU LEU SEQRES 4 A 140 ASP ARG THR PHE VAL GLU GLU ILE GLY GLU PRO LEU LEU SEQRES 5 A 140 HIS LEU LEU ARG ASN ALA ILE ASP HIS GLY ILE GLU PRO SEQRES 6 A 140 LYS GLU GLU ARG ILE ALA LYS GLY LYS PRO PRO ILE GLY SEQRES 7 A 140 THR LEU ILE LEU SER ALA ARG HIS GLU GLY ASN ASN VAL SEQRES 8 A 140 VAL ILE GLU VAL GLU ASP ASP GLY ARG GLY ILE ASP LYS SEQRES 9 A 140 GLU LYS ILE ILE ARG LYS ALA ILE GLU LYS GLY LEU ILE SEQRES 10 A 140 ASP GLU SER LYS ALA ALA THR LEU SER ASP GLN GLU ILE SEQRES 11 A 140 LEU ASN PHE LEU PHE VAL PRO GLY PHE SER SEQRES 1 A 43 VAL SER GLU VAL SER GLY ARG GLY VAL GLY MET ASP VAL SEQRES 2 A 43 VAL LYS ASN VAL VAL GLU SER LEU ASN GLY SER ILE SER SEQRES 3 A 43 ILE GLU SER GLU LYS ASP LYS GLY THR LYS VAL THR ILE SEQRES 4 A 43 ARG LEU PRO LEU HET JSJ A 184 68 ATOM 1 N ILE A 353 22.941 -16.972 53.235 1.00167.15 N ATOM 2 CA ILE A 353 22.203 -15.728 53.036 1.00162.73 C ATOM 3 C ILE A 353 20.804 -15.975 52.489 1.00159.11 C ATOM 4 O ILE A 353 20.573 -16.429 51.366 1.00165.82 O ATOM 5 CB ILE A 353 22.957 -14.772 52.137 1.00159.99 C ATOM 6 CG1 ILE A 353 22.143 -13.504 51.926 1.00148.54 C ATOM 7 CG2 ILE A 353 23.278 -15.404 50.786 1.00164.21 C ATOM 8 CD1 ILE A 353 22.859 -12.436 51.147 1.00142.97 C ATOM 9 HN3 ILE A 353 23.031 -17.470 52.326 1.00 0.00 H ATOM 10 HN2 ILE A 353 22.429 -17.573 53.912 1.00 0.00 H ATOM 11 HN1 ILE A 353 23.887 -16.756 53.608 1.00 0.00 H ATOM 12 N ARG A 354 19.842 -15.580 53.299 1.00147.20 N ATOM 13 CA ARG A 354 18.528 -16.157 53.126 1.00141.48 C ATOM 14 C ARG A 354 17.518 -15.000 53.177 1.00137.64 C ATOM 15 O ARG A 354 17.668 -14.038 53.940 1.00138.95 O ATOM 16 CB ARG A 354 18.484 -17.340 54.183 1.00140.60 C ATOM 17 CG ARG A 354 18.431 -18.771 53.596 1.00141.41 C ATOM 18 CD ARG A 354 18.332 -18.788 52.092 1.00140.79 C ATOM 19 NE ARG A 354 19.561 -18.682 51.229 1.00143.42 N ATOM 20 CZ ARG A 354 20.697 -19.383 51.106 1.00149.54 C ATOM 21 NH1 ARG A 354 21.093 -20.284 51.954 1.00151.45 N ATOM 22 NH2 ARG A 354 21.563 -18.972 50.164 1.00151.44 N ATOM 23 HE ARG A 354 19.519 -17.875 50.574 1.00 0.00 H ATOM 24 HH12 ARG A 354 21.987 -20.790 51.795 1.00 0.00 H ATOM 25 HH11 ARG A 354 20.516 -20.499 52.792 1.00 0.00 H ATOM 26 HH22 ARG A 354 22.460 -19.479 50.025 1.00 0.00 H ATOM 27 HH21 ARG A 354 21.336 -18.146 49.574 1.00 0.00 H ATOM 28 H ARG A 354 20.023 -14.874 54.041 1.00 0.00 H ATOM 29 N MET A 355 16.506 -15.044 52.319 1.00106.55 N ATOM 30 CA MET A 355 15.704 -13.841 52.123 1.00106.70 C ATOM 31 C MET A 355 14.291 -14.062 52.657 1.00106.49 C ATOM 32 O MET A 355 13.685 -15.113 52.420 1.00112.10 O ATOM 33 CB MET A 355 15.652 -13.431 50.624 1.00115.24 C ATOM 34 CG MET A 355 17.029 -13.185 49.944 1.00125.81 C ATOM 35 SD MET A 355 17.317 -11.723 48.926 1.00132.04 S ATOM 36 CE MET A 355 16.563 -12.276 47.401 1.00134.05 C ATOM 37 H MET A 355 16.289 -15.917 51.798 1.00 0.00 H ATOM 38 N VAL A 356 13.737 -13.048 53.322 1.00 94.70 N ATOM 39 CA VAL A 356 12.443 -13.174 54.005 1.00 99.66 C ATOM 40 C VAL A 356 11.658 -11.922 53.612 1.00 88.45 C ATOM 41 O VAL A 356 12.281 -10.886 53.363 1.00 89.94 O ATOM 42 CB VAL A 356 12.649 -13.330 55.537 1.00118.92 C ATOM 43 CG1 VAL A 356 13.302 -12.097 56.159 1.00125.63 C ATOM 44 CG2 VAL A 356 11.376 -13.762 56.325 1.00123.77 C ATOM 45 H VAL A 356 14.238 -12.137 53.358 1.00 0.00 H ATOM 46 N PRO A 357 10.320 -11.936 53.556 1.00 85.91 N ATOM 47 CA PRO A 357 9.599 -10.780 53.001 1.00 86.23 C ATOM 48 C PRO A 357 9.771 -9.497 53.793 1.00 87.76 C ATOM 49 O PRO A 357 9.979 -9.512 55.005 1.00 90.66 O ATOM 50 CB PRO A 357 8.142 -11.238 53.018 1.00 89.35 C ATOM 51 CG PRO A 357 8.229 -12.679 52.919 1.00 88.18 C ATOM 52 CD PRO A 357 9.391 -13.060 53.765 1.00 87.09 C ATOM 53 N ILE A 358 9.644 -8.368 53.091 1.00 79.65 N ATOM 54 CA ILE A 358 9.793 -7.068 53.738 1.00 76.64 C ATOM 55 C ILE A 358 8.597 -6.860 54.648 1.00 76.87 C ATOM 56 O ILE A 358 8.500 -5.843 55.333 1.00 75.22 O ATOM 57 CB ILE A 358 9.937 -5.925 52.720 1.00 66.33 C ATOM 58 CG1 ILE A 358 10.783 -4.812 53.306 1.00 66.33 C ATOM 59 CG2 ILE A 358 8.609 -5.352 52.394 1.00 64.64 C ATOM 60 CD1 ILE A 358 10.969 -3.670 52.389 1.00 65.68 C ATOM 61 H ILE A 358 9.437 -8.415 52.073 1.00 0.00 H ATOM 62 N SER A 359 7.667 -7.811 54.636 1.00 68.40 N ATOM 63 CA SER A 359 6.570 -7.795 55.589 1.00 79.33 C ATOM 64 C SER A 359 7.098 -7.815 57.006 1.00 74.78 C ATOM 65 O SER A 359 6.494 -7.223 57.910 1.00 78.25 O ATOM 66 CB SER A 359 5.674 -9.002 55.398 1.00 93.27 C ATOM 67 OG SER A 359 6.142 -10.041 56.233 1.00100.72 O ATOM 68 HG SER A 359 5.566 -10.838 56.120 1.00 0.00 H ATOM 69 H SER A 359 7.726 -8.577 53.935 1.00 0.00 H ATOM 70 N PHE A 360 8.187 -8.550 57.225 1.00 83.49 N ATOM 71 CA PHE A 360 8.684 -8.762 58.571 1.00 79.12 C ATOM 72 C PHE A 360 8.891 -7.436 59.274 1.00 73.29 C ATOM 73 O PHE A 360 8.430 -7.247 60.402 1.00 73.89 O ATOM 74 CB PHE A 360 9.994 -9.539 58.488 1.00 85.78 C ATOM 75 CG PHE A 360 10.318 -10.332 59.705 1.00 92.63 C ATOM 76 CD1 PHE A 360 11.472 -11.091 59.758 1.00 94.81 C ATOM 77 CD2 PHE A 360 9.476 -10.328 60.788 1.00 93.40 C ATOM 78 CE1 PHE A 360 11.777 -11.821 60.860 1.00 98.32 C ATOM 79 CE2 PHE A 360 9.776 -11.061 61.896 1.00 96.36 C ATOM 80 CZ PHE A 360 10.931 -11.807 61.934 1.00 99.90 C ATOM 81 H PHE A 360 8.688 -8.978 56.420 1.00 0.00 H ATOM 82 N VAL A 361 9.538 -6.484 58.599 1.00 74.82 N ATOM 83 CA VAL A 361 9.749 -5.167 59.192 1.00 76.76 C ATOM 84 C VAL A 361 8.496 -4.310 59.110 1.00 73.72 C ATOM 85 O VAL A 361 8.013 -3.800 60.124 1.00 83.22 O ATOM 86 CB VAL A 361 10.936 -4.451 58.530 1.00 78.36 C ATOM 87 CG1 VAL A 361 10.833 -4.517 57.029 1.00 71.74 C ATOM 88 CG2 VAL A 361 11.020 -3.019 59.007 1.00 81.46 C ATOM 89 H VAL A 361 9.895 -6.682 57.642 1.00 0.00 H ATOM 90 N PHE A 362 7.908 -4.182 57.925 1.00 67.89 N ATOM 91 CA PHE A 362 6.861 -3.185 57.746 1.00 65.63 C ATOM 92 C PHE A 362 5.721 -3.410 58.715 1.00 70.92 C ATOM 93 O PHE A 362 5.144 -2.457 59.238 1.00 73.00 O ATOM 94 CB PHE A 362 6.341 -3.223 56.319 1.00 64.21 C ATOM 95 CG PHE A 362 7.154 -2.429 55.363 1.00 64.02 C ATOM 96 CD1 PHE A 362 8.392 -1.981 55.705 1.00 72.21 C ATOM 97 CD2 PHE A 362 6.700 -2.176 54.101 1.00 62.66 C ATOM 98 CE1 PHE A 362 9.141 -1.267 54.814 1.00 71.08 C ATOM 99 CE2 PHE A 362 7.454 -1.470 53.215 1.00 62.82 C ATOM 100 CZ PHE A 362 8.675 -1.022 53.574 1.00 65.98 C ATOM 101 H PHE A 362 8.193 -4.790 57.131 1.00 0.00 H ATOM 102 N ASN A 363 5.408 -4.663 59.003 1.00 66.91 N ATOM 103 CA ASN A 363 4.217 -4.931 59.781 1.00 67.80 C ATOM 104 C ASN A 363 4.297 -4.340 61.173 1.00 69.34 C ATOM 105 O ASN A 363 3.262 -4.178 61.823 1.00 70.55 O ATOM 106 CB ASN A 363 3.974 -6.431 59.826 1.00 69.10 C ATOM 107 CG ASN A 363 3.235 -6.920 58.610 1.00 68.21 C ATOM 108 OD1 ASN A 363 2.596 -6.148 57.913 1.00 66.88 O ATOM 109 ND2 ASN A 363 3.358 -8.198 58.319 1.00 72.06 N ATOM 110 HD22 ASN A 363 3.912 -8.822 58.940 1.00 0.00 H ATOM 111 HD21 ASN A 363 2.901 -8.584 57.468 1.00 0.00 H ATOM 112 H ASN A 363 6.010 -5.445 58.675 1.00 0.00 H ATOM 113 N ARG A 364 5.495 -4.032 61.659 1.00 70.95 N ATOM 114 CA ARG A 364 5.596 -3.483 63.004 1.00 86.01 C ATOM 115 C ARG A 364 5.108 -2.045 63.080 1.00 91.27 C ATOM 116 O ARG A 364 4.558 -1.642 64.108 1.00106.83 O ATOM 117 CB ARG A 364 7.021 -3.614 63.529 1.00 92.17 C ATOM 118 CG ARG A 364 7.208 -4.845 64.409 1.00 99.59 C ATOM 119 CD ARG A 364 6.279 -4.806 65.626 1.00107.62 C ATOM 120 NE ARG A 364 4.976 -5.435 65.386 1.00110.54 N ATOM 121 CZ ARG A 364 3.905 -5.271 66.160 1.00109.39 C ATOM 122 NH1 ARG A 364 3.976 -4.497 67.227 1.00109.59 N ATOM 123 NH2 ARG A 364 2.760 -5.876 65.871 1.00106.05 N ATOM 124 HE ARG A 364 4.882 -6.052 64.554 1.00 0.00 H ATOM 125 HH12 ARG A 364 3.140 -4.368 67.832 1.00 0.00 H ATOM 126 HH11 ARG A 364 4.868 -4.016 67.462 1.00 0.00 H ATOM 127 HH22 ARG A 364 1.931 -5.740 66.484 1.00 0.00 H ATOM 128 HH21 ARG A 364 2.692 -6.487 65.032 1.00 0.00 H ATOM 129 H ARG A 364 6.350 -4.181 61.086 1.00 0.00 H ATOM 130 N PHE A 365 5.293 -1.266 62.027 1.00 74.29 N ATOM 131 CA PHE A 365 5.070 0.178 62.067 1.00 70.62 C ATOM 132 C PHE A 365 3.636 0.652 62.308 1.00 74.75 C ATOM 133 O PHE A 365 3.466 1.710 62.931 1.00 76.93 O ATOM 134 CB PHE A 365 5.579 0.797 60.785 1.00 68.42 C ATOM 135 CG PHE A 365 7.025 0.630 60.602 1.00 68.97 C ATOM 136 CD1 PHE A 365 7.515 0.090 59.450 1.00 67.76 C ATOM 137 CD2 PHE A 365 7.889 1.008 61.575 1.00 71.16 C ATOM 138 CE1 PHE A 365 8.840 -0.063 59.274 1.00 68.68 C ATOM 139 CE2 PHE A 365 9.216 0.857 61.407 1.00 72.10 C ATOM 140 CZ PHE A 365 9.699 0.322 60.256 1.00 73.16 C ATOM 141 H PHE A 365 5.610 -1.698 61.136 1.00 0.00 H ATOM 142 N PRO A 366 2.588 -0.019 61.808 1.00 72.81 N ATOM 143 CA PRO A 366 1.240 0.563 61.935 1.00 70.51 C ATOM 144 C PRO A 366 0.882 0.902 63.348 1.00 71.54 C ATOM 145 O PRO A 366 0.361 1.982 63.636 1.00 72.15 O ATOM 146 CB PRO A 366 0.314 -0.552 61.436 1.00 78.41 C ATOM 147 CG PRO A 366 1.141 -1.523 60.794 1.00 75.89 C ATOM 148 CD PRO A 366 2.579 -1.228 60.978 1.00 75.51 C ATOM 149 N ARG A 367 1.159 -0.025 64.249 1.00 76.36 N ATOM 150 CA ARG A 367 0.908 0.249 65.643 1.00 79.59 C ATOM 151 C ARG A 367 1.632 1.504 66.060 1.00 80.28 C ATOM 152 O ARG A 367 1.022 2.409 66.626 1.00 81.87 O ATOM 153 CB ARG A 367 1.341 -0.954 66.468 1.00 81.84 C ATOM 154 CG ARG A 367 0.714 -0.957 67.806 1.00 87.53 C ATOM 155 CD ARG A 367 0.999 -2.188 68.666 1.00100.47 C ATOM 156 NE ARG A 367 2.273 -2.268 69.400 1.00104.94 N ATOM 157 CZ ARG A 367 2.391 -2.801 70.623 1.00104.64 C ATOM 158 NH1 ARG A 367 1.326 -3.265 71.267 1.00103.63 N ATOM 159 NH2 ARG A 367 3.568 -2.853 71.229 1.00108.28 N ATOM 160 HE ARG A 367 3.128 -1.890 68.944 1.00 0.00 H ATOM 161 HH12 ARG A 367 1.431 -3.677 72.216 1.00 0.00 H ATOM 162 HH11 ARG A 367 0.387 -3.217 70.822 1.00 0.00 H ATOM 163 HH22 ARG A 367 3.646 -3.270 72.179 1.00 0.00 H ATOM 164 HH21 ARG A 367 4.414 -2.477 70.755 1.00 0.00 H ATOM 165 H ARG A 367 1.553 -0.942 63.956 1.00 0.00 H ATOM 166 N MET A 368 2.881 1.652 65.640 1.00 71.18 N ATOM 167 CA MET A 368 3.608 2.866 65.970 1.00 76.61 C ATOM 168 C MET A 368 2.957 4.078 65.343 1.00 73.16 C ATOM 169 O MET A 368 2.611 5.039 66.033 1.00 72.58 O ATOM 170 CB MET A 368 5.056 2.744 65.504 1.00 88.01 C ATOM 171 CG MET A 368 5.676 1.400 65.825 1.00104.94 C ATOM 172 SD MET A 368 7.466 1.326 65.643 1.00118.84 S ATOM 173 CE MET A 368 7.748 -0.387 66.016 1.00119.67 C ATOM 174 H MET A 368 3.337 0.905 65.079 1.00 0.00 H ATOM 175 N VAL A 369 2.667 4.008 64.057 1.00 72.59 N ATOM 176 CA VAL A 369 2.133 5.198 63.430 1.00 71.42 C ATOM 177 C VAL A 369 0.883 5.618 64.149 1.00 81.56 C ATOM 178 O VAL A 369 0.736 6.780 64.534 1.00 93.80 O ATOM 179 CB VAL A 369 1.876 4.955 61.945 1.00 68.38 C ATOM 180 CG1 VAL A 369 0.885 5.970 61.458 1.00 67.81 C ATOM 181 CG2 VAL A 369 3.182 5.029 61.220 1.00 68.93 C ATOM 182 H VAL A 369 2.816 3.132 63.516 1.00 0.00 H ATOM 183 N ARG A 370 0.019 4.660 64.443 1.00 72.85 N ATOM 184 CA ARG A 370 -1.139 5.016 65.225 1.00 82.11 C ATOM 185 C ARG A 370 -0.708 5.621 66.541 1.00 80.43 C ATOM 186 O ARG A 370 -1.135 6.728 66.878 1.00 78.19 O ATOM 187 CB ARG A 370 -2.017 3.790 65.423 1.00 95.66 C ATOM 188 CG ARG A 370 -2.290 3.098 64.112 1.00102.59 C ATOM 189 CD ARG A 370 -3.528 2.268 64.186 1.00109.27 C ATOM 190 NE ARG A 370 -3.464 1.290 65.263 1.00114.16 N ATOM 191 CZ ARG A 370 -3.262 -0.005 65.065 1.00117.30 C ATOM 192 NH1 ARG A 370 -3.073 -0.449 63.832 1.00117.25 N ATOM 193 NH2 ARG A 370 -3.223 -0.844 66.092 1.00118.59 N ATOM 194 HE ARG A 370 -3.583 1.626 66.240 1.00 0.00 H ATOM 195 HH12 ARG A 370 -2.913 -1.463 63.663 1.00 0.00 H ATOM 196 HH11 ARG A 370 -3.084 0.216 63.032 1.00 0.00 H ATOM 197 HH22 ARG A 370 -3.064 -1.859 65.929 1.00 0.00 H ATOM 198 HH21 ARG A 370 -3.351 -0.487 67.060 1.00 0.00 H ATOM 199 H ARG A 370 0.170 3.683 64.121 1.00 0.00 H ATOM 200 N ASP A 371 0.227 4.976 67.236 1.00 82.25 N ATOM 201 CA ASP A 371 0.707 5.544 68.493 1.00 94.47 C ATOM 202 C ASP A 371 1.170 6.976 68.281 1.00 91.88 C ATOM 203 O ASP A 371 0.634 7.913 68.876 1.00 95.96 O ATOM 204 CB ASP A 371 1.865 4.711 69.097 1.00103.78 C ATOM 205 CG ASP A 371 1.416 3.694 70.182 1.00112.17 C ATOM 206 OD1 ASP A 371 0.241 3.686 70.602 1.00119.29 O ATOM 207 OD2 ASP A 371 2.283 2.923 70.661 1.00116.35 O ATOM 208 H ASP A 371 0.612 4.075 66.887 1.00 0.00 H ATOM 209 N LEU A 372 2.130 7.165 67.386 1.00 87.40 N ATOM 210 CA LEU A 372 2.722 8.481 67.224 1.00 87.49 C ATOM 211 C LEU A 372 1.695 9.485 66.733 1.00 81.39 C ATOM 212 O LEU A 372 1.756 10.665 67.081 1.00 84.27 O ATOM 213 CB LEU A 372 3.954 8.387 66.329 1.00 91.74 C ATOM 214 CG LEU A 372 5.106 7.636 67.051 1.00100.14 C ATOM 215 CD1 LEU A 372 4.993 6.120 67.189 1.00 98.96 C ATOM 216 CD2 LEU A 372 6.456 7.954 66.435 1.00102.67 C ATOM 217 H LEU A 372 2.459 6.371 66.800 1.00 0.00 H ATOM 218 N ALA A 373 0.770 9.050 65.889 1.00 85.11 N ATOM 219 CA ALA A 373 -0.251 9.962 65.391 1.00 83.00 C ATOM 220 C ALA A 373 -1.066 10.543 66.525 1.00 86.02 C ATOM 221 O ALA A 373 -1.396 11.732 66.528 1.00 87.11 O ATOM 222 CB ALA A 373 -1.159 9.236 64.413 1.00 86.28 C ATOM 223 H ALA A 373 0.773 8.056 65.582 1.00 0.00 H ATOM 224 N LYS A 374 -1.456 9.695 67.458 1.00 90.99 N ATOM 225 CA LYS A 374 -2.309 10.127 68.553 1.00101.01 C ATOM 226 C