Browse entries in the PDBbind-CN Database
HEADER 4X7K_COMPLEX COMPND 4X7K_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 79 TYR ILE SER ARG TYR LEU THR ASP PHE GLU PRO ILE GLN SEQRES 2 A 79 CYS LEU GLY ARG GLY GLY PHE GLY VAL VAL PHE GLU ALA SEQRES 3 A 79 LYS ASN LYS VAL ASP ASP CYS ASN TYR ALA ILE LYS ARG SEQRES 4 A 79 ILE ARG LEU PRO ASN ARG GLU LEU ALA ARG GLU LYS VAL SEQRES 5 A 79 MET ARG GLU VAL LYS ALA LEU ALA LYS LEU GLU HIS PRO SEQRES 6 A 79 GLY ILE VAL ARG TYR PHE ASN ALA TRP LEU GLU ALA PRO SEQRES 7 A 79 PRO SEQRES 1 A 80 LYS VAL TYR LEU TYR ILE GLN MET GLN LEU CYS ARG LYS SEQRES 2 A 80 GLU ASN LEU LYS ASP TRP MET ASN GLY ARG CYS THR ILE SEQRES 3 A 80 GLU GLU ARG GLU ARG SER VAL CYS LEU HIS ILE PHE LEU SEQRES 4 A 80 GLN ILE ALA GLU ALA VAL GLU PHE LEU HIS SER LYS GLY SEQRES 5 A 80 LEU MET HIS ARG ASN LEU LYS PRO SER ASN ILE PHE PHE SEQRES 6 A 80 THR MET ASP ASP VAL VAL LYS VAL GLY ASP PHE GLY LEU SEQRES 7 A 80 VAL THR SEQRES 1 A 101 THR LYS LEU TYR MET SER PRO GLU GLN ILE HIS GLY ASN SEQRES 2 A 101 SER TYR SER HIS LYS VAL ASP ILE PHE SER LEU GLY LEU SEQRES 3 A 101 ILE LEU PHE GLU LEU LEU TYR PRO PHE SER THR GLN MET SEQRES 4 A 101 GLU ARG VAL ARG THR LEU THR ASP VAL ARG ASN LEU LYS SEQRES 5 A 101 PHE PRO PRO LEU PHE THR GLN LYS TYR PRO CYS GLU TYR SEQRES 6 A 101 VAL MET VAL GLN ASP MET LEU SER PRO SER PRO MET GLU SEQRES 7 A 101 ARG PRO GLU ALA ILE ASN ILE ILE GLU ASN ALA VAL PHE SEQRES 8 A 101 GLU ASP LEU ASP PHE PRO GLY LYS THR VAL HET UNN A 523 70 ATOM 1 N TYR A 585 3.449 -5.493 -0.192 1.00 67.05 N ATOM 2 CA TYR A 585 4.260 -4.367 0.358 1.00 63.70 C ATOM 3 C TYR A 585 4.835 -3.495 -0.753 1.00 61.70 C ATOM 4 O TYR A 585 5.386 -4.003 -1.732 1.00 63.29 O ATOM 5 CB TYR A 585 5.394 -4.894 1.250 1.00 62.72 C ATOM 6 CG TYR A 585 6.235 -3.804 1.883 1.00 58.54 C ATOM 7 CD1 TYR A 585 5.799 -3.142 3.032 1.00 57.47 C ATOM 8 CD2 TYR A 585 7.465 -3.430 1.332 1.00 55.92 C ATOM 9 CE1 TYR A 585 6.559 -2.138 3.617 1.00 54.63 C ATOM 10 CE2 TYR A 585 8.237 -2.421 1.910 1.00 53.64 C ATOM 11 CZ TYR A 585 7.775 -1.782 3.053 1.00 53.14 C ATOM 12 OH TYR A 585 8.521 -0.787 3.636 1.00 50.46 O ATOM 13 HH TYR A 585 8.046 -0.445 4.434 1.00 0.00 H ATOM 14 HN3 TYR A 585 4.049 -6.087 -0.799 1.00 0.00 H ATOM 15 HN2 TYR A 585 2.660 -5.110 -0.751 1.00 0.00 H ATOM 16 HN1 TYR A 585 3.074 -6.064 0.592 1.00 0.00 H ATOM 17 N ILE A 586 4.707 -2.181 -0.588 1.00 58.81 N ATOM 18 CA ILE A 586 5.277 -1.225 -1.535 1.00 55.77 C ATOM 19 C ILE A 586 6.580 -0.629 -0.986 1.00 50.84 C ATOM 20 O ILE A 586 6.591 0.012 0.070 1.00 49.20 O ATOM 21 CB ILE A 586 4.241 -0.132 -1.967 1.00 56.46 C ATOM 22 CG1 ILE A 586 4.806 0.743 -3.093 1.00 56.52 C ATOM 23 CG2 ILE A 586 3.764 0.706 -0.767 1.00 57.50 C ATOM 24 CD1 ILE A 586 3.747 1.371 -3.995 1.00 61.27 C ATOM 25 H ILE A 586 4.186 -1.824 0.239 1.00 0.00 H ATOM 26 N SER A 587 7.677 -0.872 -1.699 1.00 48.09 N ATOM 27 CA SER A 587 8.974 -0.308 -1.335 1.00 43.30 C ATOM 28 C SER A 587 9.118 1.097 -1.900 1.00 41.32 C ATOM 29 O SER A 587 9.089 1.297 -3.116 1.00 41.48 O ATOM 30 CB SER A 587 10.122 -1.200 -1.820 1.00 43.33 C ATOM 31 OG SER A 587 11.381 -0.563 -1.644 1.00 38.67 O ATOM 32 HG SER A 587 11.519 -0.366 -0.684 1.00 0.00 H ATOM 33 H SER A 587 7.609 -1.481 -2.539 1.00 0.00 H ATOM 34 N ARG A 588 9.265 2.062 -0.998 1.00 38.78 N ATOM 35 CA ARG A 588 9.519 3.452 -1.346 1.00 36.81 C ATOM 36 C ARG A 588 10.731 3.570 -2.275 1.00 34.87 C ATOM 37 O ARG A 588 10.671 4.251 -3.304 1.00 34.28 O ATOM 38 CB ARG A 588 9.745 4.243 -0.060 1.00 36.63 C ATOM 39 CG ARG A 588 10.342 5.615 -0.232 1.00 38.09 C ATOM 40 CD ARG A 588 9.279 6.681 -0.148 1.00 45.46 C ATOM 41 NE ARG A 588 9.558 7.617 0.945 1.00 45.96 N ATOM 42 CZ ARG A 588 10.563 8.491 0.957 1.00 44.47 C ATOM 43 NH1 ARG A 588 11.412 8.553 -0.061 1.00 40.20 N ATOM 44 NH2 ARG A 588 10.727 9.298 2.000 1.00 42.40 N ATOM 45 HE ARG A 588 8.926 7.597 1.771 1.00 0.00 H ATOM 46 HH12 ARG A 588 12.194 9.238 -0.045 1.00 0.00 H ATOM 47 HH11 ARG A 588 11.295 7.917 -0.875 1.00 0.00 H ATOM 48 HH22 ARG A 588 11.511 9.981 2.011 1.00 0.00 H ATOM 49 HH21 ARG A 588 10.071 9.247 2.805 1.00 0.00 H ATOM 50 H ARG A 588 9.195 1.811 0.009 1.00 0.00 H ATOM 51 N TYR A 589 11.818 2.894 -1.908 1.00 32.63 N ATOM 52 CA TYR A 589 13.043 2.893 -2.706 1.00 31.19 C ATOM 53 C TYR A 589 12.795 2.373 -4.123 1.00 32.74 C ATOM 54 O TYR A 589 13.165 3.029 -5.095 1.00 30.88 O ATOM 55 CB TYR A 589 14.155 2.090 -2.007 1.00 30.50 C ATOM 56 CG TYR A 589 15.424 1.944 -2.827 1.00 30.96 C ATOM 57 CD1 TYR A 589 16.154 3.068 -3.235 1.00 31.64 C ATOM 