LYS A 374 -1.622 11.107 69.492 1.00109.84 C ATOM 227 O LYS A 374 -2.303 11.941 70.101 1.00114.52 O ATOM 228 CB LYS A 374 -2.816 8.909 69.323 1.00100.08 C ATOM 229 CG LYS A 374 -3.559 7.880 68.467 1.00 95.55 C ATOM 230 CD LYS A 374 -4.228 8.491 67.244 1.00 86.75 C ATOM 231 CE LYS A 374 -4.016 7.624 66.032 1.00 76.40 C ATOM 232 NZ LYS A 374 -4.890 8.070 64.932 1.00 74.62 N ATOM 233 HZ1 LYS A 374 -5.884 8.003 65.231 1.00 0.00 H ATOM 234 HZ2 LYS A 374 -4.665 9.056 64.691 1.00 0.00 H ATOM 235 HZ3 LYS A 374 -4.735 7.465 64.101 1.00 0.00 H ATOM 236 H LYS A 374 -1.148 8.703 67.409 1.00 0.00 H ATOM 237 N LYS A 375 -0.302 11.010 69.666 1.00116.24 N ATOM 238 CA LYS A 375 0.367 11.895 70.621 1.00119.16 C ATOM 239 C LYS A 375 0.212 13.373 70.258 1.00121.17 C ATOM 240 O LYS A 375 0.038 14.214 71.151 1.00118.67 O ATOM 241 CB LYS A 375 1.851 11.513 70.741 1.00111.35 C ATOM 242 CG LYS A 375 2.663 12.595 71.433 1.00115.43 C ATOM 243 CD LYS A 375 4.157 12.521 71.191 1.00117.12 C ATOM 244 CE LYS A 375 4.897 13.460 72.144 1.00125.37 C ATOM 245 NZ LYS A 375 6.217 13.884 71.594 1.00125.56 N ATOM 246 HZ1 LYS A 375 6.811 13.045 71.436 1.00 0.00 H ATOM 247 HZ2 LYS A 375 6.072 14.382 70.693 1.00 0.00 H ATOM 248 HZ3 LYS A 375 6.685 14.519 72.271 1.00 0.00 H ATOM 249 H LYS A 375 0.247 10.311 69.127 1.00 0.00 H ATOM 250 N MET A 376 0.237 13.722 68.961 1.00125.10 N ATOM 251 CA MET A 376 0.120 15.128 68.537 1.00123.48 C ATOM 252 C MET A 376 -1.226 15.426 67.850 1.00112.51 C ATOM 253 O MET A 376 -1.260 16.112 66.832 1.00111.91 O ATOM 254 CB MET A 376 1.311 15.551 67.651 1.00128.70 C ATOM 255 CG MET A 376 1.470 17.109 67.421 1.00140.29 C ATOM 256 SD MET A 376 2.791 17.947 68.375 1.00153.55 S ATOM 257 CE MET A 376 2.719 19.612 67.688 1.00153.88 C ATOM 258 H MET A 376 0.342 12.981 68.238 1.00 0.00 H ATOM 259 N ASN A 377 -2.314 14.823 68.347 1.00114.87 N ATOM 260 CA ASN A 377 -3.699 15.188 68.003 1.00109.64 C ATOM 261 C ASN A 377 -3.953 15.193 66.515 1.00107.00 C ATOM 262 O ASN A 377 -4.850 15.891 66.050 1.00107.35 O ATOM 263 CB ASN A 377 -4.102 16.548 68.584 1.00113.32 C ATOM 264 CG ASN A 377 -3.424 17.726 67.905 1.00115.90 C ATOM 265 OD1 ASN A 377 -3.600 17.988 66.714 1.00111.52 O ATOM 266 ND2 ASN A 377 -2.648 18.454 68.680 1.00122.04 N ATOM 267 HD22 ASN A 377 -2.526 18.199 69.681 1.00 0.00 H ATOM 268 HD21 ASN A 377 -2.157 19.284 68.292 1.00 0.00 H ATOM 269 H ASN A 377 -2.171 14.044 69.021 1.00 0.00 H ATOM 270 N LYS A 378 -3.225 14.384 65.759 1.00106.66 N ATOM 271 CA LYS A 378 -3.352 14.413 64.312 1.00104.88 C ATOM 272 C LYS A 378 -3.855 13.064 63.839 1.00102.30 C ATOM 273 O LYS A 378 -3.370 12.027 64.302 1.00103.77 O ATOM 274 CB LYS A 378 -2.009 14.749 63.659 1.00100.51 C ATOM 275 H LYS A 378 -2.557 13.723 66.205 1.00 0.00 H ATOM 276 N GLU A 379 -4.859 13.092 62.957 1.00 97.92 N ATOM 277 CA GLU A 379 -5.415 11.894 62.347 1.00 92.02 C ATOM 278 C GLU A 379 -4.664 11.658 61.061 1.00 85.63 C ATOM 279 O GLU A 379 -4.457 12.590 60.282 1.00 87.94 O ATOM 280 CB GLU A 379 -6.912 12.002 62.039 1.00 96.28 C ATOM 281 CG GLU A 379 -7.865 12.032 63.232 1.00105.30 C ATOM 282 CD GLU A 379 -9.307 12.366 62.841 1.00110.05 C ATOM 283 OE1 GLU A 379 -9.626 13.556 62.625 1.00112.37 O ATOM 284 OE2 GLU A 379 -10.125 11.422 62.756 1.00111.08 O ATOM 285 H GLU A 379 -5.262 14.014 62.694 1.00 0.00 H ATOM 286 N VAL A 380 -4.267 10.416 60.844 1.00 80.32 N ATOM 287 CA VAL A 380 -3.458 10.041 59.699 1.00 86.67 C ATOM 288 C VAL A 380 -4.013 8.785 59.059 1.00 83.98 C ATOM 289 O VAL A 380 -4.692 7.975 59.697 1.00 90.20 O ATOM 290 CB VAL A 380 -1.978 9.829 60.079 1.00 91.58 C ATOM 291 CG1 VAL A 380 -1.471 10.986 60.863 1.00 99.54 C ATOM 292 CG2 VAL A 380 -1.838 8.585 60.939 1.00 93.09 C ATOM 293 H VAL A 380 -4.546 9.678 61.521 1.00 0.00 H ATOM 294 N ASN A 381 -3.724 8.645 57.777 1.00 73.59 N ATOM 295 CA ASN A 381 -4.066 7.467 57.008 1.00 74.17 C ATOM 296 C ASN A 381 -2.777 6.784 56.597 1.00 75.35 C ATOM 297 O ASN A 381 -1.959 7.373 55.889 1.00 73.00 O ATOM 298 CB ASN A 381 -4.883 7.833 55.785 1.00 78.77 C ATOM 299 CG ASN A 381 -5.249 6.643 55.000 1.00 82.07 C ATOM 300 OD1 ASN A 381 -4.974 5.516 55.402 1.00 76.63 O ATOM 301 ND2 ASN A 381 -5.856 6.865 53.854 1.00 86.32 N ATOM 302 HD22 ASN A 381 -6.067 7.839 53.558 1.00 0.00 H ATOM 303 HD21 ASN A 381 -6.125 6.066 53.245 1.00 0.00 H ATOM 304 H ASN A 381 -3.225 9.421 57.296 1.00 0.00 H ATOM 305 N PHE A 382 -2.602 5.549 57.024 1.00 66.39 N ATOM 306 CA PHE A 382 -1.360 4.843 56.801 1.00 63.48 C ATOM 307 C PHE A 382 -1.575 3.718 55.811 1.00 65.80 C ATOM 308 O PHE A 382 -2.415 2.844 56.032 1.00 65.73 O ATOM 309 CB PHE A 382 -0.816 4.280 58.096 1.00 68.58 C ATOM 310 CG PHE A 382 0.555 3.793 57.966 1.00 71.93 C ATOM 311 CD1 PHE A 382 1.466 4.525 57.255 1.00 77.05 C ATOM 312 CD2 PHE A 382 0.942 2.613 58.528 1.00 74.62 C ATOM 313 CE1 PHE A 382 2.736 4.106 57.128 1.00 80.96 C ATOM 314 CE2 PHE A 382 2.218 2.181 58.397 1.00 77.58 C ATOM 315 CZ PHE A 382 3.120 2.928 57.699 1.00 79.68 C ATOM 316 H PHE A 382 -3.374 5.072 57.532 1.00 0.00 H ATOM 317 N ILE A 383 -0.817 3.741 54.728 1.00 69.21 N ATOM 318 CA ILE A 383 -0.899 2.733 53.688 1.00 65.65 C ATOM 319 C ILE A 383 0.464 2.095 53.537 1.00 63.49 C ATOM 320 O ILE A 383 1.470 2.794 53.402 1.00 59.33 O ATOM 321 CB ILE A 383 -1.367 3.336 52.360 1.00 70.77 C ATOM 322 CG1 ILE A 383 -2.813 3.799 52.482 1.00 83.37 C ATOM 323 CG2 ILE A 383 -1.207 2.336 51.265 1.00 74.68 C ATOM 324 CD1 ILE A 383 -3.324 4.503 51.251 1.00 89.85 C ATOM 325 H ILE A 383 -0.132 4.516 54.617 1.00 0.00 H ATOM 326 N MET A 384 0.496 0.780 53.547 1.00 61.05 N ATOM 327 CA MET A 384 1.720 0.043 53.338 1.00 60.99 C ATOM 328 C MET A 384 1.534 -0.770 52.088 1.00 61.36 C ATOM 329 O MET A 384 0.545 -1.484 51.955 1.00 62.17 O ATOM 330 CB MET A 384 2.039 -0.867 54.495 1.00 61.76 C ATOM 331 CG MET A 384 2.448 -0.146 55.703 1.00 61.98 C ATOM 332 SD MET A 384 2.719 -1.353 56.937 1.00 63.45 S ATOM 333 CE MET A 384 1.304 -2.374 56.740 1.00 64.16 C ATOM 334 H MET A 384 -0.387 0.255 53.710 1.00 0.00 H ATOM 335 N ARG A 385 2.457 -0.640 51.172 1.00 59.71 N ATOM 336 CA ARG A 385 2.341 -1.331 49.915 1.00 67.87 C ATOM 337 C ARG A 385 3.607 -2.125 49.661 1.00 77.99 C ATOM 338 O ARG A 385 4.686 -1.788 50.154 1.00 96.52 O ATOM 339 CB ARG A 385 2.083 -0.342 48.806 1.00 68.34 C ATOM 340 CG ARG A 385 0.701 0.240 48.798 1.00 69.24 C ATOM 341 CD ARG A 385 0.373 0.615 47.388 1.00 74.63 C ATOM 342 NE ARG A 385 -0.675 1.611 47.283 1.00 79.14 N ATOM 343 CZ ARG A 385 -0.449 2.909 47.143 1.00 83.80 C ATOM 344 NH1 ARG A 385 0.794 3.369 47.132 1.00 80.40 N ATOM 345 NH2 ARG A 385 -1.474 3.746 47.036 1.00 87.00 N ATOM 346 HE ARG A 385 -1.663 1.288 47.320 1.00 0.00 H ATOM 347 HH12 ARG A 385 0.970 4.388 47.022 1.00 0.00 H ATOM 348 HH11 ARG A 385 1.593 2.711 47.233 1.00 0.00 H ATOM 349 HH22 ARG A 385 -1.303 4.766 46.926 1.00 0.00 H ATOM 350 HH21 ARG A 385 -2.448 3.382 47.062 1.00 0.00 H ATOM 351 H ARG A 385 3.282 -0.033 51.353 1.00 0.00 H ATOM 352 N GLY A 386 3.451 -3.200 48.902 1.00 74.13 N ATOM 353 CA GLY A 386 4.580 -4.025 48.536 1.00 74.03 C ATOM 354 C GLY A 386 5.169 -4.869 49.634 1.00 72.02 C ATOM 355 O GLY A 386 6.355 -5.170 49.589 1.00 73.19 O ATOM 356 H GLY A 386 2.501 -3.454 48.564 1.00 0.00 H ATOM 357 N GLU A 387 4.377 -5.292 50.608 1.00 71.80 N ATOM 358 CA GLU A 387 4.967 -6.092 51.673 1.00 68.89 C ATOM 359 C GLU A 387 5.615 -7.375 51.177 1.00 79.85 C ATOM 360 O GLU A 387 6.479 -7.921 51.862 1.00 87.59 O ATOM 361 CB GLU A 387 3.923 -6.453 52.708 1.00 60.93 C ATOM 362 CG GLU A 387 3.306 -5.324 53.399 1.00 59.81 C ATOM 363 CD GLU A 387 2.534 -5.808 54.573 1.00 69.73 C ATOM 364 OE1 GLU A 387 2.330 -5.040 55.528 1.00 68.99 O ATOM 365 OE2 GLU A 387 2.131 -6.981 54.534 1.00 73.79 O ATOM 366 H GLU A 387 3.363 -5.060 50.612 1.00 0.00 H ATOM 367 N ASP A 388 5.213 -7.891 50.022 1.00 80.42 N ATOM 368 CA ASP A 388 5.725 -9.193 49.632 1.00 77.90 C ATOM 369 C ASP A 388 7.155 -9.168 49.127 1.00 81.77 C ATOM 370 O ASP A 388 7.763 -10.236 49.056 1.00 93.23 O ATOM 371 CB ASP A 388 4.859 -9.797 48.548 1.00 71.41 C ATOM 372 CG ASP A 388 4.513 -8.808 47.502 1.00 69.74 C ATOM 373 OD1 ASP A 388 4.054 -7.711 47.849 1.00 67.97 O ATOM 374 OD2 ASP A 388 4.762 -9.109 46.327 1.00 71.94 O ATOM 375 H ASP A 388 4.548 -7.376 49.411 1.00 0.00 H ATOM 376 N THR A 389 7.698 -8.011 48.734 1.00 74.67 N ATOM 377 CA THR A 389 9.043 -8.002 48.170 1.00 67.53 C ATOM 378 C THR A 389 10.028 -8.437 49.237 1.00 69.42 C ATOM 379 O THR A 389 9.820 -8.194 50.420 1.00 78.14 O ATOM 380 CB THR A 389 9.413 -6.630 47.637 1.00 65.84 C ATOM 381 OG1 THR A 389 9.882 -5.833 48.713 1.00 71.14 O ATOM 382 CG2 THR A 389 8.222 -5.967 47.016 1.00 65.44 C ATOM 383 HG1 THR A 389 10.677 -6.262 49.118 1.00 0.00 H ATOM 384 H THR A 389 7.165 -7.123 48.830 1.00 0.00 H ATOM 385 N GLU A 390 11.112 -9.083 48.823 1.00 75.09 N ATOM 386 CA GLU A 390 12.006 -9.735 49.771 1.00 76.29 C ATOM 387 C GLU A 390 13.426 -9.181 49.729 1.00 78.03 C ATOM 388 O GLU A 390 13.938 -8.850 48.663 1.00 78.72 O ATOM 389 CB GLU A 390 12.049 -11.244 49.502 1.00 78.58 C ATOM 390 CG GLU A 390 10.701 -11.931 49.327 1.00 78.24 C ATOM 391 CD GLU A 390 10.676 -13.314 49.932 1.00 79.96 C ATOM 392 OE1 GLU A 390 11.042 -13.439 51.110 1.00 79.84 O ATOM 393 OE2 GLU A 390 10.284 -14.272 49.245 1.00 81.76 O ATOM 394 H GLU A 390 11.326 -9.124 47.806 1.00 0.00 H ATOM 395 N LEU A 391 14.046 -9.098 50.915 1.00 78.09 N ATOM 396 CA LEU A 391 15.420 -8.659 51.179 1.00 91.30 C ATOM 397 C LEU A 391 16.096 -9.654 52.119 1.00106.85 C ATOM 398 O LEU A 391 15.431 -10.451 52.784 1.00110.39 O ATOM 399 CB LEU A 391 15.476 -7.265 51.804 1.00 91.06 C ATOM 400 CG LEU A 391 15.327 -6.075 50.881 1.00 94.59 C ATOM 401 CD1 LEU A 391 15.479 -4.823 51.681 1.00100.96 C ATOM 402 CD2 LEU A 391 16.458 -6.178 49.902 1.00101.66 C ATOM 403 H LEU A 391 13.486 -9.378 51.746 1.00 0.00 H ATOM 404 N ASP A 392 17.426 -9.587 52.219 1.00107.88 N ATOM 405 CA ASP A 392 18.109 -10.492 53.136 1.00113.98 C ATOM 406 C ASP A 392 17.797 -10.134 54.573 1.00108.23 C ATOM 407 O ASP A 392 17.611 -8.963 54.914 1.00107.06 O ATOM 408 CB ASP A 392 19.622 -10.480 52.967 1.00123.30 C ATOM 409 CG ASP A 392 20.299 -11.540 53.840 1.00129.64 C ATOM 410 OD1 ASP A 392 19.866 -12.710 53.797 1.00129.44 O ATOM 411 OD2 ASP A 392 21.242 -11.206 54.595 1.00132.97 O ATOM 412 H ASP A 392 17.965 -8.901 51.653 1.00 0.00 H ATOM 413 N ARG A 393 17.803 -11.164 55.423 1.00113.24 N ATOM 414 CA ARG A 393 17.428 -10.992 56.818 1.00108.84 C ATOM 415 C ARG A 393 18.163 -9.806 57.423 1.00106.12 C ATOM 416 O ARG A 393 17.606 -9.058 58.231 1.00105.91 O ATOM 417 CB ARG A 393 17.771 -12.274 57.581 1.00117.25 C ATOM 418 CG ARG A 393 17.080 -12.497 58.913 1.00125.12 C ATOM 419 CD ARG A 393 17.068 -14.008 59.218 1.00131.39 C ATOM 420 NE ARG A 393 15.773 -14.680 59.089 1.00130.10 N ATOM 421 CZ ARG A 393 14.969 -14.970 60.108 1.00130.56 C ATOM 422 NH1 ARG A 393 15.310 -14.636 61.348 1.00134.08 N ATOM 423 NH2 ARG A 393 13.825 -15.602 59.890 1.00126.06 N ATOM 424 HE ARG A 393 15.460 -14.949 58.134 1.00 0.00 H ATOM 425 HH12 ARG A 393 14.677 -14.865 62.141 1.00 0.00 H ATOM 426 HH11 ARG A 393 16.210 -14.145 61.526 1.00 0.00 H ATOM 427 HH22 ARG A 393 13.196 -15.829 60.687 1.00 0.00 H ATOM 428 HH21 ARG A 393 13.556 -15.871 58.922 1.00 0.00 H ATOM 429 H ARG A 393 18.081 -12.106 55.081 1.00 0.00 H ATOM 430 N THR A 394 19.427 -9.625 57.041 1.00111.25 N ATOM 431 CA THR A 394 20.167 -8.434 57.438 1.00111.76 C ATOM 432 C THR A 394 19.511 -7.161 56.921 1.00103.46 C ATOM 433 O THR A 394 19.163 -6.270 57.701 1.00102.55 O ATOM 434 CB THR A 394 21.622 -8.528 56.970 1.00119.15 C ATOM 435 OG1 THR A 394 21.682 -9.184 55.699 1.00123.80 O ATOM 436 CG2 THR A 394 22.436 -9.338 57.984 1.00122.71 C ATOM 437 HG1 THR A 394 21.305 -10.096 55.781 1.00 0.00 H ATOM 438 H THR A 394 19.892 -10.344 56.451 1.00 0.00 H ATOM 439 N PHE A 395 19.307 -7.058 55.612 1.00 91.67 N ATOM 440 CA PHE A 395 18.902 -5.764 55.092 1.00 89.25 C ATOM 441 C PHE A 395 17.601 -5.334 55.716 1.00 86.51 C ATOM 442 O PHE A 395 17.425 -4.161 56.042 1.00 89.47 O ATOM 443 CB PHE A 395 18.772 -5.802 53.586 1.00 97.95 C ATOM 444 CG PHE A 395 20.047 -6.025 52.900 1.00113.24 C ATOM 445 CD1 PHE A 395 21.193 -6.321 53.614 1.00127.20 C ATOM 446 CD2 PHE A 395 20.118 -5.895 51.545 1.00116.73 C ATOM 447 CE1 PHE A 395 22.368 -6.523 52.980 1.00136.71 C ATOM 448 CE2 PHE A 395 21.278 -6.083 50.903 1.00126.83 C ATOM 449 CZ PHE A 395 22.415 -6.399 51.613 1.00135.89 C ATOM 450 H PHE A 395 19.433 -7.876 54.982 1.00 0.00 H ATOM 451 N VAL A 396 16.679 -6.274 55.903 1.00 86.61 N ATOM 452 CA VAL A 396 15.399 -5.950 56.534 1.00 96.50 C ATOM 453 C VAL A 396 15.601 -5.447 57.963 1.00104.97 C ATOM 454 O VAL A 396 15.049 -4.415 58.354 1.00115.79 O ATOM 455 CB VAL A 396 14.419 -7.140 56.461 1.00101.21 C ATOM 456 CG1 VAL A 396 15.034 -8.402 56.927 1.00106.61 C ATOM 457 CG2 VAL A 396 13.226 -6.884 57.339 1.00104.27 C ATOM 458 H VAL A 396 16.870 -7.250 55.598 1.00 0.00 H ATOM 459 N GLU A 397 16.343 -6.188 58.780 1.00106.12 N ATOM 460 CA GLU A 397 16.422 -5.833 60.195 1.00102.63 C ATOM 461 C GLU A 397 17.013 -4.452 60.413 1.00 99.08 C ATOM 462 O GLU A 397 16.686 -3.789 61.403 1.00 93.71 O ATOM 463 CB GLU A 397 17.218 -6.869 60.970 1.00103.96 C ATOM 464 CG GLU A 397 16.354 -7.981 61.507 1.00104.18 C ATOM 465 CD GLU A 397 16.812 -8.473 62.860 1.00110.22 C ATOM 466 OE1 GLU A 397 16.118 -9.337 63.436 1.00112.53 O ATOM 467 OE2 GLU A 397 17.821 -7.952 63.377 1.00116.71 O ATOM 468 H GLU A 397 16.862 -7.012 58.416 1.00 0.00 H ATOM 469 N GLU A 398 17.931 -4.029 59.554 1.00 99.13 N ATOM 470 CA GLU A 398 18.593 -2.759 59.799 1.00102.41 C ATOM 471 C GLU A 398 17.625 -1.602 59.597 1.00 96.53 C ATOM 472 O GLU A 398 17.475 -0.751 60.478 1.00102.02 O ATOM 473 CB GLU A 398 19.806 -2.619 58.864 1.00105.70 C ATOM 474 CG GLU A 398 21.199 -2.584 59.519 1.00108.08 C ATOM 475 CD GLU A 398 22.322 -2.341 58.508 1.00107.72 C ATOM 476 OE1 GLU A 398 22.488 -1.193 58.062 1.00108.54 O ATOM 477 OE2 GLU A 398 23.041 -3.296 58.154 1.00108.28 O ATOM 478 H GLU A 398 18.173 -4.598 58.718 1.00 0.00 H ATOM 479 N ILE A 399 16.879 -1.621 58.492 1.00 83.20 N ATOM 480 CA ILE A 399 16.164 -0.439 58.032 1.00 90.85 C ATOM 481 C ILE A 399 15.007 -0.035 58.916 1.00 90.07 C ATOM 482 O ILE A 399 14.508 1.084 58.775 1.00 85.10 O ATOM 483 CB ILE A 399 15.637 -0.701 56.613 1.00 93.36 C ATOM 484 CG1 ILE A 399 15.051 -2.107 56.562 1.00 89.74 C ATOM 485 CG2 ILE A 399 16.762 -0.555 55.592 1.00100.21 C ATOM 486 CD1 ILE A 399 14.162 -2.403 55.379 1.00 91.40 C ATOM 487 H ILE A 399 16.806 -2.502 57.945 1.00 0.00 H ATOM 488 N GLY A 400 14.607 -0.876 59.862 1.00 85.40 N ATOM 489 CA GLY A 400 13.407 -0.555 60.598 1.00 82.65 C ATOM 490 C GLY A 400 13.568 0.772 61.294 1.00 85.00 C ATOM 491 O GLY A 400 12.822 1.717 61.032 1.00 78.87 O ATOM 492 H GLY A 400 15.144 -1.743 60.067 1.00 0.00 H ATOM 493 N GLU A 401 14.593 0.882 62.131 1.00 91.71 N ATOM 494 CA GLU A 401 14.809 2.145 62.820 1.00 98.28 C ATOM 495 C GLU A 401 14.998 3.278 61.821 1.00 98.70 C ATOM 496 O GLU A 401 14.403 4.346 62.029 1.00115.16 O ATOM 497 CB GLU A 401 15.976 2.031 63.827 1.00100.77 C ATOM 498 CG GLU A 401 16.005 3.197 64.853 1.00 99.84 C ATOM 499 CD GLU A 401 15.418 2.821 66.216 1.00 95.76 C ATOM 500 OE1 GLU A 401 15.402 1.617 66.525 1.00 92.57 O ATOM 501 OE2 GLU A 401 14.892 3.709 66.927 1.00 93.89 O ATOM 502 H GLU A 401 15.232 0.077 62.292 1.00 0.00 H ATOM 503 N PRO A 402 15.768 3.134 60.749 1.00 88.21 N ATOM 504 CA PRO A 402 15.802 4.213 59.774 1.00 81.65 C ATOM 505 C PRO A 402 14.433 4.541 59.247 1.00 78.20 C ATOM 506 O PRO A 402 14.010 5.704 59.280 1.00 78.45 O ATOM 507 CB PRO A 402 16.703 3.653 58.671 1.00 81.94 C ATOM 508 CG PRO A 402 17.567 2.739 59.359 1.00 84.94 C ATOM 509 CD PRO A 402 16.800 2.141 60.464 1.00 85.09 C ATOM 510 N LEU A 403 13.707 3.532 58.786 1.00 76.01 N ATOM 511 CA LEU A 403 12.370 3.806 58.303 1.00 73.20 C ATOM 512 C LEU A 403 11.558 4.450 59.389 1.00 73.54 C ATOM 513 O LEU A 403 10.813 5.394 59.136 1.00 73.41 O ATOM 514 CB LEU A 403 11.700 2.528 57.823 1.00 71.49 C ATOM 515 CG LEU A 403 12.465 1.888 56.693 1.00 71.84 C ATOM 516 CD1 LEU A 403 11.658 0.769 56.172 1.00 76.20 C ATOM 517 CD2 LEU A 403 12.644 2.921 55.641 1.00 74.55 C ATOM 518 H LEU A 403 14.090 2.565 58.772 1.00 0.00 H ATOM 519 N LEU A 404 11.751 4.010 60.619 1.00 72.76 N ATOM 520 CA LEU A 404 10.914 4.542 61.666 1.00 74.81 C ATOM 521 C LEU A 404 11.109 6.029 61.775 1.00 77.01 C ATOM 522 O LEU A 404 10.164 6.758 62.091 1.00 77.84 O ATOM 523 CB LEU A 404 11.208 3.870 63.005 1.00 76.91 C ATOM 524 CG LEU A 404 10.048 3.114 63.650 1.00 83.17 C ATOM 525 CD1 LEU A 404 10.360 2.755 65.083 1.00 96.99 C ATOM 526 CD2 LEU A 404 8.806 3.944 63.600 1.00 80.12 C ATOM 527 H LEU A 404 12.484 3.302 60.826 1.00 0.00 H ATOM 528 N HIS A 405 12.323 6.504 61.540 1.00 77.11 N ATOM 529 CA HIS A 405 12.522 7.935 61.659 1.00 85.73 C ATOM 530 C HIS A 405 11.681 8.649 60.626 1.00 81.23 C ATOM 531 O HIS A 405 10.731 9.346 60.976 1.00 75.39 O ATOM 532 CB HIS A 405 14.004 8.295 61.490 1.00101.31 C ATOM 533 CG HIS A 405 14.359 9.663 61.994 1.00104.75 C ATOM 534 ND1 HIS A 405 15.224 10.505 61.333 1.00107.11 N ATOM 535 CD2 HIS A 405 13.990 10.317 63.120 1.00106.12 C ATOM 536 CE1 HIS A 405 15.356 11.626 62.019 1.00106.73 C ATOM 537 NE2 HIS A 405 14.619 11.537 63.109 1.00106.74 N ATOM 538 H HIS A 405 13.107 5.872 61.279 1.00 0.00 H ATOM 539 N LEU A 406 11.863 8.272 59.364 1.00 84.42 N ATOM 540 CA LEU A 406 11.186 8.928 58.255 1.00 73.97 C ATOM 541 C LEU A 406 9.675 8.976 58.442 1.00 71.32 C ATOM 542 O LEU A 406 9.030 9.959 58.066 1.00 70.39 O ATOM 543 CB LEU A 406 11.562 8.218 56.968 1.00 71.45 C ATOM 544 CG LEU A 406 13.044 8.339 56.689 1.00 74.88 C ATOM 545 CD1 LEU A 406 13.336 7.552 55.459 1.00 72.67 C ATOM 546 CD2 LEU A 406 13.418 9.782 56.534 1.00 84.87 C ATOM 547 H LEU A 406 12.510 7.483 59.163 1.00 0.00 H ATOM 548 N LEU A 407 9.082 7.907 58.974 1.00 77.17 N ATOM 549 CA LEU A 407 7.652 7.936 59.263 1.00 74.67 C ATOM 550 C LEU A 407 7.318 9.031 60.257 1.00 75.08 C ATOM 551 O LEU A 407 6.442 9.872 60.013 1.00 74.50 O ATOM 552 CB LEU A 407 7.196 6.586 59.827 1.00 75.62 C ATOM 553 CG LEU A 407 6.969 5.349 58.982 1.00 73.79 C ATOM 554 CD1 LEU A 407 6.766 4.199 59.901 1.00 83.88 C ATOM 555 CD2 LEU A 407 5.705 5.565 58.233 1.00 69.54 C ATOM 556 H LEU A 407 9.638 7.053 59.183 1.00 0.00 H ATOM 557 N ARG A 408 8.079 9.082 61.346 1.00 68.36 N ATOM 558 CA ARG A 408 7.717 9.941 62.450 1.00 71.54 C ATOM 559 C ARG A 408 7.596 11.375 61.993 1.00 84.88 C ATOM 560 O ARG A 408 6.544 11.994 62.169 1.00 91.54 O ATOM 561 CB ARG A 408 8.763 9.797 63.550 1.00 74.21 C ATOM 562 CG ARG A 408 8.546 10.657 64.772 1.00 77.64 C ATOM 563 CD ARG A 408 9.712 10.555 65.749 1.00 81.52 C ATOM 564 NE ARG A 408 10.050 11.865 66.287 1.00 87.07 N ATOM 565 CZ ARG A 408 9.712 12.284 67.501 1.00 98.56 C ATOM 566 NH1 ARG A 408 9.036 11.486 68.320 1.00107.50 N ATOM 567 NH2 ARG A 408 10.056 13.502 67.896 1.00105.54 N ATOM 568 HE ARG A 408 10.591 12.515 65.681 1.00 0.00 H ATOM 569 HH12 ARG A 408 8.773 11.818 69.270 1.00 0.00 H ATOM 570 HH11 ARG A 408 8.770 10.529 68.011 1.00 0.00 H ATOM 571 HH22 ARG A 408 9.793 13.834 68.846 1.00 0.00 H ATOM 572 HH21 ARG A 408 10.588 14.125 67.256 1.00 0.00 H ATOM 573 H ARG A 408 8.939 8.501 61.404 1.00 0.00 H ATOM 574 N ASN A 409 8.599 11.874 61.273 1.00 84.81 N ATOM 575 CA ASN A 409 8.555 13.279 60.889 1.00 89.94 C ATOM 576 C ASN A 409 7.262 13.582 60.143 1.00 76.80 C ATOM 577 O ASN A 409 6.586 14.573 60.437 1.00 72.74 O ATOM 578 CB ASN A 409 9.792 13.673 60.061 1.00 94.98 C ATOM 579 CG ASN A 409 10.804 12.566 59.968 1.00 97.52 C ATOM 580 OD1 ASN A 409 10.432 11.423 60.030 1.00 97.01 O ATOM 581 ND2 ASN A 409 12.073 12.897 59.769 1.00 99.58 N ATOM 582 HD22 ASN A 409 12.348 13.899 59.723 1.00 0.00 H ATOM 583 HD21 ASN A 409 12.793 12.155 59.659 1.00 0.00 H ATOM 584 H ASN A 409 9.399 11.272 60.990 1.00 0.00 H ATOM 585 N ALA A 410 6.864 12.706 59.226 1.00 73.82 N ATOM 586 CA ALA A 410 5.642 12.960 58.483 1.00 74.89 C ATOM 587 C ALA A 410 4.475 13.150 59.425 1.00 73.69 C ATOM 588 O ALA A 410 3.774 14.159 59.365 1.00 80.25 O ATOM 589 CB ALA A 410 5.369 11.819 57.518 1.00 83.33 C ATOM 590 H ALA A 410 7.422 11.848 59.042 1.00 0.00 H ATOM 591 N ILE A 411 4.249 12.195 60.312 1.00 71.58 N ATOM 592 CA ILE A 411 3.225 12.408 61.320 1.00 75.73 C ATOM 593 C ILE A 411 3.574 13.634 62.144 1.00 75.62 C ATOM 594 O ILE A 411 2.764 14.549 62.316 1.00 76.48 O ATOM 595 CB ILE A 411 3.057 11.160 62.199 1.00 78.93 C ATOM 596 CG1 ILE A 411 2.904 9.921 61.343 1.00 75.76 C ATOM 597 CG2 ILE A 411 1.881 11.315 63.091 1.00 86.72 C ATOM 598 CD1 ILE A 411 4.050 9.008 61.471 1.00 72.39 C ATOM 599 H ILE A 411 4.794 11.309 60.288 1.00 0.00 H ATOM 600 N ASP A 412 4.796 13.670 62.657 1.00 77.03 N ATOM 601 CA ASP A 412 5.157 14.707 63.604 1.00 84.30 C ATOM 602 C ASP A 412 5.135 16.052 62.910 1.00 84.01 C ATOM 603 O ASP A 412 4.365 16.941 63.278 1.00 86.48 O ATOM 604 CB ASP A 412 6.537 14.390 64.204 1.00 94.27 C ATOM 605 CG ASP A 412 6.906 15.263 65.403 1.00108.33 C ATOM 606 OD1 ASP A 412 7.986 15.022 66.000 1.00107.42 O ATOM 607 OD2 ASP A 412 6.128 16.159 65.768 1.00120.62 O ATOM 608 H ASP A 412 5.497 12.953 62.380 1.00 0.00 H ATOM 609 N HIS A 413 5.899 16.178 61.840 1.00 77.89 N ATOM 610 CA HIS A 413 6.052 17.435 61.135 1.00 86.63 C ATOM 611 C HIS A 413 5.410 17.471 59.769 1.00 90.54 C ATOM 612 O HIS A 413 5.053 18.553 59.316 1.00 93.34 O ATOM 613 CB HIS A 413 7.536 17.788 61.011 1.00 93.24 C ATOM 614 CG HIS A 413 8.043 18.593 62.163 1.00101.20 C ATOM 615 ND1 HIS A 413 7.219 19.416 62.900 1.00103.83 N ATOM 616 CD2 HIS A 413 9.264 18.672 62.738 1.00105.16 C ATOM 617 CE1 HIS A 413 7.919 19.998 63.855 1.00107.40 C ATOM 618 NE2 HIS A 413 9.162 19.558 63.783 1.00110.40 N ATOM 619 H HIS A 413 6.411 15.343 61.490 1.00 0.00 H ATOM 620 N GLY A 414 5.285 16.339 59.078 1.00 84.62 N ATOM 621 CA GLY A 414 4.747 16.387 57.728 1.00 82.98 C ATOM 622 C GLY A 414 3.264 16.710 57.657 1.00 84.13 C ATOM 623 O GLY A 414 2.866 17.644 56.964 1.00 86.15 O ATOM 624 H GLY A 414 5.569 15.431 59.499 1.00 0.00 H ATOM 625 N ILE A 415 2.429 15.958 58.375 1.00 85.63 N ATOM 626 CA ILE A 415 0.970 16.073 58.252 1.00 88.26 C ATOM 627 C ILE A 415 0.420 17.221 59.096 1.00 86.14 C ATOM 628 O ILE A 415 0.646 17.282 60.307 1.00 87.69 O ATOM 629 CB ILE A 415 0.266 14.753 58.601 1.00 95.49 C ATOM 630 CG1 ILE A 415 0.458 13.729 57.484 1.00 95.17 C ATOM 631 CG2 ILE A 415 -1.213 14.976 58.879 1.00101.94 C ATOM 632 CD1 ILE A 415 0.383 12.300 57.923 1.00 96.47 C ATOM 633 H ILE A 415 2.824 15.267 59.044 1.00 0.00 H ATOM 634 N GLU A 416 -0.327 18.122 58.456 1.00106.50 N ATOM 635 CA GLU A 416 -0.877 19.295 59.125 1.00111.57 C ATOM 636 C GLU A 416 -2.061 18.993 60.046 1.00119.93 C ATOM 637 O GLU A 416 -2.741 17.970 59.909 1.00108.91 O ATOM 638 CB GLU A 416 -1.317 20.317 58.090 1.00 98.68 C ATOM 639 CG GLU A 416 -0.265 20.633 57.094 1.00 84.30 C ATOM 640 CD GLU A 416 -0.405 19.834 55.849 1.00 80.46 C ATOM 641 OE1 GLU A 416 -0.787 18.665 55.970 1.00 83.48 O ATOM 642 OE2 GLU A 416 -0.138 20.359 54.752 1.00 80.78 O ATOM 643 H GLU A 416 -0.524 17.983 57.444 1.00 0.00 H ATOM 644 N PRO A 417 -2.353 19.911 60.963 1.00129.52 N ATOM 645 CA PRO A 417 -3.581 19.805 61.750 1.00131.62 C ATOM 646 C PRO A 417 -4.806 20.078 60.902 1.00122.06 C ATOM 647 O PRO A 417 -4.750 20.789 59.906 1.00117.33 O ATOM 648 CB PRO A 417 -3.407 20.893 62.814 1.00143.02 C ATOM 649 CG PRO A 417 -1.911 21.027 62.974 1.00142.70 C ATOM 650 CD PRO A 417 -1.355 20.797 61.591 1.00137.41 C ATOM 651 N LYS A 418 -5.940 19.563 61.366 1.00131.71 N ATOM 652 CA LYS A 418 -7.152 19.621 60.559 1.00131.17 C ATOM 653 C LYS A 418 -7.551 21.054 60.187 1.00128.78 C ATOM 654 O LYS A 418 -7.764 21.340 59.007 1.00118.31 O ATOM 655 CB LYS A 418 -8.289 18.890 61.279 1.00134.27 C ATOM 656 CG LYS A 418 -9.100 17.929 60.392 1.00131.86 C ATOM 657 CD LYS A 418 -9.856 16.846 61.192 1.00133.48 C ATOM 658 CE LYS A 418 -11.062 17.396 61.962 1.00135.81 C ATOM 659 NZ LYS A 418 -11.972 16.323 62.470 1.00133.07 N ATOM 660 HZ1 LYS A 418 -12.335 15.770 61.668 1.00 0.00 H ATOM 661 HZ2 LYS A 418 -11.445 15.699 63.113 1.00 0.00 H ATOM 662 HZ3 LYS A 418 -12.767 16.757 62.981 1.00 0.00 H ATOM 663 H LYS A 418 -5.962 19.118 62.306 1.00 0.00 H ATOM 664 N GLU A 419 -7.598 21.989 61.154 1.00137.69 N ATOM 665 CA GLU A 419 -8.094 23.338 60.828 1.00142.67 C ATOM 666 C GLU A 419 -7.241 24.035 59.784 1.00147.32 C ATOM 667 O GLU A 419 -7.763 24.691 58.874 1.00146.88 O ATOM 668 CB GLU A 419 -8.135 24.291 62.025 1.00140.57 C ATOM 669 CG GLU A 419 -8.800 23.974 63.342 1.00143.74 C ATOM 670 CD GLU A 419 -8.659 25.190 64.281 1.00146.96 C ATOM 671 OE1 GLU A 419 -8.855 26.312 63.765 1.00145.80 O ATOM 672 OE2 GLU A 419 -8.364 25.055 65.494 1.00147.24 O ATOM 673 H GLU A 419 -7.288 21.762 62.120 1.00 0.00 H ATOM 674 N GLU A 420 -5.925 24.005 59.970 1.00145.11 N ATOM 675 CA GLU A 420 -5.046 24.654 59.011 1.00144.89 C ATOM 676 C GLU A 420 -5.003 23.840 57.726 1.00145.91 C ATOM 677 O GLU A 420 -5.041 24.402 56.625 1.00150.27 O ATOM 678 CB GLU A 420 -3.663 24.857 59.626 1.00143.52 C ATOM 679 CG GLU A 420 -3.719 25.710 60.907 1.00144.65 C ATOM 680 CD GLU A 420 -3.388 27.183 60.707 1.00141.00 C ATOM 681 OE1 GLU A 420 -2.270 27.603 61.074 1.00141.05 O ATOM 682 OE2 GLU A 420 -4.254 27.930 60.205 1.00142.09 O ATOM 683 H GLU A 420 -5.526 23.519 60.798 1.00 0.00 H ATOM 684 N ARG A 421 -4.925 22.510 57.855 1.00132.66 N ATOM 685 CA ARG A 421 -4.893 21.630 56.689 1.00130.87 C ATOM 686 C ARG A 421 -6.196 21.693 55.898 1.00127.59 C ATOM 687 O ARG A 421 -6.177 21.697 54.661 1.00125.36 O ATOM 688 CB ARG A 421 -4.608 20.188 57.113 1.00129.98 C ATOM 689 H ARG A 421 -4.886 22.093 58.807 1.00 0.00 H ATOM 690 N ILE A 422 -7.339 21.713 56.592 1.00134.92 N ATOM 691 CA ILE A 422 -8.618 21.744 55.888 1.00120.68 C ATOM 692 C ILE A 422 -8.711 22.951 54.967 1.00133.58 C ATOM 693 O ILE A 422 -9.330 22.872 53.902 1.00128.94 O ATOM 694 CB ILE A 422 -9.801 21.697 56.881 1.00114.54 C ATOM 695 CG1 ILE A 422 -11.107 21.493 56.128 1.00115.55 C ATOM 696 CG2 ILE A 422 -9.904 22.958 57.699 1.00117.70 C ATOM 697 CD1 ILE A 422 -12.235 20.938 56.990 1.00118.08 C ATOM 698 H ILE A 422 -7.317 21.706 57.632 1.00 0.00 H ATOM 699 N ALA A 423 -8.098 24.072 55.355 1.00135.90 N ATOM 700 CA