58 CD2 TYR A 589 15.899 0.684 -3.190 1.00 34.78 C ATOM 59 CE1 TYR A 589 17.318 2.934 -3.996 1.00 29.83 C ATOM 60 CE2 TYR A 589 17.062 0.540 -3.943 1.00 35.61 C ATOM 61 CZ TYR A 589 17.767 1.669 -4.341 1.00 34.80 C ATOM 62 OH TYR A 589 18.917 1.528 -5.088 1.00 36.37 O ATOM 63 HH TYR A 589 18.703 1.064 -5.936 1.00 0.00 H ATOM 64 H TYR A 589 11.795 2.348 -1.023 1.00 0.00 H ATOM 65 N LEU A 590 12.153 1.211 -4.239 1.00 35.08 N ATOM 66 CA LEU A 590 11.897 0.615 -5.547 1.00 38.24 C ATOM 67 C LEU A 590 10.871 1.397 -6.378 1.00 38.57 C ATOM 68 O LEU A 590 10.928 1.380 -7.607 1.00 39.58 O ATOM 69 CB LEU A 590 11.472 -0.856 -5.412 1.00 41.37 C ATOM 70 CG LEU A 590 12.470 -1.820 -4.749 1.00 45.38 C ATOM 71 CD1 LEU A 590 11.860 -3.210 -4.607 1.00 49.17 C ATOM 72 CD2 LEU A 590 13.801 -1.886 -5.507 1.00 49.30 C ATOM 73 H LEU A 590 11.828 0.720 -3.382 1.00 0.00 H ATOM 74 N THR A 591 9.942 2.077 -5.712 1.00 37.82 N ATOM 75 CA THR A 591 8.902 2.833 -6.415 1.00 39.13 C ATOM 76 C THR A 591 9.428 4.167 -6.948 1.00 37.22 C ATOM 77 O THR A 591 9.088 4.575 -8.059 1.00 37.76 O ATOM 78 CB THR A 591 7.666 3.073 -5.520 1.00 40.66 C ATOM 79 OG1 THR A 591 7.288 1.842 -4.892 1.00 43.82 O ATOM 80 CG2 THR A 591 6.481 3.577 -6.344 1.00 42.23 C ATOM 81 HG1 THR A 591 8.039 1.511 -4.338 1.00 0.00 H ATOM 82 H THR A 591 9.954 2.072 -4.672 1.00 0.00 H ATOM 83 N ASP A 592 10.271 4.827 -6.159 1.00 33.88 N ATOM 84 CA ASP A 592 10.712 6.187 -6.469 1.00 32.62 C ATOM 85 C ASP A 592 12.022 6.272 -7.253 1.00 30.57 C ATOM 86 O ASP A 592 12.310 7.303 -7.868 1.00 28.05 O ATOM 87 CB ASP A 592 10.841 7.007 -5.182 1.00 31.93 C ATOM 88 CG ASP A 592 9.498 7.464 -4.633 1.00 38.00 C ATOM 89 OD1 ASP A 592 9.485 8.481 -3.902 1.00 42.49 O ATOM 90 OD2 ASP A 592 8.466 6.821 -4.930 1.00 39.44 O ATOM 91 H ASP A 592 10.626 4.364 -5.298 1.00 0.00 H ATOM 92 N PHE A 593 12.813 5.200 -7.226 1.00 29.06 N ATOM 93 CA PHE A 593 14.157 5.231 -7.806 1.00 28.13 C ATOM 94 C PHE A 593 14.414 4.132 -8.826 1.00 30.08 C ATOM 95 O PHE A 593 13.893 3.020 -8.702 1.00 31.33 O ATOM 96 CB PHE A 593 15.218 5.130 -6.703 1.00 26.32 C ATOM 97 CG PHE A 593 15.263 6.321 -5.788 1.00 25.22 C ATOM 98 CD1 PHE A 593 14.444 6.386 -4.662 1.00 25.21 C ATOM 99 CD2 PHE A 593 16.138 7.376 -6.044 1.00 23.98 C ATOM 100 CE1 PHE A 593 14.483 7.487 -3.815 1.00 24.72 C ATOM 101 CE2 PHE A 593 16.186 8.483 -5.199 1.00 22.49 C ATOM 102 CZ PHE A 593 15.359 8.530 -4.077 1.00 22.74 C ATOM 103 H PHE A 593 12.469 4.324 -6.784 1.00 0.00 H ATOM 104 N GLU A 594 15.229 4.461 -9.825 1.00 29.75 N ATOM 105 CA GLU A 594 15.796 3.473 -10.739 1.00 32.50 C ATOM 106 C GLU A 594 17.235 3.174 -10.300 1.00 32.10 C ATOM 107 O GLU A 594 18.100 4.051 -10.368 1.00 30.10 O ATOM 108 CB GLU A 594 15.758 3.993 -12.176 1.00 33.89 C ATOM 109 CG GLU A 594 14.336 4.256 -12.683 1.00 40.40 C ATOM 110 CD GLU A 594 14.282 4.926 -14.052 1.00 49.25 C ATOM 111 OE1 GLU A 594 13.165 5.013 -14.613 1.00 54.29 O ATOM 112 OE2 GLU A 594 15.338 5.361 -14.569 1.00 52.20 O ATOM 113 H GLU A 594 15.472 5.463 -9.961 1.00 0.00 H ATOM 114 N PRO A 595 17.491 1.947 -9.808 1.00 34.22 N ATOM 115 CA PRO A 595 18.842 1.616 -9.344 1.00 33.65 C ATOM 116 C PRO A 595 19.832 1.624 -10.504 1.00 33.73 C ATOM 117 O PRO A 595 19.504 1.161 -11.601 1.00 35.13 O ATOM 118 CB PRO A 595 18.686 0.195 -8.776 1.00 36.68 C ATOM 119 CG PRO A 595 17.210 0.047 -8.507 1.00 38.82 C ATOM 120 CD PRO A 595 16.559 0.821 -9.616 1.00 36.70 C ATOM 121 N ILE A 596 21.026 2.165 -10.266 1.00 31.52 N ATOM 122 CA ILE A 596 22.054 2.244 -11.305 1.00 32.72 C ATOM 123 C ILE A 596 23.181 1.239 -11.039 1.00 34.44 C ATOM 124 O ILE A 596 23.498 0.414 -11.899 1.00 35.54 O ATOM 125 CB ILE A 596 22.612 3.694 -11.467 1.00 31.84 C ATOM 126 CG1 ILE A 596 21.483 4.702 -11.758 1.00 30.45 C ATOM 127 CG2 ILE A 596 23.723 3.755 -12.530 1.00 32.84 C ATOM 128 CD1 ILE A 596 20.678 4.446 -13.041 1.00 36.02 C ATOM 129 H ILE A 596 21.233 2.541 -9.318 1.00 0.00 H ATOM 130 N GLN A 597 23.769 1.304 -9.846 1.00 33.19 N ATOM 131 CA GLN A 597 24.857 0.397 -9.464 1.00 35.31 C ATOM 132 C GLN A 597 25.059 0.365 -7.955 1.00 33.89 C ATOM 133 O GLN A 597 24.595 1.252 -7.241 1.00 30.79 O ATOM 134 CB GLN A 597 26.168 0.797 -10.157 1.00 35.69 C ATOM 135 CG GLN A 597 26.720 2.163 -9.739 1.00 36.48 C ATOM 136 CD GLN A 597 27.992 2.531 -10.480 1.00 42.32 C ATOM 137 OE1 GLN A 597 28.881 1.697 -10.663 1.00 46.78 O ATOM 138 NE2 GLN A 597 28.086 3.785 -10.909 1.00 42.23 N ATOM 139 HE22 GLN A 597 27.310 4.455 -10.732 1.00 0.00 H ATOM 140 HE21 GLN A 597 28.935 4.097 -11.422 1.00 0.00 H ATOM 141 H GLN A 597 23.447 2.020 -9.164 1.00 0.00 H ATOM 142 N CYS A 598 25.745 -0.670 -7.477 1.00 34.85 N ATOM 143 CA CYS A 598 26.203 -0.710 -6.095 1.00 35.16 C ATOM 144 C CYS A 598 27.530 0.047 -6.010 1.00 34.78 C ATOM 145 O CYS A 598 28.465 -0.247 -6.763 1.00 36.79 O ATOM 146 CB CYS A 598 26.391 -2.154 -5.622 1.00 37.21 C ATOM 147 SG CYS A 598 26.839 -2.300 -3.881 1.00 39.53 S ATOM 148 H CYS A 598 25.959 -1.470 -8.106 1.00 0.00 H ATOM 149 N LEU A 599 27.603 1.015 -5.101 1.00 31.67 N ATOM 150 CA LEU A 599 28.825 1.794 -4.895 1.00 31.52 C ATOM 151 C LEU A 599 29.741 1.175 -3.843 1.00 33.67 C ATOM 152 O LEU A 599 30.945 1.434 -3.841 1.00 34.65 O ATOM 153 CB LEU A 599 28.491 3.243 -4.518 1.00 29.10 C ATOM 154 CG LEU A 599 27.696 4.056 -5.546 1.00 27.03 C ATOM 155 CD1 LEU A 599 27.253 5.383 -4.945 1.00 26.00 C ATOM 156 CD2 LEU A 599 28.492 4.268 -6.830 1.00 29.28 C ATOM 157 H LEU A 599 26.767 1.225 -4.519 1.00 0.00 H ATOM 158 N GLY A 600 29.170 0.364 -2.952 1.00 34.16 N ATOM 159 CA GLY A 600 29.955 -0.382 -1.966 1.00 36.28 C ATOM 160 C GLY A 600 29.187 -0.723 -0.701 1.00 37.33 C ATOM 161 O GLY A 600 27.968 -0.553 -0.640 1.00 34.89 O ATOM 162 H GLY A 600 28.135 0.258 -2.957 1.00 0.00 H ATOM 163 N ARG A 601 29.909 -1.196 0.315 1.00 38.91 N ATOM 164 CA ARG A 601 29.304 -1.619 1.586 1.00 41.07 C ATOM 165 C ARG A 601 30.255 -1.437 2.773 1.00 41.59 C ATOM 166 O ARG A 601 31.474 -1.358 2.591 1.00 42.73 O ATOM 167 CB ARG A 601 28.846 -3.083 1.500 1.00 43.16 C ATOM 168 CG ARG A 601 29.965 -4.081 1.221 1.00 48.94 C ATOM 169 CD ARG A 601 29.429 -5.475 0.899 1.00 56.57 C ATOM 170 NE ARG A 601 28.666 -5.502 -0.351 1.00 61.76 N ATOM 171 CZ ARG A 601 27.370 -5.795 -0.443 1.00 63.82 C ATOM 172 NH1 ARG A 601 26.668 -6.107 0.642 1.00 64.06 N ATOM 173 NH2 ARG A 601 26.774 -5.789 -1.629 1.00 64.66 N ATOM 174 HE ARG A 601 29.173 -5.276 -1.230 1.00 0.00 H ATOM 175 HH12 ARG A 601 25.656 -6.334 0.559 1.00 0.00 H ATOM 176 HH11 ARG A 601 27.130 -6.124 1.573 1.00 0.00 H ATOM 177 HH22 ARG A 601 25.762 -6.017 -1.704 1.00 0.00 H ATOM 178 HH21 ARG A 601 27.319 -5.556 -2.484 1.00 0.00 H ATOM 179 H ARG A 601 30.941 -1.269 0.204 1.00 0.00 H ATOM 180 N GLY A 602 29.687 -1.379 3.979 1.00 41.78 N ATOM 181 CA GLY A 602 30.468 -1.274 5.215 1.00 43.54 C ATOM 182 C GLY A 602 29.624 -1.065 6.463 1.00 43.48 C ATOM 183 O GLY A 602 28.643 -0.309 6.444 1.00 42.74 O ATOM 184 H GLY A 602 28.650 -1.409 4.045 1.00 0.00 H ATOM 185 N GLY A 603 30.009 -1.733 7.549 1.00 44.27 N ATOM 186 CA GLY A 603 29.287 -1.632 8.822 1.00 44.17 C ATOM 187 C GLY A 603 27.864 -2.153 8.715 1.00 43.36 C ATOM 188 O GLY A 603 27.645 -3.290 8.296 1.00 43.66 O ATOM 189 H GLY A 603 30.848 -2.345 7.493 1.00 0.00 H ATOM 190 N PHE A 604 26.898 -1.312 9.083 1.00 42.05 N ATOM 191 CA PHE A 604 25.481 -1.668 8.976 1.00 41.73 C ATOM 192 C PHE A 604 24.929 -1.438 7.560 1.00 39.71 C ATOM 193 O PHE A 604 23.759 -1.722 7.300 1.00 38.36 O ATOM 194 CB PHE A 604 24.623 -0.868 9.977 1.00 41.40 C ATOM 195 CG PHE A 604 24.979 -1.086 11.431 1.00 45.40 C ATOM 196 CD1 PHE A 604 25.064 -2.372 11.970 1.00 49.02 C ATOM 197 CD2 PHE A 604 25.188 0.008 12.272 1.00 46.16 C ATOM 198 CE1 PHE A 604 25.382 -2.566 13.321 1.00 51.90 C ATOM 199 CE2 PHE A 604 25.505 -0.174 13.626 1.00 48.88 C ATOM 200 CZ PHE A 604 25.603 -1.464 14.150 1.00 49.93 C ATOM 201 H PHE A 604 27.157 -0.377 9.457 1.00 0.00 H ATOM 202 N GLY A 605 25.766 -0.944 6.649 1.00 37.98 N ATOM 203 CA GLY A 605 25.259 -0.403 5.381 1.00 35.91 C ATOM 204 C GLY A 605 25.702 -0.975 4.040 1.00 34.58 C ATOM 205 O GLY A 605 26.707 -1.686 3.934 1.00 36.09 O ATOM 206 H GLY A 605 26.789 -0.941 6.837 1.00 0.00 H ATOM 207 N VAL A 606 24.888 -0.669 3.027 1.00 31.88 N ATOM 208 CA VAL A 606 25.208 -0.897 1.615 1.00 30.49 C ATOM 209 C VAL A 606 24.849 0.403 0.887 1.00 28.35 C ATOM 210 O VAL A 606 23.848 1.033 1.219 1.00 26.91 O ATOM 211 CB VAL A 606 24.393 -2.076 1.017 1.00 32.99 C ATOM 212 CG1 VAL A 606 24.636 -2.207 -0.486 1.00 32.98 C ATOM 213 CG2 VAL A 606 24.720 -3.392 1.725 1.00 32.63 C ATOM 214 H VAL A 606 23.968 -0.241 3.254 1.00 0.00 H ATOM 215 N VAL A 607 25.658 0.816 -0.089 1.00 26.43 N ATOM 216 CA VAL A 607 25.385 2.079 -0.794 1.00 25.71 C ATOM 217 C VAL A 607 25.148 1.873 -2.291 1.00 25.74 C ATOM 218 O VAL A 607 25.898 1.155 -2.955 1.00 27.74 O ATOM 219 CB VAL A 607 26.490 3.152 -0.548 1.00 24.94 C ATOM 220 CG1 VAL A 607 26.076 4.504 -1.127 1.00 24.00 C ATOM 221 CG2 VAL A 607 26.786 3.291 0.955 1.00 26.17 C ATOM 222 H VAL A 607 26.485 0.244 -0.353 1.00 0.00 H ATOM 223 N PHE A 608 24.085 2.500 -2.792 1.00 