ALA A 423 -8.192 25.323 54.606 1.00139.12 C ATOM 701 C ALA A 423 -7.668 25.242 53.169 1.00137.48 C ATOM 702 O ALA A 423 -8.215 25.906 52.276 1.00145.49 O ATOM 703 CB ALA A 423 -7.437 26.423 55.356 1.00142.84 C ATOM 704 H ALA A 423 -7.530 24.054 56.226 1.00 0.00 H ATOM 705 N LYS A 424 -6.634 24.448 52.911 1.00139.72 N ATOM 706 CA LYS A 424 -6.004 24.496 51.598 1.00114.14 C ATOM 707 C LYS A 424 -6.751 23.688 50.547 1.00108.01 C ATOM 708 O LYS A 424 -6.401 23.751 49.366 1.00105.99 O ATOM 709 CB LYS A 424 -4.554 24.009 51.736 1.00 99.56 C ATOM 710 CG LYS A 424 -3.728 23.896 50.447 1.00 97.83 C ATOM 711 CD LYS A 424 -3.747 25.174 49.590 1.00 99.95 C ATOM 712 CE LYS A 424 -3.020 24.982 48.256 1.00 96.69 C ATOM 713 NZ LYS A 424 -3.850 24.244 47.267 1.00 94.16 N ATOM 714 HZ1 LYS A 424 -4.085 23.305 47.646 1.00 0.00 H ATOM 715 HZ2 LYS A 424 -4.725 24.775 47.086 1.00 0.00 H ATOM 716 HZ3 LYS A 424 -3.318 24.138 46.380 1.00 0.00 H ATOM 717 H LYS A 424 -6.277 23.798 53.640 1.00 0.00 H ATOM 718 N GLY A 425 -7.851 23.053 50.905 1.00105.58 N ATOM 719 CA GLY A 425 -8.538 22.201 49.969 1.00100.10 C ATOM 720 C GLY A 425 -7.997 20.803 49.936 1.00 91.60 C ATOM 721 O GLY A 425 -8.458 19.991 49.127 1.00 91.78 O ATOM 722 H GLY A 425 -8.224 23.169 51.869 1.00 0.00 H ATOM 723 N LYS A 426 -7.102 20.506 50.765 1.00 78.96 N ATOM 724 CA LYS A 426 -6.713 19.115 50.803 1.00 83.82 C ATOM 725 C LYS A 426 -7.620 18.402 51.786 1.00 83.02 C ATOM 726 O LYS A 426 -8.114 19.017 52.731 1.00 91.05 O ATOM 727 CB LYS A 426 -5.260 18.968 51.263 1.00 97.67 C ATOM 728 CG LYS A 426 -4.302 20.049 50.787 1.00105.60 C ATOM 729 CD LYS A 426 -2.855 19.724 51.157 1.00103.92 C ATOM 730 CE LYS A 426 -2.738 19.193 52.571 1.00104.73 C ATOM 731 NZ LYS A 426 -1.424 19.569 53.136 1.00104.95 N ATOM 732 HZ1 LYS A 426 -0.667 19.162 52.550 1.00 0.00 H ATOM 733 HZ2 LYS A 426 -1.337 20.605 53.147 1.00 0.00 H ATOM 734 HZ3 LYS A 426 -1.348 19.203 54.106 1.00 0.00 H ATOM 735 H LYS A 426 -6.667 21.218 51.386 1.00 0.00 H ATOM 736 N PRO A 427 -7.876 17.122 51.568 1.00 83.03 N ATOM 737 CA PRO A 427 -8.729 16.384 52.463 1.00 84.48 C ATOM 738 C PRO A 427 -8.257 16.537 53.891 1.00 89.35 C ATOM 739 O PRO A 427 -7.068 16.761 54.133 1.00 85.05 O ATOM 740 CB PRO A 427 -8.567 14.934 51.991 1.00 81.52 C ATOM 741 CG PRO A 427 -8.160 15.024 50.598 1.00 81.32 C ATOM 742 CD PRO A 427 -7.674 16.411 50.302 1.00 84.89 C ATOM 743 N PRO A 428 -9.165 16.451 54.856 1.00 93.11 N ATOM 744 CA PRO A 428 -8.773 16.685 56.254 1.00 95.99 C ATOM 745 C PRO A 428 -7.835 15.627 56.814 1.00100.99 C ATOM 746 O PRO A 428 -7.060 15.920 57.739 1.00110.36 O ATOM 747 CB PRO A 428 -10.112 16.693 56.999 1.00 97.65 C ATOM 748 CG PRO A 428 -11.159 16.906 55.930 1.00 99.21 C ATOM 749 CD PRO A 428 -10.616 16.268 54.701 1.00 95.13 C ATOM 750 N ILE A 429 -7.916 14.394 56.324 1.00101.50 N ATOM 751 CA ILE A 429 -7.158 13.271 56.861 1.00 90.69 C ATOM 752 C ILE A 429 -5.899 13.044 56.026 1.00 81.44 C ATOM 753 O ILE A 429 -5.975 12.592 54.882 1.00 76.00 O ATOM 754 CB ILE A 429 -8.029 12.014 56.899 1.00 85.37 C ATOM 755 CG1 ILE A 429 -9.424 12.364 57.412 1.00 82.68 C ATOM 756 CG2 ILE A 429 -7.430 11.012 57.849 1.00 88.59 C ATOM 757 CD1 ILE A 429 -10.472 12.662 56.313 1.00 83.51 C ATOM 758 H ILE A 429 -8.551 14.222 55.518 1.00 0.00 H ATOM 759 N GLY A 430 -4.735 13.274 56.624 1.00 84.85 N ATOM 760 CA GLY A 430 -3.490 13.092 55.915 1.00 80.52 C ATOM 761 C GLY A 430 -3.218 11.634 55.618 1.00 77.87 C ATOM 762 O GLY A 430 -3.727 10.732 56.270 1.00 86.51 O ATOM 763 H GLY A 430 -4.720 13.589 57.615 1.00 0.00 H ATOM 764 N THR A 431 -2.423 11.396 54.587 1.00 65.76 N ATOM 765 CA THR A 431 -2.138 10.050 54.128 1.00 70.28 C ATOM 766 C THR A 431 -0.652 9.784 54.217 1.00 71.56 C ATOM 767 O THR A 431 0.147 10.621 53.808 1.00 72.38 O ATOM 768 CB THR A 431 -2.590 9.873 52.705 1.00 80.73 C ATOM 769 OG1 THR A 431 -1.530 10.318 51.859 1.00 87.93 O ATOM 770 CG2 THR A 431 -3.812 10.722 52.451 1.00 83.21 C ATOM 771 HG1 THR A 431 -1.339 11.271 52.045 1.00 0.00 H ATOM 772 H THR A 431 -1.989 12.200 54.090 1.00 0.00 H ATOM 773 N LEU A 432 -0.289 8.634 54.765 1.00 73.78 N ATOM 774 CA LEU A 432 1.105 8.252 54.902 1.00 65.14 C ATOM 775 C LEU A 432 1.308 6.888 54.276 1.00 61.66 C ATOM 776 O LEU A 432 0.637 5.932 54.657 1.00 65.63 O ATOM 777 CB LEU A 432 1.510 8.224 56.369 1.00 68.58 C ATOM 778 CG LEU A 432 2.980 8.060 56.687 1.00 78.55 C ATOM 779 CD1 LEU A 432 3.708 9.246 56.201 1.00 85.53 C ATOM 780 CD2 LEU A 432 3.125 7.958 58.152 1.00 85.34 C ATOM 781 H LEU A 432 -1.025 7.985 55.108 1.00 0.00 H ATOM 782 N ILE A 433 2.260 6.778 53.358 1.00 58.54 N ATOM 783 CA ILE A 433 2.467 5.552 52.603 1.00 58.23 C ATOM 784 C ILE A 433 3.879 5.053 52.779 1.00 58.45 C ATOM 785 O ILE A 433 4.833 5.790 52.563 1.00 59.11 O ATOM 786 CB ILE A 433 2.168 5.734 51.106 1.00 64.36 C ATOM 787 CG1 ILE A 433 1.081 6.777 50.882 1.00 70.84 C ATOM 788 CG2 ILE A 433 1.862 4.411 50.462 1.00 72.32 C ATOM 789 CD1 ILE A 433 0.722 6.976 49.431 1.00 73.99 C ATOM 790 H ILE A 433 2.878 7.594 53.173 1.00 0.00 H ATOM 791 N LEU A 434 4.006 3.799 53.145 1.00 54.03 N ATOM 792 CA LEU A 434 5.276 3.101 53.166 1.00 58.04 C ATOM 793 C LEU A 434 5.206 1.979 52.150 1.00 74.89 C ATOM 794 O LEU A 434 4.355 1.099 52.269 1.00 82.43 O ATOM 795 CB LEU A 434 5.558 2.543 54.546 1.00 59.04 C ATOM 796 CG LEU A 434 6.741 1.591 54.594 1.00 65.28 C ATOM 797 CD1 LEU A 434 8.063 2.224 54.286 1.00 68.08 C ATOM 798 CD2 LEU A 434 6.762 0.931 55.912 1.00 74.12 C ATOM 799 H LEU A 434 3.152 3.280 53.434 1.00 0.00 H ATOM 800 N SER A 435 6.072 2.014 51.139 1.00 71.51 N ATOM 801 CA SER A 435 6.010 1.037 50.053 1.00 68.66 C ATOM 802 C SER A 435 7.392 0.485 49.689 1.00 70.42 C ATOM 803 O SER A 435 8.396 1.196 49.743 1.00 78.56 O ATOM 804 CB SER A 435 5.307 1.620 48.802 1.00 69.66 C ATOM 805 OG SER A 435 5.563 2.994 48.557 1.00 77.79 O ATOM 806 HG SER A 435 5.076 3.279 47.743 1.00 0.00 H ATOM 807 H SER A 435 6.806 2.750 51.122 1.00 0.00 H ATOM 808 N ALA A 436 7.428 -0.792 49.294 1.00 69.99 N ATOM 809 CA ALA A 436 8.627 -1.446 48.767 1.00 68.91 C ATOM 810 C ALA A 436 8.336 -2.155 47.449 1.00 70.14 C ATOM 811 O ALA A 436 7.496 -3.051 47.404 1.00 75.68 O ATOM 812 CB ALA A 436 9.167 -2.459 49.764 1.00 69.48 C ATOM 813 H ALA A 436 6.555 -1.352 49.365 1.00 0.00 H ATOM 814 N ARG A 437 9.042 -1.786 46.389 1.00 78.89 N ATOM 815 CA ARG A 437 8.879 -2.436 45.099 1.00 75.96 C ATOM 816 C ARG A 437 10.238 -2.974 44.675 1.00 78.54 C ATOM 817 O ARG A 437 11.269 -2.355 44.948 1.00 80.84 O ATOM 818 CB ARG A 437 8.291 -1.473 44.048 1.00 71.57 C ATOM 819 CG ARG A 437 9.172 -0.283 43.698 1.00 76.23 C ATOM 820 CD ARG A 437 8.373 0.988 43.372 1.00 90.24 C ATOM 821 NE ARG A 437 9.073 1.852 42.399 1.00112.12 N ATOM 822 CZ ARG A 437 8.518 2.924 41.833 1.00130.03 C ATOM 823 NH1 ARG A 437 7.283 3.285 42.121 1.00138.96 N ATOM 824 NH2 ARG A 437 9.262 3.683 40.973 1.00137.17 N ATOM 825 HE ARG A 437 10.051 1.611 42.142 1.00 0.00 H ATOM 826 HH12 ARG A 437 6.868 4.125 41.669 1.00 0.00 H ATOM 827 HH11 ARG A 437 6.724 2.730 42.800 1.00 0.00 H ATOM 828 HH22 ARG A 437 8.843 4.522 40.524 1.00 0.00 H ATOM 829 HH21 ARG A 437 10.247 3.421 40.768 1.00 0.00 H ATOM 830 H ARG A 437 9.730 -1.012 46.483 1.00 0.00 H ATOM 831 N HIS A 438 10.235 -4.167 44.072 1.00 83.86 N ATOM 832 CA HIS A 438 11.448 -4.881 43.647 1.00 86.18 C ATOM 833 C HIS A 438 11.693 -4.557 42.185 1.00 83.69 C ATOM 834 O HIS A 438 11.303 -5.306 41.294 1.00 87.79 O ATOM 835 CB HIS A 438 11.257 -6.385 43.863 1.00 98.86 C ATOM 836 CG HIS A 438 12.376 -7.250 43.355 1.00111.42 C ATOM 837 ND1 HIS A 438 12.728 -7.303 42.024 1.00116.54 N ATOM 838 CD2 HIS A 438 13.152 -8.167 43.979 1.00114.90 C ATOM 839 CE1 HIS A 438 13.711 -8.170 41.859 1.00117.85 C ATOM 840 NE2 HIS A 438 13.985 -8.711 43.031 1.00117.21 N ATOM 841 H HIS A 438 9.316 -4.619 43.892 1.00 0.00 H ATOM 842 N GLU A 439 12.381 -3.449 41.933 1.00 83.64 N ATOM 843 CA GLU A 439 12.667 -3.006 40.575 1.00 86.43 C ATOM 844 C GLU A 439 14.101 -3.310 40.195 1.00 89.79 C ATOM 845 O GLU A 439 15.037 -2.843 40.851 1.00 89.65 O ATOM 846 CB GLU A 439 12.356 -1.515 40.369 1.00 86.77 C ATOM 847 CG GLU A 439 12.846 -0.520 41.414 1.00 95.87 C ATOM 848 CD GLU A 439 12.190 0.836 41.262 1.00101.70 C ATOM 849 OE1 GLU A 439 11.019 0.847 40.812 1.00101.83 O ATOM 850 OE2 GLU A 439 12.827 1.842 41.655 1.00107.44 O ATOM 851 H GLU A 439 12.727 -2.879 42.731 1.00 0.00 H ATOM 852 N GLY A 440 14.255 -4.091 39.134 1.00 98.03 N ATOM 853 CA GLY A 440 15.565 -4.321 38.567 1.00100.85 C ATOM 854 C GLY A 440 16.424 -5.130 39.504 1.00105.94 C ATOM 855 O GLY A 440 16.006 -6.145 40.066 1.00112.17 O ATOM 856 H GLY A 440 13.423 -4.544 38.705 1.00 0.00 H ATOM 857 N ASN A 441 17.616 -4.621 39.749 1.00 97.65 N ATOM 858 CA ASN A 441 18.546 -5.259 40.650 1.00100.35 C ATOM 859 C ASN A 441 18.687 -4.473 41.917 1.00 98.85 C ATOM 860 O ASN A 441 19.628 -4.700 42.671 1.00 96.98 O ATOM 861 CB ASN A 441 19.911 -5.387 39.987 1.00112.22 C ATOM 862 CG ASN A 441 19.810 -5.608 38.504 1.00120.59 C ATOM 863 OD1 ASN A 441 19.510 -4.683 37.743 1.00121.33 O ATOM 864 ND2 ASN A 441 20.078 -6.836 38.075 1.00124.53 N ATOM 865 HD22 ASN A 441 20.326 -7.582 38.756 1.00 0.00 H ATOM 866 HD21 ASN A 441 20.040 -7.052 37.058 1.00 0.00 H ATOM 867 H ASN A 441 17.894 -3.735 39.280 1.00 0.00 H ATOM 868 N ASN A 442 17.774 -3.548 42.159 1.00 92.91 N ATOM 869 CA ASN A 442 17.802 -2.716 43.343 1.00 93.23 C ATOM 870 C ASN A 442 16.445 -2.782 44.032 1.00 86.04 C ATOM 871 O ASN A 442 15.407 -2.900 43.377 1.00 88.66 O ATOM 872 CB ASN A 442 18.167 -1.268 42.985 1.00 97.70 C ATOM 873 CG ASN A 442 19.257 -1.182 41.928 1.00104.40 C ATOM 874 OD1 ASN A 442 20.447 -1.215 42.236 1.00106.75 O ATOM 875 ND2 ASN A 442 18.852 -1.059 40.676 1.00107.87 N ATOM 876 HD22 ASN A 442 17.835 -1.035 40.458 1.00 0.00 H ATOM 877 HD21 ASN A 442 19.550 -0.986 39.908 1.00 0.00 H ATOM 878 H ASN A 442 17.005 -3.413 41.472 1.00 0.00 H ATOM 879 N VAL A 443 16.467 -2.722 45.363 1.00 93.93 N ATOM 880 CA VAL A 443 15.259 -2.753 46.184 1.00 90.56 C ATOM 881 C VAL A 443 15.053 -1.355 46.745 1.00 84.88 C ATOM 882 O VAL A 443 15.904 -0.842 47.481 1.00 90.39 O ATOM 883 CB VAL A 443 15.364 -3.782 47.318 1.00 92.28 C ATOM 884 CG1 VAL A 443 14.370 -3.461 48.457 1.00 77.41 C ATOM 885 CG2 VAL A 443 15.190 -5.165 46.761 1.00103.11 C ATOM 886 H VAL A 443 17.388 -2.650 45.840 1.00 0.00 H ATOM 887 N VAL A 444 13.919 -0.748 46.422 1.00 74.54 N ATOM 888 CA VAL A 444 13.651 0.643 46.744 1.00 73.18 C ATOM 889 C VAL A 444 12.446 0.736 47.649 1.00 70.42 C ATOM 890 O VAL A 444 11.427 0.095 47.403 1.00 72.06 O ATOM 891 CB VAL A 444 13.481 1.492 45.479 1.00 73.95 C ATOM 892 CG1 VAL A 444 12.097 1.437 44.980 1.00 72.37 C ATOM 893 CG2 VAL A 444 13.832 2.899 45.786 1.00 87.14 C ATOM 894 H VAL A 444 13.190 -1.291 45.916 1.00 0.00 H ATOM 895 N ILE A 445 12.604 1.458 48.736 1.00 65.67 N ATOM 896 CA ILE A 445 11.566 1.698 49.718 1.00 63.60 C ATOM 897 C ILE A 445 11.232 3.166 49.648 1.00 62.93 C ATOM 898 O ILE A 445 12.113 3.991 49.438 1.00 64.25 O ATOM 899 CB ILE A 445 12.070 1.347 51.120 1.00 64.03 C ATOM 900 CG1 ILE A 445 12.741 -0.008 51.100 1.00 68.09 C ATOM 901 CG2 ILE A 445 10.957 1.398 52.099 1.00 62.42 C ATOM 902 CD1 ILE A 445 13.542 -0.258 52.324 1.00 73.83 C ATOM 903 H ILE A 445 13.537 1.886 48.902 1.00 0.00 H ATOM 904 N GLU A 446 9.976 3.503 49.778 1.00 58.42 N ATOM 905 CA GLU A 446 9.653 4.912 49.771 1.00 61.47 C ATOM 906 C GLU A 446 8.648 5.160 50.872 1.00 59.51 C ATOM 907 O GLU A 446 7.922 4.264 51.275 1.00 62.29 O ATOM 908 CB GLU A 446 9.125 5.400 48.427 1.00 71.14 C ATOM 909 CG GLU A 446 9.748 4.719 47.232 1.00 93.87 C ATOM 910 CD GLU A 446 9.231 5.252 45.902 1.00104.10 C ATOM 911 OE1 GLU A 446 8.855 6.434 45.862 1.00106.52 O ATOM 912 OE2 GLU A 446 9.155 4.493 44.909 1.00103.90 O ATOM 913 H GLU A 446 9.234 2.782 49.883 1.00 0.00 H ATOM 914 N VAL A 447 8.720 6.344 51.447 1.00 59.91 N ATOM 915 CA VAL A 447 7.751 6.819 52.406 1.00 59.19 C ATOM 916 C VAL A 447 7.295 8.177 51.919 1.00 65.64 C ATOM 917 O VAL A 447 8.119 9.070 51.717 1.00 69.88 O ATOM 918 CB VAL A 447 8.338 6.909 53.815 1.00 60.24 C ATOM 919 CG1 VAL A 447 8.551 5.571 54.344 1.00 60.40 C ATOM 920 CG2 VAL A 447 9.657 7.571 53.755 1.00 62.92 C ATOM 921 H VAL A 447 9.514 6.967 51.197 1.00 0.00 H ATOM 922 N GLU A 448 6.003 8.340 51.711 1.00 68.87 N ATOM 923 CA GLU A 448 5.496 9.621 51.264 1.00 70.94 C ATOM 924 C GLU A 448 4.281 10.022 52.079 1.00 73.80 C ATOM 925 O GLU A 448 3.558 9.174 52.601 1.00 72.68 O ATOM 926 CB GLU A 448 5.159 9.592 49.780 1.00 72.72 C ATOM 927 CG GLU A 448 4.726 8.256 49.224 1.00 80.64 C ATOM 928 CD GLU A 448 4.176 8.387 47.817 1.00 88.63 C ATOM 929 OE1 GLU A 448 4.170 9.526 47.306 1.00 93.74 O ATOM 930 OE2 GLU A 448 3.756 7.367 47.225 1.00 88.02 O ATOM 931 H GLU A 448 5.348 7.548 51.868 1.00 0.00 H ATOM 932 N ASP A 449 4.084 11.335 52.192 1.00 80.92 N ATOM 933 CA ASP A 449 3.026 11.952 52.985 1.00 78.29 C ATOM 934 C ASP A 449 2.470 13.121 52.194 1.00 66.10 C ATOM 935 O ASP A 449 3.180 13.708 51.382 1.00 70.62 O ATOM 936 CB ASP A 449 3.542 12.462 54.318 1.00 76.74 C ATOM 937 CG ASP A 449 4.561 13.540 54.149 1.00 80.93 C ATOM 938 OD1 ASP A 449 4.159 14.710 54.001 1.00 82.20 O ATOM 939 OD2 ASP A 449 5.759 13.213 54.146 1.00 91.42 O ATOM 940 H ASP A 449 4.731 11.966 51.678 1.00 0.00 H ATOM 941 N ASP A 450 1.215 13.480 52.445 1.00 71.10 N ATOM 942 CA ASP A 450 0.642 14.677 51.841 1.00 69.80 C ATOM 943 C ASP A 450 0.676 15.807 52.852 1.00 69.15 C ATOM 944 O ASP A 450 -0.345 16.257 53.333 1.00 71.29 O ATOM 945 CB ASP A 450 -0.774 14.409 51.327 1.00 73.22 C ATOM 946 CG ASP A 450 -1.671 13.796 52.366 1.00 80.21 C ATOM 947 OD1 ASP A 450 -2.883 14.107 52.361 1.00 91.01 O ATOM 948 OD2 ASP A 450 -1.154 13.035 53.207 1.00 83.43 O ATOM 949 H ASP A 450 0.633 12.899 53.082 1.00 0.00 H ATOM 950 N GLY A 451 1.855 16.392 53.038 1.00 70.80 N ATOM 951 CA GLY A 451 2.108 17.222 54.176 1.00 71.26 C ATOM 952 C GLY A 451 2.428 18.662 53.851 1.00 74.97 C ATOM 953 O GLY A 451 2.161 19.162 52.754 1.00 78.03 O ATOM 954 H GLY A 451 2.611 16.243 52.340 1.00 0.00 H ATOM 955 N ARG A 452 2.919 19.372 54.860 1.00 69.92 N ATOM 956 CA ARG A 452 3.255 20.776 54.675 1.00 81.44 C ATOM 957 C ARG A 452 4.313 20.925 53.610 1.00 92.40 C ATOM 958 O ARG A 452 4.280 21.854 52.801 1.00 98.54 O ATOM 959 CB ARG A 452 3.781 21.384 55.975 1.00 91.01 C ATOM 960 CG ARG A 452 2.766 22.073 56.864 1.00100.41 C ATOM 961 CD ARG A 452 2.598 23.569 56.622 1.00101.51 C ATOM 962 NE ARG A 452 1.546 24.086 57.487 1.00 99.68 N ATOM 963 CZ ARG A 452 0.256 24.037 57.190 1.00 94.44 C ATOM 964 NH1 ARG A 452 -0.131 23.513 56.031 1.00 82.76 N ATOM 965 NH2 ARG A 452 -0.636 24.513 58.048 1.00 95.70 N ATOM 966 HE ARG A 452 1.824 24.519 58.391 1.00 0.00 H ATOM 967 HH12 ARG A 452 -1.142 23.471 55.791 1.00 0.00 H ATOM 968 HH11 ARG A 452 0.577 23.145 55.364 1.00 0.00 H ATOM 969 HH22 ARG A 452 -1.650 24.476 57.818 1.00 0.00 H ATOM 970 HH21 ARG A 452 -0.322 24.923 58.951 1.00 0.00 H ATOM 971 H ARG A 452 3.064 18.923 55.787 1.00 0.00 H ATOM 972 N GLY A 453 5.307 20.057 53.652 1.00 83.07 N ATOM 973 CA GLY A 453 6.389 20.070 52.700 1.00 86.07 C ATOM 974 C GLY A 453 7.542 20.857 53.262 1.00 90.72 C ATOM 975 O GLY A 453 7.341 21.914 53.863 1.00 95.53 O ATOM 976 H GLY A 453 5.309 19.336 54.401 1.00 0.00 H ATOM 977 N ILE A 454 8.757 20.398 52.999 1.00 90.49 N ATOM 978 CA ILE A 454 9.921 21.090 53.510 1.00 74.98 C ATOM 979 C ILE A 454 10.110 22.339 52.672 1.00 74.04 C ATOM 980 O ILE A 454 10.049 22.275 51.445 1.00 73.08 O ATOM 981 CB ILE A 454 11.149 20.176 53.431 1.00 73.78 C ATOM 982 CG1 ILE A 454 11.005 18.974 54.347 1.00 74.54 C ATOM 983 CG2 ILE A 454 12.346 20.896 53.935 1.00 75.83 C ATOM 984 CD1 ILE A 454 12.070 17.924 54.112 1.00 74.84 C ATOM 985 H ILE A 454 8.874 19.539 52.424 1.00 0.00 H ATOM 986 N ASP A 455 10.280 23.491 53.321 1.00 72.30 N ATOM 987 CA ASP A 455 10.515 24.739 52.589 1.00 77.07 C ATOM 988 C ASP A 455 11.973 24.772 52.176 1.00 87.30 C ATOM 989 O ASP A 455 12.860 24.910 53.020 1.00 99.91 O ATOM 990 CB ASP A 455 10.164 25.986 53.395 1.00 75.58 C ATOM 991 CG ASP A 455 10.063 27.241 52.521 1.00 73.74 C ATOM 992 OD1 ASP A 455 10.731 27.312 51.473 1.00 71.63 O ATOM 993 OD2 ASP A 455 9.319 28.167 52.887 1.00 74.35 O ATOM 994 H ASP A 455 10.245 23.504 54.360 1.00 0.00 H ATOM 995 N LYS A 456 12.216 24.687 50.876 1.00 75.34 N ATOM 996 CA LYS A 456 13.581 24.542 50.400 1.00 84.26 C ATOM 997 C LYS A 456 14.399 25.788 50.681 1.00 93.27 C ATOM 998 O LYS A 456 15.611 25.698 50.894 1.00 91.92 O ATOM 999 CB LYS A 456 13.581 24.195 48.928 1.00 66.05 C ATOM 1000 CG LYS A 456 13.075 22.822 48.675 1.00 64.07 C ATOM 1001 CD LYS A 456 13.001 22.579 47.231 1.00 65.72 C ATOM 1002 CE LYS A 456 12.365 21.281 46.953 1.00 72.38 C ATOM 1003 NZ LYS A 456 11.040 21.507 46.380 1.00 96.35 N ATOM 1004 HZ1 LYS A 456 10.459 22.043 47.055 1.00 0.00 H ATOM 1005 HZ2 LYS A 456 11.133 22.047 45.496 1.00 0.00 H ATOM 1006 HZ3 LYS A 456 10.588 20.591 46.183 1.00 0.00 H ATOM 1007 H LYS A 456 11.430 24.724 50.197 1.00 0.00 H ATOM 1008 N GLU A 457 13.780 26.963 50.678 1.00 95.50 N ATOM 1009 CA GLU A 457 14.622 28.132 50.869 1.00 97.99 C ATOM 1010 C GLU A 457 15.031 28.273 52.336 1.00 89.50 C ATOM 1011 O GLU A 457 16.056 28.899 52.623 1.00 94.92 O ATOM 1012 CB GLU A 457 13.919 29.391 50.346 1.00109.39 C ATOM 1013 CG GLU A 457 14.735 30.699 50.494 1.00127.46 C ATOM 1014 CD GLU A 457 15.858 30.827 49.446 1.00140.46 C ATOM 1015 OE1 GLU A 457 15.740 30.178 48.383 1.00142.92 O ATOM 1016 OE2 GLU A 457 16.844 31.576 49.672 1.00146.98 O ATOM 1017 H GLU A 457 12.751 27.042 50.546 1.00 0.00 H ATOM 1018 N LYS A 458 14.293 27.654 53.267 1.00 94.77 N ATOM 1019 CA LYS A 458 14.747 27.621 54.655 1.00 84.72 C ATOM 1020 C LYS A 458 16.071 26.876 54.801 1.00 85.84 C ATOM 1021 O LYS A 458 16.967 27.330 55.520 1.00 95.28 O ATOM 1022 CB LYS A 458 13.684 26.960 55.533 1.00 77.07 C ATOM 1023 CG LYS A 458 12.612 27.884 56.052 1.00 79.61 C ATOM 1024 CD LYS A 458 13.175 29.266 56.366 1.00 94.49 C ATOM 1025 CE LYS A 458 12.659 29.809 57.704 1.00102.80 C ATOM 1026 NZ LYS A 458 12.954 31.260 57.920 1.00105.33 N ATOM 1027 HZ1 LYS A 458 13.983 31.410 57.901 1.00 0.00 H ATOM 1028 HZ2 LYS A 458 12.507 31.819 57.166 1.00 0.00 H ATOM 1029 HZ3 LYS A 458 12.576 31.556 58.843 1.00 0.00 H ATOM 1030 H LYS A 458 13.397 27.197 53.002 1.00 0.00 H ATOM 1031 N ILE A 459 16.232 25.757 54.091 1.00 82.22 N ATOM 1032 CA ILE A 459 17.503 25.034 54.090 1.00 82.70 C ATOM 1033 C ILE A 459 18.597 25.866 53.434 1.00 85.19 C ATOM 1034 O ILE A 459 19.758 25.830 53.853 1.00 87.58 O ATOM 1035 CB ILE A 459 17.352 23.661 53.415 1.00 79.84 C ATOM 1036 CG1 ILE A 459 16.782 22.620 54.372 1.00 78.88 C ATOM 1037 CG2 ILE A 459 18.673 23.172 52.978 1.00 80.86 C ATOM 1038 CD1 ILE A 459 15.431 22.932 54.936 1.00 78.23 C ATOM 1039 H ILE A 459 15.438 25.392 53.527 1.00 0.00 H ATOM 1040 N ILE A 460 18.250 26.608 52.381 1.00 90.62 N ATOM 1041 CA ILE A 460 19.237 27.451 51.730 1.00 87.76 C ATOM 1042 C ILE A 460 19.668 28.566 52.668 1.00 92.17 C ATOM 1043 O ILE A 460 20.851 28.895 52.736 1.00 98.75 O ATOM 1044 CB ILE A 460 18.680 28.016 50.398 1.00 86.14 C ATOM 1045 CG1 ILE A 460 18.740 27.001 49.257 1.00 81.11 C ATOM 1046 CG2 ILE A 460 19.389 29.272 49.967 1.00 92.05 C ATOM 1047 CD1 ILE A 460 18.449 27.637 47.899 1.00 81.70 C ATOM 1048 H ILE A 460 17.273 26.583 52.026 1.00 0.00 H ATOM 1049 N ARG A 461 18.750 29.118 53.458 1.00 81.87 N ATOM 1050 CA ARG A 461 19.126 30.167 54.398 1.00 96.79 C ATOM 1051 C ARG A 461 19.900 29.646 55.586 1.00109.16 C ATOM 1052 O ARG A 461 20.522 30.437 56.302 1.00114.74 O ATOM 1053 CB ARG A 461 17.906 30.902 54.906 1.00 98.11 C ATOM 1054 CG ARG A 461 17.237 31.717 53.840 1.00103.08 C ATOM 1055 CD ARG A 461 17.086 33.151 54.255 1.00114.20 C ATOM 1056 NE ARG A 461 16.061 33.302 55.280 1.00123.78 N ATOM 1057 CZ ARG A 461 16.279 33.849 56.471 1.00137.59 C ATOM 1058 NH1 ARG A 461 17.487 34.294 56.770 1.00143.85 N ATOM 1059 NH2 ARG A 461 15.297 33.959 57.359 1.00141.05 N ATOM 1060 HE ARG A 461 15.102 32.961 55.066 1.00 0.00 H ATOM 1061 HH12 ARG A 461 17.667 34.724 57.700 1.00 0.00 H ATOM 1062 HH11 ARG A 461 18.257 34.214 56.076 1.00 0.00 H ATOM 1063 HH22 ARG A 461 15.481 34.389 58.288 1.00 0.00 H ATOM 1064 HH21 ARG A 461 14.344 33.615 57.125 1.00 0.00 H ATOM 1065 H ARG A 461 17.761 28.800 53.405 1.00 0.00 H ATOM 1066 N LYS A 462 19.889 28.340 55.804 1.00102.63 N ATOM 1067 CA LYS A 462 20.661 27.786 56.901 1.00104.56 C ATOM 1068 C LYS A 462 22.064 27.467 56.434 1.00102.65 C ATOM 1069 O LYS A 462 23.021 27.655 57.179 1.00108.28 O ATOM 1070 CB LYS A 462 19.976 26.537 57.463 1.00105.78 C ATOM 1071 CG LYS A 462 18.993 26.780 58.637 1.00111.11 C ATOM 1072 CD LYS A 462 18.010 25.597 58.815 1.00105.07 C ATOM 1073 CE LYS A 462 17.021 25.753 59.971 1.00102.00 C ATOM 1074 NZ LYS A 462 15.873 24.795 59.877 1.00 96.64 N ATOM 1075 HZ1 LYS A 462 15.357 24.960 58.989 1.00 0.00 H ATOM 1076 HZ2 LYS A 462 16.234 23.820 59.893 1.00 0.00 H ATOM 1077 HZ3 LYS A 462 15.233 24.942 60.683 1.00 0.00 H ATOM 1078 H LYS A 462 19.329 27.713 55.191 1.00 0.00 H ATOM 1079 N ALA A 463 22.212 27.002 55.202 1.00103.09 N ATOM 1080 CA ALA A 463 23.547 26.731 54.696 1.00101.61 C ATOM 1081 C ALA A 463 24.387 27.995 54.589 1.00101.72 C ATOM 1082 O ALA A 463 25.607 27.949 54.766 1.00109.17 O ATOM 1083 CB ALA A 463 23.447 26.047 53.345 1.00102.34 C ATOM 1084 H ALA A 463 21.380 26.832 54.602 1.00 0.00 H ATOM 1085 N ILE A 464 23.773 29.124 54.241 1.00110.98 N ATOM 1086 CA ILE A 464 24.536 30.370 54.147 1.00109.37 C ATOM 1087 C ILE A 464 24.991 30.839 55.519 1.00102.57 C ATOM 1088 O ILE A 464 26.167 31.160 55.718 1.00107.35 O ATOM 1089 CB ILE A 464 23.734 31.464 53.421 1.00111.66 C ATOM 1090 CG1 ILE A 464 22.512 31.904 54.228 1.00115.23 C ATOM 1091 CG2 ILE A 464 23.373 31.006 52.032 1.00102.79 C ATOM 1092 CD1 ILE A 464 22.816 32.957 55.281 1.00122.67 C ATOM 1093 H ILE A 464 22.753 29.121 54.036 1.00 0.00 H ATOM 1094 N GLU A 465 24.062 30.891 56.479 1.00103.97 N ATOM 1095 CA GLU A 465 24.388 31.338 57.830 1.00108.43 C ATOM 1096 C GLU A 465 25.507 30.517 58.448 1.00111.39 C ATOM 1097 O GLU A 465 26.470 31.072 58.989 1.00120.09 O ATOM 1098 CB GLU A 465 23.138 31.252 58.716 1.00106.37 C ATOM 1099 CG GLU A 465 23.444 31.266 60.221 1.00129.43 C ATOM 1100 CD GLU A 465 22.290 31.730 61.117 1.00131.22 C ATOM 1101 OE1 GLU A 465 22.444 31.670 62.358 1.00133.70 O ATOM 1102 OE2 GLU A 465 21.198 32.032 60.595 1.00127.76 O ATOM 1103 H GLU A 465 23.086 30.607 56.259 1.00 0.00 H ATOM 1104 N LYS A 466 25.424 29.195 58.345 1.00113.60 N ATOM 1105 CA LYS A 466 26.415 28.341 58.992 1.00119.37 C ATOM 1106 C LYS A 466 27.675 28.147 58.140 1.00121.22 C ATOM 1107 O LYS A 466 28.642 27.537 58.611 1.00120.57 O ATOM 1108 CB LYS A 466 25.758 27.000 59.411 1.00118.92 C ATOM 1109 CG LYS A 466 24.908 27.122 60.740 1.00123.28 C ATOM 1110 CD LYS A 466 24.849 25.856 61.632 1.00122.44 C ATOM 1111 CE LYS A 466 23.569 25.042 61.456 1.00113.09 C ATOM 1112 NZ LYS A 466 23.826 23.602 61.719 1.00108.03 N ATOM 1113 HZ1 LYS A 466 24.544 23.252 61.053 1.00 0.00 H ATOM 1114 HZ2 LYS A 466 24.170 23.485 62.694 1.00 0.00 H ATOM 1115 HZ3 LYS A 466 22.944 23.065 61.594 1.00 0.00 H ATOM 1116 H LYS A 466 24.649 28.766 57.800 1.00 0.00 H ATOM 1117 N GLY A 467 27.701 28.656 56.908 1.00109.80 N ATOM 1118 CA GLY A 467 28.904 28.583 56.105 1.00112.52 C ATOM 1119 C GLY A 467 29.122 27.274 55.395 1.00109.01 C ATOM 1120 O GLY A 467 30.253 26.972 55.010 1.00111.90 O ATOM 1121 H GLY A 467 26.849 29.110 56.520 1.00 0.00 H ATOM 1122 N LEU A 468 28.081 26.464 55.236 1.00108.33 N ATOM 1123 CA LEU A 468 28.248 25.251 54.457 1.00105.55 C ATOM 1124 C LEU A 468 28.521 25.607 53.019 1.00113.52 C ATOM 1125 O LEU A 468 29.277 24.917 52.329 1.00116.61 O ATOM 1126 CB LEU A 468 26.988 24.421 54.505 1.00100.13 C ATOM 1127 CG LEU A 468 26.830 23.649 55.778 1.00100.03 C ATOM 1128 CD1 LEU A 468 25.390 23.821 56.187 1.00 96.59 C ATOM 1129 CD2 LEU A 468 27.218 22.212 55.524 1.00 99.16 C ATOM 1130 H LEU A 468 27.161 26.695 55.663 1.00 0.00 H ATOM 1131 N ILE A 469 27.852 26.654 52.542 1.00114.75 N ATOM 1132 CA ILE A 469 28.055 27.194 51.210 1.00114.63 C ATOM 1133 C ILE A 469 27.761 28.686 51.258 1.00117.45 C ATOM 1134 O ILE A 469 26.946 29.145 52.063 1.00116.66 O ATOM 1135 CB ILE A 469 27.150 26.459 50.201 1.00109.51 C ATOM 1136 CG1 ILE A 469 27.755 26.478 48.798 1.00116.76 C ATOM 1137 CG2 ILE A 469 25.759 27.047 50.220 1.00106.57 C ATOM 1138 CD1 ILE A 469 29.119 25.823 48.711 1.00121.35 C ATOM 1139 H ILE A 469 27.147 27.109 53.156 1.00 0.00 H ATOM 1140 N ASP A 470 28.452 29.453 50.416 1.00128.37 N ATOM 1141 CA ASP A 470 28.195 30.885 50.320 1.00128.53 C ATOM 1142 C ASP A 470 27.085 31.153 49.320 1.00139.93 C ATOM 1143 O ASP A 470 26.878 30.403 48.363 1.00137.17 O ATOM 1144 CB ASP A 470 29.419 31.717 49.942 1.00120.74 C ATOM 1145 CG ASP A 470 29.191 33.224 50.167 1.00120.01 C ATOM 1146 OD1 ASP A 470 28.219 33.594 50.864 1.00118.26 O ATOM 1147 OD2 ASP A 470 29.984 34.040 49.652 1.00125.79 O ATOM 1148 H ASP A 470 29.186 29.024 49.818 1.00 0.00 H ATOM 1149 N GLU A 471 26.451 32.304 49.508 1.00144.16 N ATOM 1150 CA GLU A 471 25.203 32.635 48.837 1.00141.26 C ATOM 1151 C GLU A 471 25.289 32.740 47.321 1.00134.97 C ATOM 1152 O GLU A 471 24.330 32.369 46.636 1.00127.25 O ATOM 1153 CB GLU A 471 24.681 33.943 49.392 1.00149.25 C ATOM 1154 CG GLU A 471 23.407 34.369 48.762 1.00154.92 C ATOM 1155 CD GLU A 471 22.669 35.325 49.635 1.00163.54 C ATOM 1156 OE1 GLU A 471 22.172 36.330 49.093 1.00169.04 O ATOM 1157 OE2 GLU A 471 22.597 35.081 50.862 1.00163.53 O ATOM 1158 H GLU A 471 26.864 32.999 50.163 1.00 0.00 H ATOM 1159 N SER A 472 26.388 33.235 46.762 1.00146.33 N ATOM 1160 CA SER A 472 26.347 33.479 45.323 1.00146.55 C ATOM 1161 C SER A 472 26.288 32.185 44.521 1.00142.06 C ATOM 1162 O SER A 472 25.777 32.186 43.395 1.00150.20 O ATOM 1163 CB SER A 472 27.554 34.318 44.895 1.00150.03 C ATOM 1164 OG SER A 472 27.703 34.328 43.481 1.00148.49 O ATOM 1165 HG SER A 472 27.833 33.401 43.157 1.00 0.00 H ATOM 1166 H SER A 472 27.239 33.439 47.324 1.00 0.00 H ATOM 1167 N LYS A 473 26.800 31.083 45.064 1.00141.70 N ATOM 1168 CA LYS A 473 26.702 29.792 44.401 1.00126.03 C ATOM 1169 C LYS A 473 25.463 29.025 44.828 1.00111.16 C ATOM 1170 O LYS A 473 25.344 27.839 44.513 