24.51 N ATOM 224 CA PHE A 608 23.690 2.413 -4.197 1.00 26.16 C ATOM 225 C PHE A 608 23.741 3.788 -4.853 1.00 24.36 C ATOM 226 O PHE A 608 23.516 4.802 -4.192 1.00 23.85 O ATOM 227 CB PHE A 608 22.249 1.901 -4.317 1.00 26.32 C ATOM 228 CG PHE A 608 22.019 0.550 -3.698 1.00 30.68 C ATOM 229 CD1 PHE A 608 21.356 0.434 -2.480 1.00 34.27 C ATOM 230 CD2 PHE A 608 22.454 -0.605 -4.340 1.00 33.94 C ATOM 231 CE1 PHE A 608 21.136 -0.827 -1.904 1.00 34.90 C ATOM 232 CE2 PHE A 608 22.241 -1.867 -3.774 1.00 38.43 C ATOM 233 CZ PHE A 608 21.580 -1.973 -2.554 1.00 37.94 C ATOM 234 H PHE A 608 23.507 3.081 -2.152 1.00 0.00 H ATOM 235 N GLU A 609 24.029 3.815 -6.151 1.00 24.76 N ATOM 236 CA GLU A 609 23.684 4.968 -6.969 1.00 23.55 C ATOM 237 C GLU A 609 22.307 4.690 -7.560 1.00 24.10 C ATOM 238 O GLU A 609 22.056 3.597 -8.079 1.00 25.05 O ATOM 239 CB GLU A 609 24.705 5.208 -8.082 1.00 24.33 C ATOM 240 CG GLU A 609 24.323 6.356 -9.039 1.00 25.85 C ATOM 241 CD GLU A 609 25.328 6.573 -10.162 1.00 29.10 C ATOM 242 OE1 GLU A 609 26.396 5.930 -10.148 1.00 30.15 O ATOM 243 OE2 GLU A 609 25.044 7.394 -11.063 1.00 28.75 O ATOM 244 H GLU A 609 24.507 3.001 -6.587 1.00 0.00 H ATOM 245 N ALA A 610 21.408 5.662 -7.467 1.00 23.55 N ATOM 246 CA ALA A 610 20.065 5.487 -8.025 1.00 24.11 C ATOM 247 C ALA A 610 19.491 6.803 -8.524 1.00 23.69 C ATOM 248 O ALA A 610 19.761 7.862 -7.952 1.00 22.31 O ATOM 249 CB ALA A 610 19.135 4.848 -6.993 1.00 24.77 C ATOM 250 H ALA A 610 21.659 6.554 -6.995 1.00 0.00 H ATOM 251 N LYS A 611 18.706 6.729 -9.595 1.00 24.03 N ATOM 252 CA LYS A 611 18.100 7.920 -10.181 1.00 25.01 C ATOM 253 C LYS A 611 16.677 8.085 -9.672 1.00 24.26 C ATOM 254 O LYS A 611 15.869 7.165 -9.771 1.00 24.95 O ATOM 255 CB LYS A 611 18.104 7.831 -11.709 1.00 26.96 C ATOM 256 CG LYS A 611 17.356 8.970 -12.399 1.00 28.24 C ATOM 257 CD LYS A 611 17.186 8.709 -13.890 1.00 36.00 C ATOM 258 CE LYS A 611 18.498 8.866 -14.642 1.00 40.88 C ATOM 259 NZ LYS A 611 18.966 10.281 -14.654 1.00 43.01 N ATOM 260 HZ1 LYS A 611 18.251 10.877 -15.117 1.00 0.00 H ATOM 261 HZ2 LYS A 611 19.109 10.606 -13.676 1.00 0.00 H ATOM 262 HZ3 LYS A 611 19.863 10.344 -15.177 1.00 0.00 H ATOM 263 H LYS A 611 18.520 5.801 -10.025 1.00 0.00 H ATOM 264 N ASN A 612 16.376 9.256 -9.119 1.00 22.52 N ATOM 265 CA ASN A 612 15.005 9.565 -8.737 1.00 22.62 C ATOM 266 C ASN A 612 14.157 9.789 -9.994 1.00 23.65 C ATOM 267 O ASN A 612 14.504 10.601 -10.863 1.00 22.90 O ATOM 268 CB ASN A 612 14.967 10.763 -7.776 1.00 20.90 C ATOM 269 CG ASN A 612 13.565 11.074 -7.288 1.00 21.16 C ATOM 270 OD1 ASN A 612 12.815 11.772 -7.952 1.00 23.88 O ATOM 271 ND2 ASN A 612 13.211 10.554 -6.118 1.00 24.67 N ATOM 272 HD22 ASN A 612 13.883 9.965 -5.586 1.00 0.00 H ATOM 273 HD21 ASN A 612 12.262 10.736 -5.734 1.00 0.00 H ATOM 274 H ASN A 612 17.126 9.958 -8.958 1.00 0.00 H ATOM 275 N LYS A 613 13.056 9.045 -10.103 1.00 24.41 N ATOM 276 CA LYS A 613 12.217 9.084 -11.300 1.00 26.65 C ATOM 277 C LYS A 613 11.587 10.455 -11.549 1.00 26.78 C ATOM 278 O LYS A 613 11.511 10.908 -12.691 1.00 27.59 O ATOM 279 CB LYS A 613 11.127 8.005 -11.235 1.00 28.87 C ATOM 280 CG LYS A 613 11.670 6.581 -11.112 1.00 31.02 C ATOM 281 CD LYS A 613 10.542 5.559 -11.059 1.00 36.63 C ATOM 282 CE LYS A 613 11.078 4.172 -10.749 1.00 39.45 C ATOM 283 NZ LYS A 613 9.989 3.157 -10.747 1.00 44.41 N ATOM 284 HZ1 LYS A 613 9.284 3.408 -10.025 1.00 0.00 H ATOM 285 HZ2 LYS A 613 9.536 3.135 -11.683 1.00 0.00 H ATOM 286 HZ3 LYS A 613 10.389 2.221 -10.532 1.00 0.00 H ATOM 287 H LYS A 613 12.787 8.421 -9.316 1.00 0.00 H ATOM 288 N VAL A 614 11.148 11.112 -10.479 1.00 25.48 N ATOM 289 CA VAL A 614 10.441 12.390 -10.597 1.00 25.71 C ATOM 290 C VAL A 614 11.402 13.546 -10.917 1.00 23.92 C ATOM 291 O VAL A 614 11.129 14.342 -11.823 1.00 25.91 O ATOM 292 CB VAL A 614 9.583 12.689 -9.328 1.00 25.79 C ATOM 293 CG1 VAL A 614 9.080 14.138 -9.313 1.00 25.72 C ATOM 294 CG2 VAL A 614 8.389 11.714 -9.239 1.00 28.27 C ATOM 295 H VAL A 614 11.311 10.708 -9.534 1.00 0.00 H ATOM 296 N ASP A 615 12.519 13.640 -10.191 1.00 22.93 N ATOM 297 CA ASP A 615 13.432 14.777 -10.380 1.00 22.62 C ATOM 298 C ASP A 615 14.569 14.545 -11.383 1.00 23.25 C ATOM 299 O ASP A 615 15.274 15.492 -11.752 1.00 22.60 O ATOM 300 CB ASP A 615 13.914 15.384 -9.037 1.00 20.26 C ATOM 301 CG ASP A 615 14.993 14.559 -8.322 1.00 20.61 C ATOM 302 OD1 ASP A 615 15.674 13.720 -8.943 1.00 20.60 O ATOM 303 OD2 ASP A 615 15.184 14.795 -7.106 1.00 20.71 O ATOM 304 H ASP A 615 12.744 12.906 -9.489 1.00 0.00 H ATOM 305 N ASP A 616 