1.00105.84 O ATOM 1171 CB LYS A 473 27.987 28.985 44.577 1.00124.81 C ATOM 1172 CG LYS A 473 29.077 29.536 43.631 1.00131.61 C ATOM 1173 CD LYS A 473 29.922 28.475 42.927 1.00131.40 C ATOM 1174 CE LYS A 473 30.026 28.742 41.426 1.00132.35 C ATOM 1175 NZ LYS A 473 30.208 27.488 40.644 1.00130.30 N ATOM 1176 HZ1 LYS A 473 31.082 27.014 40.950 1.00 0.00 H ATOM 1177 HZ2 LYS A 473 29.396 26.859 40.806 1.00 0.00 H ATOM 1178 HZ3 LYS A 473 30.273 27.718 39.632 1.00 0.00 H ATOM 1179 H LYS A 473 27.281 31.146 45.984 1.00 0.00 H ATOM 1180 N ALA A 474 24.569 29.662 45.589 1.00108.79 N ATOM 1181 CA ALA A 474 23.318 29.003 45.912 1.00101.09 C ATOM 1182 C ALA A 474 22.633 28.559 44.642 1.00 97.90 C ATOM 1183 O ALA A 474 22.019 27.501 44.611 1.00 93.91 O ATOM 1184 CB ALA A 474 22.400 29.938 46.693 1.00104.34 C ATOM 1185 H ALA A 474 24.767 30.619 45.945 1.00 0.00 H ATOM 1186 N ALA A 475 22.772 29.326 43.570 1.00 96.70 N ATOM 1187 CA ALA A 475 22.180 28.934 42.302 1.00 94.99 C ATOM 1188 C ALA A 475 22.775 27.644 41.759 1.00 93.59 C ATOM 1189 O ALA A 475 22.192 27.039 40.859 1.00 91.64 O ATOM 1190 CB ALA A 475 22.320 30.053 41.283 1.00 99.24 C ATOM 1191 H ALA A 475 23.308 30.214 43.637 1.00 0.00 H ATOM 1192 N THR A 476 23.968 27.261 42.201 1.00 98.80 N ATOM 1193 CA THR A 476 24.570 26.029 41.703 1.00 98.21 C ATOM 1194 C THR A 476 23.832 24.781 42.162 1.00101.83 C ATOM 1195 O THR A 476 23.591 23.864 41.364 1.00 92.41 O ATOM 1196 CB THR A 476 26.014 25.954 42.168 1.00101.79 C ATOM 1197 OG1 THR A 476 26.039 25.777 43.589 1.00100.63 O ATOM 1198 CG2 THR A 476 26.732 27.207 41.821 1.00106.84 C ATOM 1199 HG1 THR A 476 25.587 26.543 44.024 1.00 0.00 H ATOM 1200 H THR A 476 24.473 27.840 42.902 1.00 0.00 H ATOM 1201 N LEU A 477 23.449 24.734 43.432 1.00 92.36 N ATOM 1202 CA LEU A 477 22.875 23.516 43.977 1.00 95.37 C ATOM 1203 C LEU A 477 21.516 23.240 43.337 1.00100.03 C ATOM 1204 O LEU A 477 20.770 24.156 42.997 1.00104.49 O ATOM 1205 CB LEU A 477 22.793 23.590 45.508 1.00 91.12 C ATOM 1206 CG LEU A 477 22.395 24.823 46.311 1.00 93.07 C ATOM 1207 CD1 LEU A 477 20.976 25.155 46.035 1.00 97.93 C ATOM 1208 CD2 LEU A 477 22.546 24.537 47.774 1.00 89.40 C ATOM 1209 H LEU A 477 23.560 25.571 44.039 1.00 0.00 H ATOM 1210 N SER A 478 21.207 21.966 43.159 1.00107.98 N ATOM 1211 CA SER A 478 19.938 21.550 42.593 1.00 86.76 C ATOM 1212 C SER A 478 18.965 21.242 43.722 1.00 77.04 C ATOM 1213 O SER A 478 19.364 21.089 44.868 1.00 77.13 O ATOM 1214 CB SER A 478 20.163 20.345 41.688 1.00 85.19 C ATOM 1215 OG SER A 478 21.014 19.398 42.306 1.00 80.98 O ATOM 1216 HG SER A 478 21.144 18.627 41.699 1.00 0.00 H ATOM 1217 H SER A 478 21.897 21.238 43.434 1.00 0.00 H ATOM 1218 N ASP A 479 17.669 21.265 43.419 1.00 72.97 N ATOM 1219 CA ASP A 479 16.704 20.977 44.470 1.00 71.01 C ATOM 1220 C ASP A 479 17.067 19.700 45.178 1.00 70.78 C ATOM 1221 O ASP A 479 17.080 19.640 46.407 1.00 70.52 O ATOM 1222 CB ASP A 479 15.307 20.887 43.892 1.00 76.48 C ATOM 1223 CG ASP A 479 14.659 22.207 43.860 1.00 86.17 C ATOM 1224 OD1 ASP A 479 15.400 23.178 44.029 1.00 84.50 O ATOM 1225 OD2 ASP A 479 13.435 22.288 43.690 1.00 90.41 O ATOM 1226 H ASP A 479 17.353 21.484 42.453 1.00 0.00 H ATOM 1227 N GLN A 480 17.446 18.694 44.409 1.00 77.03 N ATOM 1228 CA GLN A 480 17.895 17.439 44.979 1.00 79.64 C ATOM 1229 C GLN A 480 19.023 17.666 45.977 1.00 83.36 C ATOM 1230 O GLN A 480 19.072 17.013 47.023 1.00 82.52 O ATOM 1231 CB GLN A 480 18.345 16.520 43.848 1.00 85.12 C ATOM 1232 CG GLN A 480 17.478 16.592 42.595 1.00 82.97 C ATOM 1233 CD GLN A 480 18.290 16.537 41.310 1.00 78.28 C ATOM 1234 OE1 GLN A 480 18.613 15.474 40.801 1.00 79.59 O ATOM 1235 NE2 GLN A 480 18.623 17.696 40.785 1.00 87.33 N ATOM 1236 HE22 GLN A 480 18.329 18.580 41.248 1.00 0.00 H ATOM 1237 HE21 GLN A 480 19.180 17.728 39.907 1.00 0.00 H ATOM 1238 H GLN A 480 17.422 18.805 43.375 1.00 0.00 H ATOM 1239 N GLU A 481 19.936 18.599 45.670 1.00 89.98 N ATOM 1240 CA GLU A 481 21.062 18.908 46.556 1.00 91.14 C ATOM 1241 C GLU A 481 20.620 19.680 47.798 1.00 91.57 C ATOM 1242 O GLU A 481 21.209 19.509 48.867 1.00 92.96 O ATOM 1243 CB GLU A 481 22.149 19.701 45.793 1.00 89.52 C ATOM 1244 CG GLU A 481 22.984 18.893 44.767 1.00 95.26 C ATOM 1245 CD GLU A 481 24.318 19.549 44.378 1.00103.09 C ATOM 1246 OE1 GLU A 481 25.353 19.236 45.012 1.00105.74 O ATOM 1247 OE2 GLU A 481 24.334 20.353 43.420 1.00104.44 O ATOM 1248 H GLU A 481 19.842 19.120 44.775 1.00 0.00 H ATOM 1249 N ILE A 482 19.619 20.550 47.680 1.00 86.89 N ATOM 1250 CA ILE A 482 19.210 21.370 48.815 1.00 76.13 C ATOM 1251 C ILE A 482 18.825 20.503 50.002 1.00 85.24 C ATOM 1252 O ILE A 482 19.232 20.764 51.138 1.00 90.17 O ATOM 1253 CB ILE A 482 18.063 22.287 48.398 1.00 71.65 C ATOM 1254 CG1 ILE A 482 18.505 23.109 47.221 1.00 73.03 C ATOM 1255 CG2 ILE A 482 17.815 23.268 49.469 1.00 72.56 C ATOM 1256 CD1 ILE A 482 17.633 24.226 46.969 1.00 73.08 C ATOM 1257 H ILE A 482 19.124 20.646 46.770 1.00 0.00 H ATOM 1258 N LEU A 483 18.057 19.439 49.754 1.00 82.60 N ATOM 1259 CA LEU A 483 17.552 18.598 50.835 1.00 82.74 C ATOM 1260 C LEU A 483 18.654 17.729 51.399 1.00 81.28 C ATOM 1261 O LEU A 483 18.615 17.359 52.574 1.00 79.80 O ATOM 1262 CB LEU A 483 16.376 17.741 50.343 1.00 83.08 C ATOM 1263 CG LEU A 483 15.026 18.452 50.115 1.00 77.92 C ATOM 1264 CD1 LEU A 483 14.045 17.605 49.360 1.00 69.29 C ATOM 1265 CD2 LEU A 483 14.389 18.870 51.413 1.00 83.66 C ATOM 1266 H LEU A 483 17.814 19.205 48.770 1.00 0.00 H ATOM 1267 N ASN A 484 19.666 17.446 50.597 1.00 85.98 N ATOM 1268 CA ASN A 484 20.822 16.757 51.120 1.00 88.00 C ATOM 1269 C ASN A 484 21.396 17.528 52.298 1.00 86.66 C ATOM 1270 O ASN A 484 22.109 16.952 53.115 1.00 86.58 O ATOM 1271 CB ASN A 484 21.850 16.613 49.998 1.00101.58 C ATOM 1272 CG ASN A 484 21.834 15.235 49.376 1.00113.63 C ATOM 1273 OD1 ASN A 484 21.169 14.332 49.878 1.00121.87 O ATOM 1274 ND2 ASN A 484 22.538 15.076 48.253 1.00115.38 N ATOM 1275 HD22 ASN A 484 23.086 15.871 47.866 1.00 0.00 H ATOM 1276 HD21 ASN A 484 22.538 14.158 47.765 1.00 0.00 H ATOM 1277 H ASN A 484 19.630 17.718 49.594 1.00 0.00 H ATOM 1278 N PHE A 485 21.058 18.817 52.430 1.00 93.10 N ATOM 1279 CA PHE A 485 21.489 19.582 53.588 1.00 88.97 C ATOM 1280 C PHE A 485 20.784 19.126 54.814 1.00 78.36 C ATOM 1281 O PHE A 485 21.229 19.414 55.914 1.00 79.99 O ATOM 1282 CB PHE A 485 21.158 21.039 53.444 1.00 88.08 C ATOM 1283 CG PHE A 485 22.253 21.833 52.897 1.00 84.38 C ATOM 1284 CD1 PHE A 485 23.402 22.049 53.603 1.00 90.94 C ATOM 1285 CD2 PHE A 485 22.129 22.364 51.641 1.00 79.41 C ATOM 1286 CE1 PHE A 485 24.398 22.786 53.065 1.00 95.66 C ATOM 1287 CE2 PHE A 485 23.120 23.098 51.099 1.00 82.15 C ATOM 1288 CZ PHE A 485 24.262 23.306 51.802 1.00 88.54 C ATOM 1289 H PHE A 485 20.481 19.275 51.696 1.00 0.00 H ATOM 1290 N LEU A 486 19.761 18.340 54.640 1.00 82.01 N ATOM 1291 CA LEU A 486 19.213 17.714 55.813 1.00 91.96 C ATOM 1292 C LEU A 486 20.153 16.670 56.350 1.00114.51 C ATOM 1293 O LEU A 486 19.921 16.144 57.440 1.00115.68 O ATOM 1294 CB LEU A 486 17.818 17.149 55.526 1.00 77.57 C ATOM 1295 CG LEU A 486 16.780 18.260 55.370 1.00 68.04 C ATOM 1296 CD1 LEU A 486 17.085 19.231 54.244 1.00 68.86 C ATOM 1297 CD2 LEU A 486 15.466 17.597 55.160 1.00 69.44 C ATOM 1298 H LEU A 486 19.358 18.172 53.696 1.00 0.00 H ATOM 1299 N PHE A 487 21.163 16.312 55.600 1.00 88.13 N ATOM 1300 CA PHE A 487 22.067 15.273 56.075 1.00 98.08 C ATOM 1301 C PHE A 487 23.297 15.782 56.758 1.00102.60 C ATOM 1302 O PHE A 487 24.196 14.987 56.967 1.00104.41 O ATOM 1303 CB PHE A 487 22.413 14.359 54.873 1.00101.57 C ATOM 1304 CG PHE A 487 21.326 13.505 54.448 1.00108.66 C ATOM 1305 CD1 PHE A 487 20.727 12.652 55.340 1.00115.57 C ATOM 1306 CD2 PHE A 487 20.927 13.529 53.127 1.00111.13 C ATOM 1307 CE1 PHE A 487 19.718 11.803 54.931 1.00118.95 C ATOM 1308 CE2 PHE A 487 19.929 12.682 52.699 1.00111.74 C ATOM 1309 CZ PHE A 487 19.311 11.844 53.591 1.00115.77 C ATOM 1310 H PHE A 487 21.319 16.763 54.676 1.00 0.00 H ATOM 1311 N VAL A 488 23.498 17.087 56.835 1.00121.11 N ATOM 1312 CA VAL A 488 24.692 17.397 57.628 1.00122.65 C ATOM 1313 C VAL A 488 24.341 17.224 59.075 1.00117.95 C ATOM 1314 O VAL A 488 23.179 17.344 59.431 1.00111.79 O ATOM 1315 CB VAL A 488 25.281 18.792 57.343 1.00126.21 C ATOM 1316 CG1 VAL A 488 26.189 19.286 58.540 1.00133.36 C ATOM 1317 CG2 VAL A 488 26.236 18.771 56.106 1.00129.44 C ATOM 1318 H VAL A 488 22.887 17.802 56.390 1.00 0.00 H ATOM 1319 N PRO A 489 25.249 16.739 59.880 1.00119.98 N ATOM 1320 CA PRO A 489 25.012 16.682 61.315 1.00105.04 C ATOM 1321 C PRO A 489 24.626 18.044 61.875 1.00 98.12 C ATOM 1322 O PRO A 489 25.174 19.081 61.491 1.00 98.81 O ATOM 1323 CB PRO A 489 26.379 16.235 61.885 1.00109.33 C ATOM 1324 CG PRO A 489 27.325 16.083 60.778 1.00114.51 C ATOM 1325 CD PRO A 489 26.494 16.041 59.518 1.00115.33 C ATOM 1326 N GLY A 490 23.752 18.026 62.867 1.00102.29 N ATOM 1327 CA GLY A 490 23.462 19.238 63.600 1.00103.43 C ATOM 1328 C GLY A 490 22.865 20.370 62.791 1.00100.50 C ATOM 1329 O GLY A 490 22.938 21.541 63.204 1.00102.44 O ATOM 1330 H GLY A 490 23.272 17.139 63.120 1.00 0.00 H ATOM 1331 N PHE A 491 22.287 20.052 61.631 1.00102.12 N ATOM 1332 CA PHE A 491 21.525 21.038 60.872 1.00 99.41 C ATOM 1333 C PHE A 491 20.313 21.493 61.661 1.00104.01 C ATOM 1334 O PHE A 491 19.948 22.674 61.624 1.00115.21 O ATOM 1335 CB PHE A 491 21.107 20.454 59.518 1.00 95.56 C ATOM 1336 CG PHE A 491 20.958 21.474 58.404 1.00 93.92 C ATOM 1337 CD1 PHE A 491 19.874 22.315 58.341 1.00 92.46 C ATOM 1338 CD2 PHE A 491 21.919 21.583 57.421 1.00 94.43 C ATOM 1339 CE1 PHE A 491 19.757 23.218 57.309 1.00 91.56 C ATOM 1340 CE2 PHE A 491 21.799 22.479 56.397 1.00 93.48 C ATOM 1341 CZ PHE A 491 20.728 23.301 56.340 1.00 92.50 C ATOM 1342 H PHE A 491 22.381 19.084 61.262 1.00 0.00 H ATOM 1343 N SER A 492 19.696 20.577 62.391 1.00119.28 N ATOM 1344 CA SER A 492 18.600 20.897 63.304 1.00119.59 C ATOM 1345 C SER A 492 18.950 22.054 64.261 1.00125.94 C ATOM 1346 O SER A 492 20.116 22.296 64.586 1.00128.58 O ATOM 1347 CB SER A 492 18.228 19.632 64.097 1.00119.82 C ATOM 1348 OG SER A 492 18.876 19.612 65.352 1.00125.72 O ATOM 1349 HG SER A 492 18.620 18.790 65.841 1.00 0.00 H ATOM 1350 H SER A 492 20.004 19.587 62.312 1.00 0.00 H TER 1351 SER A 492 ATOM 1352 N VAL A 497 21.624 24.448 73.580 1.00126.33 N ATOM 1353 CA VAL A 497 22.788 24.426 74.435 1.00132.40 C ATOM 1354 C VAL A 497 22.322 24.306 75.873 1.00137.20 C ATOM 1355 O VAL A 497 22.592 23.292 76.504 1.00139.09 O ATOM 1356 CB VAL A 497 23.688 25.652 74.188 1.00135.80 C ATOM 1357 CG1 VAL A 497 24.417 25.504 72.859 1.00132.12 C ATOM 1358 CG2 VAL A 497 22.862 26.911 74.135 1.00136.21 C ATOM 1359 HN3 VAL A 497 21.027 25.262 73.831 1.00 0.00 H ATOM 1360 HN2 VAL A 497 21.085 23.568 73.708 1.00 0.00 H ATOM 1361 HN1 VAL A 497 21.925 24.530 72.588 1.00 0.00 H ATOM 1362 N SER A 498 21.601 25.315 76.377 1.00145.92 N ATOM 1363 CA SER A 498 21.081 25.266 77.744 1.00154.49 C ATOM 1364 C SER A 498 20.424 23.930 78.023 1.00156.59 C ATOM 1365 O SER A 498 20.632 23.320 79.078 1.00159.71 O ATOM 1366 CB SER A 498 20.069 26.390 77.982 1.00153.81 C ATOM 1367 OG SER A 498 19.048 25.997 78.900 1.00152.35 O ATOM 1368 HG SER A 498 18.415 26.747 79.028 1.00 0.00 H ATOM 1369 H SER A 498 21.407 26.149 75.786 1.00 0.00 H ATOM 1370 N GLU A 499 19.630 23.466 77.075 1.00154.55 N ATOM 1371 CA GLU A 499 18.928 22.212 77.183 1.00156.64 C ATOM 1372 C GLU A 499 19.379 21.345 76.025 1.00151.26 C ATOM 1373 O GLU A 499 19.582 21.829 74.907 1.00146.42 O ATOM 1374 CB GLU A 499 17.409 22.419 77.168 1.00158.25 C ATOM 1375 CG GLU A 499 16.577 21.147 77.282 1.00157.16 C ATOM 1376 CD GLU A 499 15.288 21.214 76.470 1.00149.56 C ATOM 1377 OE1 GLU A 499 15.076 20.295 75.655 1.00143.77 O ATOM 1378 OE2 GLU A 499 14.505 22.178 76.619 1.00147.69 O ATOM 1379 H GLU A 499 19.506 24.031 76.211 1.00 0.00 H ATOM 1380 N VAL A 500 19.596 20.074 76.328 1.00135.47 N ATOM 1381 CA VAL A 500 19.905 19.067 75.335 1.00126.68 C ATOM 1382 C VAL A 500 19.194 17.789 75.714 1.00131.03 C ATOM 1383 O VAL A 500 19.378 17.283 76.826 1.00142.40 O ATOM 1384 CB VAL A 500 21.397 18.788 75.247 1.00128.23 C ATOM 1385 CG1 VAL A 500 21.584 17.596 74.372 1.00125.01 C ATOM 1386 CG2 VAL A 500 22.085 20.007 74.742 1.00127.94 C ATOM 1387 H VAL A 500 19.542 19.786 77.326 1.00 0.00 H ATOM 1388 N SER A 501 18.386 17.264 74.805 1.00140.13 N ATOM 1389 CA SER A 501 17.826 15.940 75.023 1.00133.44 C ATOM 1390 C SER A 501 18.943 14.923 74.848 1.00136.45 C ATOM 1391 O SER A 501 19.489 14.770 73.748 1.00137.89 O ATOM 1392 CB SER A 501 16.656 15.668 74.084 1.00123.49 C ATOM 1393 OG SER A 501 15.711 14.777 74.669 1.00123.33 O ATOM 1394 HG SER A 501 14.967 14.623 74.034 1.00 0.00 H ATOM 1395 H SER A 501 18.154 17.795 73.942 1.00 0.00 H ATOM 1396 N GLY A 502 19.329 14.284 75.952 1.00122.26 N ATOM 1397 CA GLY A 502 20.398 13.314 75.894 1.00123.08 C ATOM 1398 C GLY A 502 20.126 12.288 74.827 1.00119.08 C ATOM 1399 O GLY A 502 21.049 11.700 74.271 1.00119.06 O ATOM 1400 H GLY A 502 18.859 14.484 76.858 1.00 0.00 H ATOM 1401 N ARG A 503 18.859 12.121 74.482 1.00123.51 N ATOM 1402 CA ARG A 503 