14.723 13.291 -11.824 1.00 23.70 N ATOM 306 CA ASP A 616 15.691 12.901 -12.863 1.00 24.41 C ATOM 307 C ASP A 616 17.174 13.052 -12.462 1.00 23.51 C ATOM 308 O ASP A 616 18.069 13.031 -13.321 1.00 24.91 O ATOM 309 CB ASP A 616 15.399 13.633 -14.186 1.00 25.36 C ATOM 310 CG ASP A 616 15.929 12.888 -15.400 1.00 31.30 C ATOM 311 OD1 ASP A 616 16.438 13.553 -16.323 1.00 33.65 O ATOM 312 OD2 ASP A 616 15.835 11.642 -15.436 1.00 32.39 O ATOM 313 H ASP A 616 14.124 12.549 -11.409 1.00 0.00 H ATOM 314 N CYS A 617 17.430 13.190 -11.164 1.00 21.39 N ATOM 315 CA CYS A 617 18.796 13.314 -10.650 1.00 21.59 C ATOM 316 C CYS A 617 19.268 11.990 -10.066 1.00 21.73 C ATOM 317 O CYS A 617 18.453 11.209 -9.580 1.00 21.65 O ATOM 318 CB CYS A 617 18.875 14.394 -9.560 1.00 20.10 C ATOM 319 SG CYS A 617 18.461 16.060 -10.150 1.00 23.74 S ATOM 320 H CYS A 617 16.636 13.210 -10.493 1.00 0.00 H ATOM 321 N ASN A 618 20.582 11.762 -10.109 1.00 22.09 N ATOM 322 CA ASN A 618 21.203 10.573 -9.527 1.00 22.65 C ATOM 323 C ASN A 618 21.774 10.894 -8.150 1.00 21.72 C ATOM 324 O ASN A 618 22.438 11.923 -7.965 1.00 22.48 O ATOM 325 CB ASN A 618 22.324 10.042 -10.429 1.00 24.59 C ATOM 326 CG ASN A 618 21.802 9.435 -11.721 1.00 27.66 C ATOM 327 OD1 ASN A 618 20.732 9.797 -12.204 1.00 32.18 O ATOM 328 ND2 ASN A 618 22.560 8.507 -12.283 1.00 32.34 N ATOM 329 HD22 ASN A 618 23.459 8.231 -11.839 1.00 0.00 H ATOM 330 HD21 ASN A 618 22.257 8.054 -13.168 1.00 0.00 H ATOM 331 H ASN A 618 21.192 12.462 -10.578 1.00 0.00 H ATOM 332 N TYR A 619 21.522 10.001 -7.199 1.00 21.13 N ATOM 333 CA TYR A 619 21.913 10.197 -5.807 1.00 20.11 C ATOM 334 C TYR A 619 22.702 8.996 -5.294 1.00 20.64 C ATOM 335 O TYR A 619 22.647 7.915 -5.870 1.00 21.82 O ATOM 336 CB TYR A 619 20.657 10.354 -4.944 1.00 19.92 C ATOM 337 CG TYR A 619 19.825 11.573 -5.275 1.00 19.77 C ATOM 338 CD1 TYR A 619 20.101 12.803 -4.681 1.00 20.08 C ATOM 339 CD2 TYR A 619 18.766 11.499 -6.187 1.00 19.20 C ATOM 340 CE1 TYR A 619 19.342 13.934 -4.978 1.00 19.06 C ATOM 341 CE2 TYR A 619 17.997 12.622 -6.490 1.00 19.32 C ATOM 342 CZ TYR A 619 18.291 13.837 -5.877 1.00 19.35 C ATOM 343 OH TYR A 619 17.549 14.960 -6.172 1.00 19.16 O ATOM 344 HH TYR A 619 16.601 14.799 -5.938 1.00 0.00 H ATOM 345 H TYR A 619 21.025 9.125 -7.458 1.00 0.00 H ATOM 346 N ALA A 620 23.432 9.196 -4.201 1.00 20.10 N ATOM 347 CA ALA A 620 23.948 8.080 -3.430 1.00 20.64 C ATOM 348 C ALA A 620 22.943 7.775 -2.331 1.00 20.08 C ATOM 349 O ALA A 620 22.520 8.668 -1.591 1.00 20.03 O ATOM 350 CB ALA A 620 25.310 8.407 -2.838 1.00 20.87 C ATOM 351 H ALA A 620 23.637 10.168 -3.893 1.00 0.00 H ATOM 352 N ILE A 621 22.556 6.507 -2.233 1.00 20.50 N ATOM 353 CA ILE A 621 21.577 6.077 -1.242 1.00 21.00 C ATOM 354 C ILE A 621 22.168 4.972 -0.370 1.00 20.50 C ATOM 355 O ILE A 621 22.517 3.896 -0.861 1.00 21.84 O ATOM 356 CB ILE A 621 20.250 5.624 -1.910 1.00 22.70 C ATOM 357 CG1 ILE A 621 19.607 6.806 -2.661 1.00 23.93 C ATOM 358 CG2 ILE A 621 19.287 5.055 -0.861 1.00 26.29 C ATOM 359 CD1 ILE A 621 18.397 6.443 -3.458 1.00 32.59 C ATOM 360 H ILE A 621 22.963 5.803 -2.881 1.00 0.00 H ATOM 361 N LYS A 622 22.293 5.264 0.923 1.00 19.92 N ATOM 362 CA LYS A 622 22.823 4.301 1.884 1.00 20.73 C ATOM 363 C LYS A 622 21.664 3.578 2.549 1.00 21.04 C ATOM 364 O LYS A 622 20.755 4.210 3.090 1.00 22.74 O ATOM 365 CB LYS A 622 23.672 5.003 2.950 1.00 20.60 C ATOM 366 CG LYS A 622 24.313 4.053 3.966 1.00 22.06 C ATOM 367 CD LYS A 622 25.116 4.815 5.023 1.00 22.70 C ATOM 368 CE LYS A 622 26.406 5.420 4.452 1.00 24.89 C ATOM 369 NZ LYS A 622 27.247 6.019 5.546 1.00 24.31 N ATOM 370 HZ1 LYS A 622 26.708 6.769 6.025 1.00 0.00 H ATOM 371 HZ2 LYS A 622 27.499 5.279 6.232 1.00 0.00 H ATOM 372 HZ3 LYS A 622 28.113 6.421 5.135 1.00 0.00 H ATOM 373 H LYS A 622 22.005 6.205 1.258 1.00 0.00 H ATOM 374 N ARG A 623 21.703 2.254 2.510 1.00 22.52 N ATOM 375 CA ARG A 623 20.695 1.449 3.176 1.00 22.30 C ATOM 376 C ARG A 623 21.338 0.803 4.397 1.00 23.32 C ATOM 377 O ARG A 623 22.223 -0.044 4.268 1.00 24.71 O ATOM 378 CB ARG A 623 20.144 0.386 2.221 1.00 23.86 C ATOM 379 CG ARG A 623 19.011 -0.461 2.806 1.00 26.16 C ATOM 380 CD ARG A 623 18.711 -1.656 1.915 1.00 28.48 C ATOM 381 NE ARG A 623 19.667 -2.741 2.140 1.00 33.19 N ATOM 382 CZ ARG A 623 19.931 -3.711 1.269 1.00 36.87 C ATOM 383 NH1 ARG A 623 19.330 -3.737 0.086 1.00 38.14 N ATOM 384 NH2 ARG A 623 20.814 -4.652 1.578 1.00 37.11 N ATOM 385 HE ARG A 623 20.177 -2.755 3.046 1.00 0.00 H ATOM 386 HH12 ARG A 623 19.543 -4.499 -0.589 1.00 0.00 H ATOM 387 HH11 ARG A 623 