18.404 11.203 73.459 1.00125.58 C ATOM 1403 C ARG A 503 18.034 12.011 72.218 1.00134.58 C ATOM 1404 O ARG A 503 17.253 12.962 72.316 1.00139.10 O ATOM 1405 CB ARG A 503 17.197 10.435 74.007 1.00117.53 C ATOM 1406 CG ARG A 503 17.397 9.885 75.438 1.00117.63 C ATOM 1407 CD ARG A 503 16.110 9.654 76.239 1.00119.11 C ATOM 1408 NE ARG A 503 16.132 8.357 76.933 1.00130.96 N ATOM 1409 CZ ARG A 503 15.478 8.093 78.065 1.00139.41 C ATOM 1410 NH1 ARG A 503 14.753 9.043 78.629 1.00140.50 N ATOM 1411 NH2 ARG A 503 15.548 6.891 78.641 1.00140.32 N ATOM 1412 HE ARG A 503 16.697 7.592 76.511 1.00 0.00 H ATOM 1413 HH12 ARG A 503 14.238 8.849 79.512 1.00 0.00 H ATOM 1414 HH11 ARG A 503 14.697 9.984 78.190 1.00 0.00 H ATOM 1415 HH22 ARG A 503 15.030 6.706 79.524 1.00 0.00 H ATOM 1416 HH21 ARG A 503 16.121 6.139 78.207 1.00 0.00 H ATOM 1417 H ARG A 503 18.142 12.687 74.979 1.00 0.00 H ATOM 1418 N GLY A 504 18.651 11.676 71.068 1.00136.02 N ATOM 1419 CA GLY A 504 18.402 12.329 69.780 1.00134.38 C ATOM 1420 C GLY A 504 18.373 11.514 68.487 1.00129.49 C ATOM 1421 O GLY A 504 19.378 10.887 68.123 1.00125.00 O ATOM 1422 H GLY A 504 19.348 10.905 71.096 1.00 0.00 H ATOM 1423 N VAL A 505 17.229 11.466 67.807 1.00127.36 N ATOM 1424 CA VAL A 505 17.115 10.804 66.509 1.00123.44 C ATOM 1425 C VAL A 505 17.498 11.790 65.397 1.00126.97 C ATOM 1426 O VAL A 505 16.786 12.765 65.136 1.00133.32 O ATOM 1427 CB VAL A 505 15.703 10.241 66.309 1.00120.00 C ATOM 1428 CG1 VAL A 505 15.486 9.056 67.248 1.00120.01 C ATOM 1429 CG2 VAL A 505 14.648 11.306 66.573 1.00117.43 C ATOM 1430 H VAL A 505 16.385 11.916 68.215 1.00 0.00 H ATOM 1431 N GLY A 506 18.637 11.560 64.749 1.00124.44 N ATOM 1432 CA GLY A 506 19.135 12.450 63.708 1.00119.48 C ATOM 1433 C GLY A 506 18.761 11.907 62.342 1.00107.90 C ATOM 1434 O GLY A 506 18.644 10.699 62.167 1.00106.68 O ATOM 1435 H GLY A 506 19.192 10.715 64.994 1.00 0.00 H ATOM 1436 N MET A 507 18.658 12.787 61.351 1.00111.21 N ATOM 1437 CA MET A 507 18.456 12.318 59.985 1.00105.72 C ATOM 1438 C MET A 507 19.642 11.553 59.454 1.00115.30 C ATOM 1439 O MET A 507 19.533 10.824 58.455 1.00119.29 O ATOM 1440 CB MET A 507 18.127 13.464 59.038 1.00 98.79 C ATOM 1441 CG MET A 507 16.635 13.794 58.979 1.00 96.69 C ATOM 1442 SD MET A 507 15.630 12.696 57.940 1.00 94.72 S ATOM 1443 CE MET A 507 16.835 12.189 56.720 1.00 92.91 C ATOM 1444 H MET A 507 18.721 13.806 61.549 1.00 0.00 H ATOM 1445 N ASP A 508 20.815 11.755 60.014 1.00100.42 N ATOM 1446 CA ASP A 508 21.856 11.097 59.236 1.00112.62 C ATOM 1447 C ASP A 508 21.955 9.664 59.514 1.00111.08 C ATOM 1448 O ASP A 508 22.513 8.907 58.707 1.00119.11 O ATOM 1449 CB ASP A 508 23.267 11.448 59.488 1.00120.88 C ATOM 1450 CG ASP A 508 23.598 12.727 58.805 1.00130.13 C ATOM 1451 OD1 ASP A 508 24.125 12.678 57.666 1.00133.21 O ATOM 1452 OD2 ASP A 508 23.641 13.619 59.671 1.00135.19 O ATOM 1453 H ASP A 508 20.975 12.303 60.883 1.00 0.00 H ATOM 1454 N VAL A 509 21.626 9.336 60.740 1.00114.67 N ATOM 1455 CA VAL A 509 21.649 7.965 61.137 1.00103.27 C ATOM 1456 C VAL A 509 21.042 7.144 60.025 1.00100.08 C ATOM 1457 O VAL A 509 21.614 6.143 59.596 1.00 99.69 O ATOM 1458 CB VAL A 509 20.918 7.891 62.475 1.00103.61 C ATOM 1459 CG1 VAL A 509 21.320 6.677 63.191 1.00104.23 C ATOM 1460 CG2 VAL A 509 21.235 9.140 63.331 1.00106.57 C ATOM 1461 H VAL A 509 21.349 10.072 61.421 1.00 0.00 H ATOM 1462 N VAL A 510 19.966 7.665 59.430 1.00101.89 N ATOM 1463 CA VAL A 510 19.346 7.024 58.275 1.00 99.03 C ATOM 1464 C VAL A 510 20.272 7.066 57.081 1.00 99.42 C ATOM 1465 O VAL A 510 20.568 6.034 56.473 1.00101.70 O ATOM 1466 CB VAL A 510 17.993 7.663 57.921 1.00 97.09 C ATOM 1467 CG1 VAL A 510 17.425 6.961 56.717 1.00 94.46 C ATOM 1468 CG2 VAL A 510 17.021 7.543 59.058 1.00 96.65 C ATOM 1469 H VAL A 510 19.560 8.549 59.799 1.00 0.00 H ATOM 1470 N LYS A 511 20.759 8.252 56.738 1.00 98.66 N ATOM 1471 CA LYS A 511 21.667 8.347 55.615 1.00 99.35 C ATOM 1472 C LYS A 511 22.761 7.310 55.743 1.00100.33 C ATOM 1473 O LYS A 511 23.207 6.741 54.748 1.00 99.72 O ATOM 1474 CB LYS A 511 22.244 9.741 55.536 1.00101.91 C ATOM 1475 CG LYS A 511 22.589 10.103 54.136 1.00101.90 C ATOM 1476 CD LYS A 511 24.080 10.210 53.946 1.00104.71 C ATOM 1477 CE LYS A 511 24.428 10.444 52.473 1.00106.96 C ATOM 1478 NZ LYS A 511 25.886 10.678 52.204 1.00110.96 N ATOM 1479 HZ1 LYS A 511 26.203 11.520 52.726 1.00 0.00 H ATOM 1480 HZ2 LYS A 511 26.432 9.849 52.515 1.00 0.00 H ATOM 1481 HZ3 LYS A 511 26.030 10.827 51.185 1.00 0.00 H ATOM 1482 H LYS A 511 20.491 9.104 57.271 1.00 0.00 H ATOM 1483 N ASN A 512 23.125 6.964 56.972 1.00 97.76 N ATOM 1484 CA ASN A 512 24.266 6.084 57.162 1.00 99.22 C ATOM 1485 C ASN A 512 23.895 4.659 56.798 1.00 96.91 C ATOM 1486 O ASN A 512 24.501 4.058 55.907 1.00 96.66 O ATOM 1487 CB ASN A 512 24.757 6.163 58.614 1.00111.22 C ATOM 1488 CG ASN A 512 26.169 5.585 58.801 1.00122.74 C ATOM 1489 OD1 ASN A 512 26.353 4.611 59.539 1.00129.87 O ATOM 1490 ND2 ASN A 512 27.161 6.180 58.140 1.00125.38 N ATOM 1491 HD22 ASN A 512 26.962 6.998 57.529 1.00 0.00 H ATOM 1492 HD21 ASN A 512 28.135 5.827 58.235 1.00 0.00 H ATOM 1493 H ASN A 512 22.597 7.321 57.794 1.00 0.00 H ATOM 1494 N VAL A 513 22.846 4.136 57.427 1.00 99.22 N ATOM 1495 CA VAL A 513 22.357 2.800 57.107 1.00 97.10 C ATOM 1496 C VAL A 513 22.218 2.638 55.625 1.00 95.31 C ATOM 1497 O VAL A 513 22.581 1.607 55.047 1.00 94.74 O ATOM 1498 CB VAL A 513 21.005 2.574 57.788 1.00 95.42 C ATOM 1499 CG1 VAL A 513 20.539 1.160 57.556 1.00 93.66 C ATOM 1500 CG2 VAL A 513 21.130 2.920 59.255 1.00 97.48 C ATOM 1501 H VAL A 513 22.364 4.692 58.162 1.00 0.00 H ATOM 1502 N VAL A 514 21.659 3.644 54.991 1.00102.11 N ATOM 1503 CA VAL A 514 21.512 3.555 53.562 1.00104.04 C ATOM 1504 C VAL A 514 22.906 3.501 52.951 1.00106.12 C ATOM 1505 O VAL A 514 23.245 2.561 52.223 1.00101.61 O ATOM 1506 CB VAL A 514 20.659 4.728 53.054 1.00 97.63 C ATOM 1507 CG1 VAL A 514 20.131 4.455 51.707 1.00 91.93 C ATOM 1508 CG2 VAL A 514 19.492 4.916 53.968 1.00 97.24 C ATOM 1509 H VAL A 514 21.331 4.484 55.509 1.00 0.00 H ATOM 1510 N GLU A 515 23.781 4.432 53.361 1.00111.14 N ATOM 1511 CA GLU A 515 25.158 4.466 52.866 1.00113.24 C ATOM 1512 C GLU A 515 25.955 3.283 53.353 1.00115.81 C ATOM 1513 O GLU A 515 26.953 2.914 52.723 1.00115.60 O ATOM 1514 CB GLU A 515 25.866 5.731 53.331 1.00113.43 C ATOM 1515 CG GLU A 515 25.533 6.951 52.525 1.00120.25 C ATOM 1516 CD GLU A 515 26.772 7.765 52.185 1.00133.02 C ATOM 1517 OE1 GLU A 515 27.658 7.912 53.060 1.00139.22 O ATOM 1518 OE2 GLU A 515 26.859 8.267 51.044 1.00134.35 O ATOM 1519 H GLU A 515 23.473 5.149 54.049 1.00 0.00 H ATOM 1520 N SER A 516 25.548 2.725 54.491 1.00107.97 N ATOM 1521 CA SER A 516 26.187 1.528 55.002 1.00109.86 C ATOM 1522 C SER A 516 26.128 0.391 54.009 1.00111.10 C ATOM 1523 O SER A 516 27.138 -0.266 53.760 1.00112.80 O ATOM 1524 CB SER A 516 25.530 1.104 56.307 1.00107.49 C ATOM 1525 OG SER A 516 24.365 0.365 56.000 1.00101.63 O ATOM 1526 HG SER A 516 23.745 0.932 55.476 1.00 0.00 H ATOM 1527 H SER A 516 24.762 3.153 55.020 1.00 0.00 H ATOM 1528 N LEU A 517 24.965 0.156 53.419 1.00104.13 N ATOM 1529 CA LEU A 517 24.741 -1.010 52.588 1.00101.95 C ATOM 1530 C LEU A 517 24.907 -0.739 51.106 1.00 96.36 C ATOM 1531 O LEU A 517 24.361 -1.497 50.302 1.00 94.85 O ATOM 1532 CB LEU A 517 23.342 -1.561 52.839 1.00102.34 C ATOM 1533 CG LEU A 517 23.010 -1.741 54.317 1.00111.26 C ATOM 1534 CD1 LEU A 517 21.509 -1.892 54.534 1.00117.04 C ATOM 1535 CD2 LEU A 517 23.799 -2.873 54.979 1.00115.85 C ATOM 1536 H LEU A 517 24.186 0.831 53.557 1.00 0.00 H ATOM 1537 N ASN A 518 25.677 0.274 50.723 1.00 96.56 N ATOM 1538 CA ASN A 518 25.784 0.705 49.330 1.00113.15 C ATOM 1539 C ASN A 518 24.452 1.248 48.821 1.00124.06 C ATOM 1540 O ASN A 518 24.102 1.068 47.653 1.00120.25 O ATOM 1541 CB ASN A 518 26.254 -0.423 48.404 1.00115.20 C ATOM 1542 CG ASN A 518 27.281 0.030 47.401 1.00116.01 C ATOM 1543 OD1 ASN A 518 28.204 0.767 47.749 1.00117.21 O ATOM 1544 ND2 ASN A 518 27.111 -0.362 46.145 1.00110.63 N ATOM 1545 HD22 ASN A 518 26.316 -0.985 45.898 1.00 0.00 H ATOM 1546 HD21 ASN A 518 27.773 -0.046 45.408 1.00 0.00 H ATOM 1547 H ASN A 518 26.227 0.782 51.445 1.00 0.00 H ATOM 1548 N GLY A 519 23.721 1.935 49.695 1.00110.20 N ATOM 1549 CA GLY A 519 22.397 2.437 49.375 1.00116.71 C ATOM 1550 C GLY A 519 22.279 3.945 49.510 1.00124.88 C ATOM 1551 O GLY A 519 22.964 4.566 50.324 1.00133.37 O ATOM 1552 H GLY A 519 24.112 2.119 50.641 1.00 0.00 H ATOM 1553 N SER A 520 21.389 4.534 48.704 1.00116.63 N ATOM 1554 CA SER A 520 21.226 5.987 48.607 1.00115.24 C ATOM 1555 C SER A 520 19.833 6.453 49.032 1.00 98.47 C ATOM 1556 O SER A 520 18.845 6.148 48.365 1.00 91.15 O ATOM 1557 CB SER A 520 21.539 6.458 47.190 1.00121.53 C ATOM 1558 OG SER A 520 20.432 6.234 46.342 1.00126.01 O ATOM 1559 HG SER A 520 19.649 6.735 46.684 1.00 0.00 H ATOM 1560 H SER A 520 20.781 3.929 48.115 1.00 0.00 H ATOM 1561 N ILE A 521 19.750 7.184 50.130 1.00116.19 N ATOM 1562 CA ILE A 521 18.519 7.881 50.478 1.00100.26 C ATOM 1563 C ILE A 521 18.371 9.108 49.594 1.00 80.67 C ATOM 1564 O ILE A 521 19.337 9.615 49.030 1.00 82.59 O ATOM 1565 CB ILE A 521 18.514 8.243 51.969 1.00 81.05 C ATOM 1566 CG1 ILE A 521 17.233 8.945 52.374 1.00 80.07 C ATOM 1567 CG2 ILE A 521 19.648 9.060 52.265 1.00 83.92 C ATOM 1568 CD1 ILE A 521 17.250 9.411 53.783 1.00 81.47 C ATOM 1569 H ILE A 521 20.577 7.263 50.756 1.00 0.00 H ATOM 1570 N SER A 522 17.135 9.555 49.422 1.00 83.64 N ATOM 1571 CA SER A 522 16.822 10.749 48.656 1.00 80.00 C ATOM 1572 C SER A 522 15.587 11.400 49.266 1.00 80.94 C ATOM 1573 O SER A 522 14.734 10.724 49.843 1.00 81.59 O ATOM 1574 CB SER A 522 16.566 10.392 47.190 1.00 78.85 C ATOM 1575 OG SER A 522 17.711 9.828 46.600 1.00 87.22 O ATOM 1576 HG SER A 522 17.961 9.004 47.089 1.00 0.00 H ATOM 1577 H SER A 522 16.352 9.026 49.856 1.00 0.00 H ATOM 1578 N ILE A 523 15.464 12.711 49.100 1.00 80.70 N ATOM 1579 CA ILE A 523 14.284 13.435 49.544 1.00 80.14 C ATOM 1580 C ILE A 523 13.795 14.304 48.400 1.00 80.51 C ATOM 1581 O ILE A 523 14.569 15.061 47.811 1.00 84.61 O ATOM 1582 CB ILE A 523 14.559 14.293 50.790 1.00 82.14 C ATOM 1583 CG1 ILE A 523 15.243 13.460 51.853 1.00 82.39 C ATOM 1584 CG2 ILE A 523 13.280 14.811 51.380 1.00 81.30 C ATOM 1585 CD1 ILE A 523 15.215 14.101 53.191 1.00 83.90 C ATOM 1586 H ILE A 523 16.234 13.236 48.639 1.00 0.00 H ATOM 1587 N GLU A 524 12.510 14.206 48.094 1.00 86.08 N ATOM 1588 CA GLU A 524 11.874 15.015 47.071 1.00 87.93 C ATOM 1589 C GLU A 524 10.737 15.723 47.779 1.00 82.41 C ATOM 1590 O GLU A 524 9.959 15.081 48.491 1.00 76.97 O ATOM 1591 CB GLU A 524 11.289 14.156 45.949 1.00 95.86 C ATOM 1592 CG GLU A 524 12.197 13.110 45.330 1.00107.75 C ATOM 1593 CD GLU A 524 11.558 12.456 44.114 1.00113.19 C ATOM 1594 OE1 GLU A 524 10.438 12.873 43.747 1.00112.08 O ATOM 1595 OE2 GLU A 524 12.140 11.490 43.572 1.00115.82 O ATOM 1596 H GLU A 524 11.929 13.516 48.612 1.00 0.00 H ATOM 1597 N SER A 525 10.625 17.027 47.613 1.00 86.70 N ATOM 1598 CA SER A 525 9.489 17.625 48.275 1.00 84.17 C ATOM 1599 C SER A 525 8.998 18.824 47.498 1.00 91.03 C ATOM 1600 O SER A 525 9.744 19.493 46.777 1.00 96.09 O ATOM 1601 CB SER A 525 9.782 18.042 49.704 1.00 85.99 C ATOM 1602 OG SER A 525 8.632 18.697 50.191 1.00 88.81 O ATOM 1603 HG SER A 525 7.862 18.076 50.160 1.00 0.00 H ATOM 1604 H SER A 525 11.301 17.581 47.050 1.00 0.00 H ATOM 1605 N GLU A 526 7.731 19.121 47.740 1.00 87.66 N ATOM 1606 CA GLU A 526 7.002 20.160 47.034 1.00 94.89 C ATOM 1607 C GLU A 526 6.185 20.862 48.110 1.00 89.35 C ATOM 1608 O GLU A 526 5.290 20.246 48.694 1.00 86.02 O ATOM 1609 CB GLU A 526 6.097 19.518 45.955 1.00100.54 C ATOM 1610 CG GLU A 526 6.824 18.746 44.789 1.00102.42 C ATOM 1611 CD GLU A 526 6.624 17.185 44.795 1.00 96.84 C ATOM 1612 OE1 GLU A 526 6.050 16.612 45.751 1.00 90.93 O ATOM 1613 OE2 GLU A 526 7.076 16.517 43.836 1.00 93.56 O ATOM 1614 H GLU A 526 7.231 18.581 48.475 1.00 0.00 H ATOM 1615 N LYS A 527 6.484 22.135 48.381 1.00 91.86 N ATOM 1616 CA LYS A 527 5.857 22.809 49.517 1.00 92.50 C ATOM 1617 C LYS A 527 4.346 22.723 49.444 1.00 90.71 C ATOM 1618 O LYS A 527 3.740 23.092 48.437 1.00 90.79 O ATOM 1619 CB LYS A 527 6.263 24.276 49.615 1.00 95.87 C ATOM 1620 CG LYS A 527 5.940 24.846 50.994 1.00 98.83 C ATOM 1621 CD LYS A 527 6.043 26.363 51.064 1.00106.15 C ATOM 1622 CE LYS A 527 5.383 26.838 52.355 1.00107.84 C ATOM 1623 NZ LYS A 527 4.225 27.761 52.165 1.00105.86 N ATOM 1624 HZ1 LYS A 527 4.542 28.613 51.659 1.00 0.00 H ATOM 1625 HZ2 LYS A 527 3.488 27.281 51.610 1.00 0.00 H ATOM 1626 HZ3 LYS A 527 3.842 28.030 53.094 1.00 0.00 H ATOM 1627 H LYS A 527 7.164 22.648 47.783 1.00 0.00 H ATOM 1628 N ASP A 528 3.739 22.280 50.540 1.00 92.97 N ATOM 1629 CA ASP A 528 2.299 22.229 50.741 1.00 89.67 C ATOM 1630 C ASP A 528 1.658 21.167 49.884 1.00 88.90 C ATOM 1631 O ASP A 528 0.432 21.094 49.827 1.00 90.36 O ATOM 1632 CB ASP A 528 1.624 23.577 50.513 1.00 89.28 C ATOM 1633 CG ASP A 528 1.631 24.399 51.746 1.00 88.04 C ATOM 1634 OD1 ASP A 528 1.937 23.808 52.798 1.00 84.55 O ATOM 1635 OD2 ASP A 528 1.345 25.606 51.677 1.00 90.26 O ATOM 