18.646 -2.995 -0.166 1.00 0.00 H ATOM 388 HH22 ARG A 623 21.023 -5.412 0.899 1.00 0.00 H ATOM 389 HH21 ARG A 623 21.297 -4.630 2.499 1.00 0.00 H ATOM 390 H ARG A 623 22.471 1.782 1.992 1.00 0.00 H ATOM 391 N ILE A 624 20.890 1.224 5.574 1.00 23.35 N ATOM 392 CA ILE A 624 21.415 0.723 6.840 1.00 24.77 C ATOM 393 C ILE A 624 20.439 -0.298 7.412 1.00 25.90 C ATOM 394 O ILE A 624 19.267 0.015 7.623 1.00 26.10 O ATOM 395 CB ILE A 624 21.616 1.878 7.863 1.00 23.32 C ATOM 396 CG1 ILE A 624 22.734 2.819 7.398 1.00 25.86 C ATOM 397 CG2 ILE A 624 21.889 1.311 9.286 1.00 24.83 C ATOM 398 CD1 ILE A 624 22.813 4.154 8.168 1.00 25.93 C ATOM 399 H ILE A 624 20.135 1.939 5.594 1.00 0.00 H ATOM 400 N ARG A 625 20.911 -1.517 7.653 1.00 27.29 N ATOM 401 CA ARG A 625 20.090 -2.492 8.359 1.00 29.53 C ATOM 402 C ARG A 625 20.164 -2.156 9.843 1.00 29.78 C ATOM 403 O ARG A 625 21.237 -2.254 10.446 1.00 30.81 O ATOM 404 CB ARG A 625 20.578 -3.921 8.109 1.00 31.03 C ATOM 405 CG ARG A 625 19.739 -4.984 8.807 1.00 36.03 C ATOM 406 CD ARG A 625 20.415 -6.343 8.771 1.00 44.83 C ATOM 407 NE ARG A 625 19.731 -7.312 9.629 1.00 53.87 N ATOM 408 CZ ARG A 625 18.771 -8.142 9.227 1.00 57.12 C ATOM 409 NH1 ARG A 625 18.359 -8.142 7.965 1.00 58.70 N ATOM 410 NH2 ARG A 625 18.220 -8.980 10.095 1.00 59.08 N ATOM 411 HE ARG A 625 20.017 -7.355 10.628 1.00 0.00 H ATOM 412 HH12 ARG A 625 17.608 -8.795 7.663 1.00 0.00 H ATOM 413 HH11 ARG A 625 18.787 -7.489 7.278 1.00 0.00 H ATOM 414 HH22 ARG A 625 17.470 -9.630 9.786 1.00 0.00 H ATOM 415 HH21 ARG A 625 18.538 -8.987 11.085 1.00 0.00 H ATOM 416 H ARG A 625 21.868 -1.775 7.337 1.00 0.00 H ATOM 417 N LEU A 626 19.037 -1.754 10.433 1.00 29.63 N ATOM 418 CA LEU A 626 19.015 -1.438 11.867 1.00 30.45 C ATOM 419 C LEU A 626 19.391 -2.668 12.698 1.00 31.19 C ATOM 420 O LEU A 626 18.831 -3.751 12.497 1.00 32.34 O ATOM 421 CB LEU A 626 17.657 -0.869 12.305 1.00 30.65 C ATOM 422 CG LEU A 626 17.202 0.490 11.758 1.00 30.04 C ATOM 423 CD1 LEU A 626 15.932 0.939 12.466 1.00 29.90 C ATOM 424 CD2 LEU A 626 18.294 1.568 11.883 1.00 29.90 C ATOM 425 H LEU A 626 18.166 -1.664 9.872 1.00 0.00 H ATOM 426 N PRO A 627 20.357 -2.513 13.624 1.00 31.80 N ATOM 427 CA PRO A 627 20.837 -3.641 14.429 1.00 33.89 C ATOM 428 C PRO A 627 19.830 -4.142 15.472 1.00 35.53 C ATOM 429 O PRO A 627 18.918 -3.403 15.848 1.00 35.70 O ATOM 430 CB PRO A 627 22.074 -3.062 15.130 1.00 33.61 C ATOM 431 CG PRO A 627 21.816 -1.606 15.193 1.00 30.18 C ATOM 432 CD PRO A 627 21.113 -1.276 13.908 1.00 30.64 C ATOM 433 N ASN A 628 20.003 -5.388 15.913 1.00 37.76 N ATOM 434 CA ASN A 628 19.223 -5.976 17.014 1.00 40.96 C ATOM 435 C ASN A 628 19.811 -5.590 18.377 1.00 39.71 C ATOM 436 O ASN A 628 20.023 -6.437 19.255 1.00 43.13 O ATOM 437 CB ASN A 628 19.140 -7.508 16.866 1.00 44.17 C ATOM 438 CG ASN A 628 18.191 -8.157 17.878 1.00 51.75 C ATOM 439 OD1 ASN A 628 17.184 -7.568 18.279 1.00 58.41 O ATOM 440 ND2 ASN A 628 18.513 -9.382 18.289 1.00 56.67 N ATOM 441 HD22 ASN A 628 19.371 -9.843 17.926 1.00 0.00 H ATOM 442 HD21 ASN A 628 17.906 -9.877 18.973 1.00 0.00 H ATOM 443 H ASN A 628 20.728 -5.976 15.455 1.00 0.00 H ATOM 444 N ARG A 629 20.079 -4.301 18.540 1.00 36.17 N ATOM 445 CA ARG A 629 20.690 -3.763 19.748 1.00 34.25 C ATOM 446 C ARG A 629 20.058 -2.398 19.952 1.00 29.86 C ATOM 447 O ARG A 629 20.304 -1.500 19.162 1.00 27.15 O ATOM 448 CB ARG A 629 22.191 -3.548 19.524 1.00 34.08 C ATOM 449 CG ARG A 629 23.080 -4.768 19.602 1.00 38.40 C ATOM 450 CD ARG A 629 24.546 -4.343 19.474 1.00 39.89 C ATOM 451 NE ARG A 629 24.917 -3.428 20.550 1.00 41.60 N ATOM 452 CZ ARG A 629 25.891 -2.524 20.494 1.00 37.25 C ATOM 453 NH1 ARG A 629 26.640 -2.383 19.406 1.00 34.22 N ATOM 454 NH2 ARG A 629 26.112 -1.749 21.544 1.00 39.94 N ATOM 455 HE ARG A 629 24.374 -3.488 21.435 1.00 0.00 H ATOM 456 HH12 ARG A 629 27.396 -1.669 19.384 1.00 0.00 H ATOM 457 HH11 ARG A 629 26.470 -2.986 18.576 1.00 0.00 H ATOM 458 HH22 ARG A 629 26.870 -1.038 21.515 1.00 0.00 H ATOM 459 HH21 ARG A 629 25.528 -1.851 22.398 1.00 0.00 H ATOM 460 H ARG A 629 19.842 -3.644 17.769 1.00 0.00 H ATOM 461 N GLU A 630 19.269 -2.228 21.011 1.00 29.55 N ATOM 462 CA GLU A 630 18.522 -0.971 21.178 1.00 27.60 C ATOM 463 C GLU A 630 19.419 0.264 21.358 1.00 25.44 C ATOM 464 O GLU A 630 19.042 1.355 20.958 1.00 23.03 O ATOM 465 CB GLU A 630 17.502 -1.075 22.321 1.00 28.18 C ATOM 466 CG GLU A 630 18.104 -1.223 23.705 1.00 28.93 C ATOM 467 CD GLU A 630 17.061 -1.358 24.795 1.00 30.13 C ATOM 468 OE1 GLU A 630 17.431 -1.763 25.913 1.00 34.32 O ATOM 469 OE2 GLU A 630 15.868 -1.069 24.539 1.00 32.50 O ATOM 470 H GLU A 630 19.181 -2.984 21.720 1.00 0.00 H ATOM 471 N LEU A 631 20.591 0.090 21.969 1.00 25.89 N ATOM 472 CA LEU A 631 21.488 1.234 22.189 1.00 25.25 C ATOM 473 C LEU A 631 22.181 1.654 20.903 1.00 24.82 C ATOM 474 O LEU A 631 22.354 2.859 20.633 1.00 23.67 O ATOM 475 CB LEU A 631 22.492 0.946 23.312 1.00 24.80 C ATOM 476 CG LEU A 631 21.878 0.597 24.673 1.00 27.56 C ATOM 477 CD1 LEU A 631 22.959 0.270 25.704 1.00 27.68 C ATOM 478 CD2 LEU A 631 20.944 1.705 25.193 1.00 27.71 C ATOM 479 H LEU A 631 20.872 -0.858 22.291 1.00 0.00 H ATOM 480 N ALA A 632 22.543 0.667 20.086 1.00 25.74 N ATOM 481 CA ALA A 632 23.063 0.948 18.746 1.00 25.32 C ATOM 482 C ALA A 632 22.003 1.598 17.845 1.00 24.75 C ATOM 483 O ALA A 632 22.317 2.522 17.088 1.00 22.75 O ATOM 484 CB ALA A 632 23.632 -0.322 18.108 1.00 27.13 C ATOM 485 H ALA A 632 22.455 -0.319 20.404 1.00 0.00 H ATOM 486 N ARG A 633 20.750 1.139 17.943 1.00 25.56 N ATOM 487 CA ARG A 633 19.648 1.758 17.190 1.00 25.13 C ATOM 488 C ARG A 633 19.417 3.198 17.627 1.00 24.53 C ATOM 489 O ARG A 633 19.184 4.076 16.793 1.00 23.12 O ATOM 490 CB ARG A 633 18.340 0.979 17.347 1.00 27.10 C ATOM 491 CG ARG A 633 18.265 -0.306 16.558 1.00 31.29 C ATOM 492 CD ARG A 633 16.812 -0.797 16.412 1.00 31.21 C ATOM 493 NE ARG A 633 16.131 -1.001 17.695 1.00 33.68 N ATOM 494 CZ ARG A 633 16.177 -2.115 18.426 1.00 37.01 C ATOM 495 NH1 ARG A 633 16.894 -3.168 18.036 1.00 39.36 N ATOM 496 NH2 ARG A 633 15.504 -2.175 19.568 1.00 37.99 N ATOM 497 HE ARG A 633 15.565 -0.211 18.065 1.00 0.00 H ATOM 498 HH12 ARG A 633 16.916 -4.027 18.621 1.00 0.00 H ATOM 499 HH11 ARG A 633 17.431 -3.131 17.146 1.00 0.00 H ATOM 500 HH22 ARG A 633 15.534 -3.040 20.145 1.00 0.00 H ATOM 501 HH21 ARG A 633 14.946 -1.357 19.887 1.00 0.00 H ATOM 502 H ARG A 633 20.551 0.329 18.564 1.00 0.00 H ATOM 503 N GLU A 634 19.474 3.426 18.939 1.00 25.06 N ATOM 504 CA GLU A 634 19.346 4.770 19.506 1.00 25.00 C ATOM 505 C GLU A 634 20.358 5.712 18.861 1.00 24.05 C ATOM 506 O GLU A 634 20.020 6.846 18.498 1.00 23.33 O ATOM 507 CB GLU A 634 19.526 4.730 21.031 1.00 25.74 C ATOM 508 CG GLU A 634 19.222 6.053 21.748 1.00 26.92 C ATOM 509 CD GLU A 634 20.437 6.976 21.884 1.00 30.15 C ATOM 510 OE1 GLU A 634 20.232 8.182 22.148 1.00 28.82 O ATOM 511 OE2 GLU A 634 21.589 6.507 21.732 1.00 27.48 O ATOM 512 H GLU A 634 19.614 2.621 19.583 1.00 0.00 H ATOM 513 N LYS A 635 21.589 5.228 18.707 1.00 23.62 N ATOM 514 CA LYS A 635 22.665 6.011 18.101 1.00 23.12 C ATOM 515 C LYS A 635 22.379 6.296 16.632 1.00 22.47 C ATOM 516 O LYS A 635 22.515 7.442 16.184 1.00 20.82 O ATOM 517 CB LYS A 635 24.014 5.298 18.280 1.00 23.58 C ATOM 518 CG LYS A 635 25.211 5.997 17.629 1.00 23.12 C ATOM 519 CD LYS A 635 26.522 5.347 18.071 1.00 24.89 C ATOM 520 CE LYS A 635 27.733 6.076 17.468 1.00 25.14 C ATOM 521 NZ LYS A 635 29.020 5.503 17.984 1.00 27.06 N ATOM 522 HZ1 LYS A 635 29.052 5.603 19.019 1.00 0.00 H ATOM 523 HZ2 LYS A 635 29.076 4.496 17.730 1.00 0.00 H ATOM 524 HZ3 LYS A 635 29.820 6.014 17.560 1.00 0.00 H ATOM 525 H LYS A 635 21.792 4.260 19.029 1.00 0.00 H ATOM 526 N VAL A 636 21.970 5.267 15.888 1.00 21.89 N ATOM 527 CA VAL A 636 21.652 5.430 14.457 1.00 22.28 C ATOM 528 C VAL A 636 20.578 6.498 14.229 1.00 21.79 C ATOM 529 O VAL A 636 20.744 7.383 13.383 1.00 21.43 O ATOM 530 CB VAL A 636 21.243 4.095 13.767 1.00 21.45 C ATOM 531 CG1 VAL A 636 20.682 4.359 12.371 1.00 21.71 C ATOM 532 CG2 VAL A 636 22.435 3.141 13.678 1.00 22.74 C ATOM 533 H VAL A 636 21.873 4.329 16.327 1.00 0.00 H ATOM 534 N MET A 637 19.488 6.425 14.989 1.00 23.47 N ATOM 535 CA MET A 637 18.391 7.385 14.835 1.00 23.60 C ATOM 536 C MET A 637 18.811 8.809 15.219 1.00 23.39 C ATOM 537 O MET A 637 18.403 9.781 14.568 1.00 23.17 O ATOM 538 CB MET A 637 17.146 6.946 15.618 1.00 24.92 C ATOM 539 CG MET A 637 16.596 5.558 15.234 1.00 28.90 C ATOM 540 SD MET A 637 16.374 5.258 13.460 1.00 32.94 S ATOM 541 CE MET A 637 14.965 6.300 13.084 1.00 36.88 C ATOM 542 H MET A 637 19.413 5.674 15.704 1.00 0.00 H ATOM 543 N ARG A 638 19.616 8.934 16.271 1.00 22.78 N ATOM 544 CA ARG A 638 20.199 10.227 16.635 1.00 22.60 C ATOM 545 C ARG A 638 21.096 10.795 15.545 1.00 22.12 C ATOM 546 O ARG A 638 21.022 11.992 15.238 1.00 22.50 O ATOM 547 CB ARG A 638 21.012 10.128 17.922 1.00 24.12 C ATOM 548 CG ARG A 638 20.289 10.557 19.168 1.00 28.55 C ATOM 549 CD ARG A 638 21.301 10.815 20.292 1.00 29.09 C ATOM 550 NE ARG A 638 22.077 9.618 20.607 1.00 28.25 N ATOM 551 CZ ARG A 638 23.337 