1636 H ASP A 528 4.342 21.942 51.317 1.00 0.00 H ATOM 1637 N LYS A 529 2.448 20.397 49.148 1.00 88.36 N ATOM 1638 CA LYS A 529 1.951 19.271 48.398 1.00 86.09 C ATOM 1639 C LYS A 529 2.462 17.946 48.955 1.00 84.48 C ATOM 1640 O LYS A 529 1.914 16.899 48.609 1.00 87.84 O ATOM 1641 CB LYS A 529 2.346 19.426 46.923 1.00 86.72 C ATOM 1642 CG LYS A 529 1.510 20.470 46.140 1.00 95.58 C ATOM 1643 CD LYS A 529 1.461 20.163 44.632 1.00102.53 C ATOM 1644 CE LYS A 529 0.554 21.112 43.850 1.00106.34 C ATOM 1645 NZ LYS A 529 1.249 21.604 42.617 1.00109.32 N ATOM 1646 HZ1 LYS A 529 2.116 22.111 42.888 1.00 0.00 H ATOM 1647 HZ2 LYS A 529 1.494 20.794 42.012 1.00 0.00 H ATOM 1648 HZ3 LYS A 529 0.618 22.247 42.098 1.00 0.00 H ATOM 1649 H LYS A 529 3.464 20.614 49.111 1.00 0.00 H ATOM 1650 N GLY A 530 3.456 17.962 49.832 1.00 82.49 N ATOM 1651 CA GLY A 530 3.974 16.755 50.445 1.00 81.29 C ATOM 1652 C GLY A 530 5.428 16.493 50.104 1.00 82.20 C ATOM 1653 O GLY A 530 6.026 17.137 49.250 1.00 83.58 O ATOM 1654 H GLY A 530 3.880 18.876 50.090 1.00 0.00 H ATOM 1655 N THR A 531 5.996 15.531 50.833 1.00 89.66 N ATOM 1656 CA THR A 531 7.386 15.116 50.690 1.00 82.88 C ATOM 1657 C THR A 531 7.472 13.595 50.616 1.00 80.70 C ATOM 1658 O THR A 531 6.696 12.888 51.256 1.00 86.85 O ATOM 1659 CB THR A 531 8.235 15.596 51.861 1.00 76.63 C ATOM 1660 OG1 THR A 531 8.166 14.617 52.904 1.00 75.30 O ATOM 1661 CG2 THR A 531 7.732 16.929 52.394 1.00 78.35 C ATOM 1662 HG1 THR A 531 7.225 14.508 53.191 1.00 0.00 H ATOM 1663 H THR A 531 5.412 15.048 51.546 1.00 0.00 H ATOM 1664 N LYS A 532 8.444 13.093 49.862 1.00 76.48 N ATOM 1665 CA LYS A 532 8.661 11.659 49.784 1.00 74.99 C ATOM 1666 C LYS A 532 10.142 11.355 49.875 1.00 76.27 C ATOM 1667 O LYS A 532 10.954 12.023 49.244 1.00 77.82 O ATOM 1668 CB LYS A 532 8.054 11.077 48.510 1.00 73.44 C ATOM 1669 CG LYS A 532 8.803 11.340 47.246 1.00 80.75 C ATOM 1670 CD LYS A 532 8.057 10.771 46.049 1.00 86.31 C ATOM 1671 CE LYS A 532 8.153 9.269 46.037 1.00 86.46 C ATOM 1672 NZ LYS A 532 7.846 8.665 44.715 1.00 86.09 N ATOM 1673 HZ1 LYS A 532 6.876 8.917 44.437 1.00 0.00 H ATOM 1674 HZ2 LYS A 532 8.516 9.026 44.006 1.00 0.00 H ATOM 1675 HZ3 LYS A 532 7.931 7.631 44.780 1.00 0.00 H ATOM 1676 H LYS A 532 9.057 13.735 49.321 1.00 0.00 H ATOM 1677 N VAL A 533 10.480 10.370 50.689 1.00 71.95 N ATOM 1678 CA VAL A 533 11.845 9.936 50.919 1.00 73.16 C ATOM 1679 C VAL A 533 11.981 8.539 50.347 1.00 71.69 C ATOM 1680 O VAL A 533 11.067 7.728 50.469 1.00 69.95 O ATOM 1681 CB VAL A 533 12.168 9.961 52.420 1.00 74.26 C ATOM 1682 CG1 VAL A 533 13.643 9.909 52.632 1.00 76.20 C ATOM 1683 CG2 VAL A 533 11.601 11.205 53.046 1.00 77.31 C ATOM 1684 H VAL A 533 9.719 9.875 51.197 1.00 0.00 H ATOM 1685 N THR A 534 13.100 8.263 49.703 1.00 72.93 N ATOM 1686 CA THR A 534 13.295 7.023 48.962 1.00 71.77 C ATOM 1687 C THR A 534 14.608 6.343 49.335 1.00 72.92 C ATOM 1688 O THR A 534 15.622 7.014 49.488 1.00 77.43 O ATOM 1689 CB THR A 534 13.265 7.347 47.494 1.00 71.65 C ATOM 1690 OG1 THR A 534 12.124 8.163 47.235 1.00 79.40 O ATOM 1691 CG2 THR A 534 13.192 6.113 46.680 1.00 70.31 C ATOM 1692 HG1 THR A 534 12.091 8.385 46.271 1.00 0.00 H ATOM 1693 H THR A 534 13.873 8.958 49.725 1.00 0.00 H ATOM 1694 N ILE A 535 14.604 5.020 49.481 1.00 71.49 N ATOM 1695 CA ILE A 535 15.809 4.267 49.834 1.00 72.61 C ATOM 1696 C ILE A 535 16.022 3.118 48.860 1.00 73.16 C ATOM 1697 O ILE A 535 15.247 2.163 48.850 1.00 76.09 O ATOM 1698 CB ILE A 535 15.767 3.751 51.273 1.00 72.90 C ATOM 1699 CG1 ILE A 535 15.818 4.920 52.237 1.00 74.34 C ATOM 1700 CG2 ILE A 535 16.912 2.826 51.518 1.00 73.95 C ATOM 1701 CD1 ILE A 535 15.148 4.653 53.541 1.00 74.10 C ATOM 1702 H ILE A 535 13.713 4.503 49.339 1.00 0.00 H ATOM 1703 N ARG A 536 17.045 3.219 48.026 1.00 80.32 N ATOM 1704 CA ARG A 536 17.382 2.170 47.070 1.00 79.77 C ATOM 1705 C ARG A 536 18.371 1.197 47.697 1.00 80.70 C ATOM 1706 O ARG A 536 19.373 1.627 48.256 1.00 82.56 O ATOM 1707 CB ARG A 536 17.986 2.783 45.821 1.00 80.70 C ATOM 1708 CG ARG A 536 17.809 1.980 44.596 1.00 82.59 C ATOM 1709 CD ARG A 536 17.911 2.900 43.444 1.00 89.11 C ATOM 1710 NE ARG A 536 17.538 2.230 42.228 1.00 89.08 N ATOM 1711 CZ ARG A 536 16.768 2.776 41.318 1.00 94.93 C ATOM 1712 NH1 ARG A 536 16.299 3.996 41.505 1.00 95.51 N ATOM 1713 NH2 ARG A 536 16.476 2.097 40.237 1.00105.93 N ATOM 1714 HE ARG A 536 17.896 1.268 42.062 1.00 0.00 H ATOM 1715 HH12 ARG A 536 15.688 4.434 40.786 1.00 0.00 H ATOM 1716 HH11 ARG A 536 16.541 4.519 42.371 1.00 0.00 H ATOM 1717 HH22 ARG A 536 15.866 2.518 39.507 1.00 0.00 H ATOM 1718 HH21 ARG A 536 16.854 1.137 40.108 1.00 0.00 H ATOM 1719 H ARG A 536 17.630 4.078 48.053 1.00 0.00 H ATOM 1720 N LEU A 537 18.092 -0.104 47.617 1.00 83.70 N ATOM 1721 CA LEU A 537 18.954 -1.108 48.236 1.00 83.22 C ATOM 1722 C LEU A 537 19.344 -2.188 47.236 1.00 92.25 C ATOM 1723 O LEU A 537 18.511 -2.599 46.420 1.00 98.37 O ATOM 1724 CB LEU A 537 18.242 -1.771 49.408 1.00 81.77 C ATOM 1725 CG LEU A 537 17.887 -0.878 50.586 1.00 89.22 C ATOM 1726 CD1 LEU A 537 17.555 -1.725 51.789 1.00 94.83 C ATOM 1727 CD2 LEU A 537 19.009 0.058 50.907 1.00 86.82 C ATOM 1728 H LEU A 537 17.242 -0.411 47.103 1.00 0.00 H ATOM 1729 N PRO A 538 20.572 -2.703 47.292 1.00101.74 N ATOM 1730 CA PRO A 538 21.016 -3.657 46.273 1.00104.10 C ATOM 1731 C PRO A 538 20.545 -5.077 46.561 1.00106.24 C ATOM 1732 O PRO A 538 20.230 -5.451 47.692 1.00106.17 O ATOM 1733 CB PRO A 538 22.543 -3.554 46.338 1.00102.72 C ATOM 1734 CG PRO A 538 22.822 -3.253 47.761 1.00103.19 C ATOM 1735 CD PRO A 538 21.605 -2.509 48.324 1.00102.74 C ATOM 1736 N LEU A 539 20.505 -5.864 45.492 1.00115.47 N ATOM 1737 CA LEU A 539 20.125 -7.275 45.540 1.00115.45 C ATOM 1738 C LEU A 539 18.853 -7.511 46.348 1.00116.61 C ATOM 1739 O LEU A 539 17.763 -7.177 45.890 1.00117.62 O ATOM 1740 CB LEU A 539 21.296 -8.115 46.089 1.00110.87 C ATOM 1741 CG LEU A 539 21.479 -8.404 47.582 1.00103.21 C ATOM 1742 CD1 LEU A 539 21.334 -9.895 47.864 1.00 99.34 C ATOM 1743 CD2 LEU A 539 22.836 -7.896 48.045 1.00 98.03 C ATOM 1744 H LEU A 539 20.758 -5.454 44.570 1.00 0.00 H TER 1745 LEU A 539 HETATM 1746 C1' JSJ A 1 12.335 19.047 57.871 1.00 0.20 C HETATM 1747 C2' JSJ A 1 11.536 19.763 58.937 1.00 0.14 C HETATM 1748 C3' JSJ A 1 12.561 20.151 59.964 1.00 0.11 C HETATM 1749 C4' JSJ A 1 13.721 19.189 59.754 1.00 0.12 C HETATM 1750 C5' JSJ A 1 13.689 17.994 60.705 1.00 0.11 C HETATM 1751 O5' JSJ A 1 14.986 17.394 60.793 1.00 -0.25 O HETATM 1752 PA JSJ A 1 15.367 16.254 61.871 1.00 0.30 P HETATM 1753 O1A JSJ A 1 16.703 15.688 61.498 1.00 -0.61 O HETATM 1754 O2A JSJ A 1 14.192 15.340 62.090 1.00 -0.61 O HETATM 1755 O3A JSJ A 1 15.625 17.068 63.224 1.00 -0.15 O HETATM 1756 PB JSJ A 1 15.173 16.377 64.594 1.00 0.23 P HETATM 1757 O1B JSJ A 1 13.679 16.552 64.523 1.00 -0.61 O HETATM 1758 O2B JSJ A 1 15.631 14.963 64.393 1.00 -0.61 O HETATM 1759 S1 JSJ A 1 16.082 17.287 65.963 1.00 0.04 S HETATM 1760 S2 JSJ A 1 15.232 19.166 66.028 1.00 -0.04 S HETATM 1761 C13 JSJ A 1 14.419 19.951 67.314 1.00 0.07 C HETATM 1762 C12 JSJ A 1 13.382 20.471 67.102 1.00 0.05 C HETATM 1763 C11 JSJ A 1 13.454 21.257 66.023 1.00 0.00 C HETATM 1764 C10 JSJ A 1 12.172 22.040 65.830 1.00 0.01 C HETATM 1765 C17 JSJ A 1 12.465 23.534 65.898 1.00 -0.04 C HETATM 1766 H11 JSJ A 1 13.087 23.825 65.039 1.00 0.02 H HETATM 1767 H12 JSJ A 1 13.001 23.761 66.832 1.00 0.02 H HETATM 1768 H13 JSJ A 1 11.519 24.095 65.873 1.00 0.02 H HETATM 1769 C18 JSJ A 1 11.514 21.660 64.509 1.00 -0.04 C HETATM 1770 H14 JSJ A 1 11.318 20.578 64.495 1.00 0.02 H HETATM 1771 H15 JSJ A 1 12.184 21.922 63.677 1.00 0.02 H HETATM 1772 H16 JSJ A 1 10.565 22.206 64.401 1.00 0.02 H HETATM 1773 N10 JSJ A 1 11.338 21.587 66.961 1.00 0.36 N HETATM 1774 C14 JSJ A 1 12.049 20.613 67.814 1.00 0.04 C HETATM 1775 C15 JSJ A 1 11.277 19.302 67.852 1.00 -0.02 C HETATM 1776 H5 JSJ A 1 11.811 18.581 68.488 1.00 0.02 H HETATM 1777 H6 JSJ A 1 11.190 18.898 66.833 1.00 0.02 H HETATM 1778 H7 JSJ A 1 10.272 19.480 68.263 1.00 0.02 H HETATM 1779 C16 JSJ A 1 12.250 21.179 69.220 1.00 -0.02 C HETATM 1780 H8 JSJ A 1 12.810 22.124 69.158 1.00 0.02 H HETATM 1781 H9 JSJ A 1 12.815 20.457 69.829 1.00 0.02 H HETATM 1782 H10 JSJ A 1 11.270 21.363 69.685 1.00 0.02 H HETATM 1783 O6 JSJ A 1 9.977 22.076 67.221 1.00 -0.35 O HETATM 1784 H29 JSJ A 1 9.728 22.693 66.543 1.00 0.27 H HETATM 1785 H24 JSJ A 1 10.944 20.845 66.404 1.00 0.22 H HETATM 1786 H2 JSJ A 1 14.321 21.325 65.368 1.00 0.10 H HETATM 1787 H3 JSJ A 1 14.247 19.196 68.095 1.00 0.07 H HETATM 1788 H4 JSJ A 1 15.097 20.728 67.697 1.00 0.07 H HETATM 1789 H21 JSJ A 1 12.970 17.251 60.330 1.00 0.06 H HETATM 1790 H22 JSJ A 1 13.378 18.333 61.704 1.00 0.06 H HETATM 1791 O4' JSJ A 1 13.603 18.708 58.423 1.00 -0.34 O HETATM 1792 H20 JSJ A 1 14.672 19.727 59.885 1.00 0.07 H HETATM 1793 O3' JSJ A 1 12.959 21.490 59.663 1.00 -0.39 O HETATM 1794 H28 JSJ A 1 12.224 22.076 59.799 1.00 0.21 H HETATM 1795 H19 JSJ A 1 12.165 20.080 60.988 1.00 0.06 H HETATM 1796 O2' JSJ A 1 10.935 20.935 58.374 1.00 -0.38 O HETATM 1797 H27 JSJ A 1 11.606 21.466 57.961 1.00 0.21 H HETATM 1798 H18 JSJ A 1 10.764 19.109 59.369 1.00 0.07 H HETATM 1799 N9 JSJ A 1 11.597 17.805 57.629 1.00 -0.19 N HETATM 1800 C4 JSJ A 1 10.317 17.745 57.292 1.00 0.16 C HETATM 1801 C5 JSJ A 1 9.995 16.331 57.173 1.00 0.10 C HETATM 1802 C6 JSJ A 1 8.601 16.007 56.788 1.00 0.13 C HETATM 1803 N1 JSJ A 1 7.747 17.018 56.571 1.00 -0.27 N HETATM 1804 C2 JSJ A 1 8.124 18.289 56.699 1.00 0.05 C HETATM 1805 N3 JSJ A 1 9.359 18.655 57.043 1.00 -0.27 N HETATM 1806 H17 JSJ A 1 7.390 19.065 56.514 1.00 0.10 H HETATM 1807 N6 JSJ A 1 8.165 14.736 56.647 1.00 -0.32 N HETATM 1808 H25 JSJ A 1 7.188 14.554 56.378 1.00 0.18 H HETATM 1809 H26 JSJ A 1 8.810 13.949 56.809 1.00 0.18 H HETATM 1810 N7 JSJ A 1 11.129 15.664 57.466 1.00 -0.30 N HETATM 1811 C8 JSJ A 1 12.090 16.572 57.748 1.00 0.11 C HETATM 1812 H23 JSJ A 1 13.114 16.332 58.030 1.00 0.13 H HETATM 1813 H1 JSJ A 1 12.442 19.650 56.958 1.00 0.10 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1352 1353 1359 1360 1361 CONECT 1359 1352 CONECT 1360 1352 CONECT 1361 1352 CONECT 1746 1747 1791 1799 1813 CONECT 1747 1746 1748 1796 1798 CONECT 1748 1747 1749 1793 1795 CONECT 1749 1748 1750 1791 1792 CONECT 1750 1749 1751 1789 1790 CONECT 1751 1750 1752 CONECT 1752 1751 1753 1754 1755 CONECT 1753 1752 CONECT 1754 1752 CONECT 1755 1752 1756 CONECT 1756 1755 1757 1758 1759 CONECT 1757 1756 CONECT 1758 1756 CONECT 1759 1756 1760 CONECT 1760 1759 1761 CONECT 1761 1760 1762 1787 1788 CONECT 1762 1761 1763 1774 CONECT 1763 1762 1764 1786 CONECT 1764 1763 1765 1769 1773 CONECT 1765 1764 1766 1767 1768 CONECT 1766 1765 CONECT 1767 1765 CONECT 1768 1765 CONECT 1769 1764 1770 1771 1772 CONECT 1770 1769 CONECT 1771 1769 CONECT 1772 1769 CONECT 1773 1764 1774 1783 1785 CONECT 1774 1762 1773 1775 1779 CONECT 1775 1774 1776 1777 1778 CONECT 1776 1775 CONECT 1777 1775 CONECT 1778 1775 CONECT 1779 1774 1780 1781 1782 CONECT 1780 1779 CONECT 1781 1779 CONECT 1782 1779 CONECT 1783 1773 1784 CONECT 1784 1783 CONECT 1785 1773 CONECT 1786 1763 CONECT 1787 1761 CONECT 1788 1761 CONECT 1789 1750 CONECT 1790 1750 CONECT 1791 1746 1749 CONECT 1792 1749 CONECT 1793 1748 1794 CONECT 1794 1793 CONECT 1795 1748 CONECT 1796 1747 1797 CONECT 1797 1796 CONECT 1798 1747 CONECT 1799 1746 1800 1811 CONECT 1800 1799 1801 1805 CONECT 1801 1800 1802 1810 CONECT 1802 1801 1803 1807 CONECT 1803 1802 1804 CONECT 1804 1803 1805 1806 CONECT 1805 1800 1804 CONECT 1806 1804 CONECT 1807 1802 1808 1809 CONECT 1808 1807 CONECT 1809 1807 CONECT 1810 1801 1811 CONECT 1811 1799 1810 1812 CONECT 1812 1811 CONECT 1813 1746 MASTER 0 0 0 0 0 0 0 0 1811 2 76 15 END
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Structure:
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Related entries of code: 6mi6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1i5d
RCSB PDB
PDBbind
191aa, >1I5D_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6mi6
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CheA
Ligand Name
JSJ
EC.Number
E.C.-.-.-.-
Resolution
2.95(Å)
Affinity (Kd/Ki/IC50)
Ki=29uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2018) Appl.Magn.Reson. Vol. 49: pp. 1385-1395
Ligand Properties
Formula
C
1
9
H
3
3
N
6
O
1
0
P
2
S
2
Molecular Weight
631.577
Exact Mass
631.117
No. of atoms
72
No. of bonds
75
Polar Surface Area
321.14
LOGP Value
-3.13 (
Computed with XLOGP3
)
1.69 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 5
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 13
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 4
Canonical SMILES
O[C@@H]1[C@@H](COP(OP(SSCC2=CC([N@@H+](C2(C)C)O)(C)C)(O)O)(O)O)O[C@H]([C@@H]1O)n1cnc2c1ncnc2N
InChI String
InChI=1S/C19H34N6O10P2S2/c1-18(2)5-10(19(3,4)25(18)28)7-38-39-37(31,32)35-36(29,30)33-6-11-13(26)14(27)17(34-11)24-9-23-12-15(20)21-8-22-16(12)24/h5,8-9,11,13-14,17,26-32,36-37H,6-7H2,1-4H3,(H2,20,21,22)/p+1/t11-,13-,14-,17-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q56310
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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