9.391 20.242 1.00 28.37 C ATOM 552 NH1 ARG A 638 24.024 10.281 19.532 1.00 25.43 N ATOM 553 NH2 ARG A 638 23.919 8.254 20.604 1.00 26.90 N ATOM 554 HE ARG A 638 21.604 8.879 21.165 1.00 0.00 H ATOM 555 HH12 ARG A 638 25.007 10.081 19.259 1.00 0.00 H ATOM 556 HH11 ARG A 638 23.578 11.177 19.250 1.00 0.00 H ATOM 557 HH22 ARG A 638 24.903 8.062 20.327 1.00 0.00 H ATOM 558 HH21 ARG A 638 23.391 7.555 21.165 1.00 0.00 H ATOM 559 H ARG A 638 19.836 8.096 16.847 1.00 0.00 H ATOM 560 N GLU A 639 21.954 9.946 14.976 1.00 21.23 N ATOM 561 CA GLU A 639 22.910 10.396 13.958 1.00 21.84 C ATOM 562 C GLU A 639 22.226 10.910 12.689 1.00 21.50 C ATOM 563 O GLU A 639 22.667 11.907 12.097 1.00 20.01 O ATOM 564 CB GLU A 639 23.924 9.297 13.627 1.00 21.55 C ATOM 565 CG GLU A 639 24.984 9.076 14.722 1.00 27.41 C ATOM 566 CD GLU A 639 26.009 10.207 14.824 1.00 34.39 C ATOM 567 OE1 GLU A 639 26.631 10.357 15.896 1.00 39.98 O ATOM 568 OE2 GLU A 639 26.204 10.949 13.841 1.00 32.35 O ATOM 569 H GLU A 639 21.945 8.946 15.260 1.00 0.00 H ATOM 570 N VAL A 640 21.153 10.243 12.267 1.00 21.16 N ATOM 571 CA VAL A 640 20.445 10.704 11.068 1.00 21.12 C ATOM 572 C VAL A 640 19.796 12.077 11.306 1.00 19.93 C ATOM 573 O VAL A 640 19.886 12.958 10.448 1.00 19.55 O ATOM 574 CB VAL A 640 19.476 9.639 10.459 1.00 21.67 C ATOM 575 CG1 VAL A 640 18.268 9.388 11.342 1.00 24.61 C ATOM 576 CG2 VAL A 640 19.035 10.064 9.052 1.00 23.58 C ATOM 577 H VAL A 640 20.820 9.403 12.783 1.00 0.00 H ATOM 578 N LYS A 641 19.194 12.264 12.481 1.00 20.65 N ATOM 579 CA LYS A 641 18.610 13.561 12.855 1.00 20.60 C ATOM 580 C LYS A 641 19.671 14.666 12.909 1.00 21.26 C ATOM 581 O LYS A 641 19.424 15.797 12.470 1.00 21.95 O ATOM 582 CB LYS A 641 17.873 13.463 14.193 1.00 20.77 C ATOM 583 CG LYS A 641 16.603 12.620 14.147 1.00 23.96 C ATOM 584 CD LYS A 641 15.885 12.669 15.491 1.00 28.25 C ATOM 585 CE LYS A 641 14.569 11.907 15.457 1.00 34.89 C ATOM 586 NZ LYS A 641 14.725 10.466 15.797 1.00 37.51 N ATOM 587 HZ1 LYS A 641 15.369 10.018 15.114 1.00 0.00 H ATOM 588 HZ2 LYS A 641 15.118 10.378 16.756 1.00 0.00 H ATOM 589 HZ3 LYS A 641 13.796 9.999 15.757 1.00 0.00 H ATOM 590 H LYS A 641 19.136 11.471 13.151 1.00 0.00 H ATOM 591 N ALA A 642 20.850 14.335 13.440 1.00 20.50 N ATOM 592 CA ALA A 642 21.963 15.282 13.494 1.00 21.67 C ATOM 593 C ALA A 642 22.474 15.658 12.099 1.00 20.21 C ATOM 594 O ALA A 642 22.663 16.843 11.801 1.00 20.88 O ATOM 595 CB ALA A 642 23.105 14.729 14.352 1.00 21.85 C ATOM 596 H ALA A 642 20.981 13.378 13.826 1.00 0.00 H ATOM 597 N LEU A 643 22.705 14.663 11.249 1.00 19.48 N ATOM 598 CA LEU A 643 23.247 14.954 9.916 1.00 20.27 C ATOM 599 C LEU A 643 22.254 15.771 9.072 1.00 19.48 C ATOM 600 O LEU A 643 22.661 16.593 8.251 1.00 19.44 O ATOM 601 CB LEU A 643 23.711 13.679 9.205 1.00 21.47 C ATOM 602 CG LEU A 643 22.757 12.704 8.535 1.00 25.24 C ATOM 603 CD1 LEU A 643 22.637 13.045 7.054 1.00 28.45 C ATOM 604 CD2 LEU A 643 23.296 11.290 8.703 1.00 25.41 C ATOM 605 H LEU A 643 22.503 13.682 11.527 1.00 0.00 H ATOM 606 N ALA A 644 20.960 15.573 9.314 1.00 19.34 N ATOM 607 CA ALA A 644 19.915 16.286 8.558 1.00 20.07 C ATOM 608 C ALA A 644 19.927 17.807 8.773 1.00 21.18 C ATOM 609 O ALA A 644 19.440 18.557 7.915 1.00 22.13 O ATOM 610 CB ALA A 644 18.528 15.703 8.870 1.00 19.54 C ATOM 611 H ALA A 644 20.680 14.899 10.055 1.00 0.00 H ATOM 612 N LYS A 645 20.494 18.253 9.900 1.00 21.05 N ATOM 613 CA LYS A 645 20.572 19.677 10.250 1.00 22.91 C ATOM 614 C LYS A 645 21.784 20.371 9.623 1.00 23.09 C ATOM 615 O LYS A 645 21.879 21.599 9.634 1.00 24.62 O ATOM 616 CB LYS A 645 20.640 19.851 11.772 1.00 23.62 C ATOM 617 CG LYS A 645 19.456 19.276 12.539 1.00 26.09 C ATOM 618 CD LYS A 645 19.688 19.335 14.043 1.00 28.87 C ATOM 619 CE LYS A 645 19.877 20.765 14.529 1.00 33.37 C ATOM 620 NZ LYS A 645 20.033 20.835 16.012 1.00 35.20 N ATOM 621 HZ1 LYS A 645 19.183 20.446 16.468 1.00 0.00 H ATOM 622 HZ2 LYS A 645 20.865 20.281 16.298 1.00 0.00 H ATOM 623 HZ3 LYS A 645 20.159 21.826 16.300 1.00 0.00 H ATOM 624 H LYS A 645 20.899 17.558 10.559 1.00 0.00 H ATOM 625 N LEU A 646 22.718 19.581 9.095 1.00 21.73 N ATOM 626 CA LEU A 646 24.009 20.127 8.633 1.00 21.18 C ATOM 627 C LEU A 646 23.996 20.676 7.218 1.00 20.89 C ATOM 628 O LEU A 646 23.553 20.004 6.284 1.00 21.50 O ATOM 629 CB LEU A 646 25.126 19.075 8.757 1.00 22.32 C ATOM 630 CG LEU A 646 25.357 18.434 10.125 1.00 21.83 C ATOM 631 CD1 LEU A 646 26.512 17.443 10.041 1.00 26.39 C ATOM 632 CD2 LEU A 646 25.614 19.487 11.217 1.00 25.47 C ATOM 633 H LEU A 646 22.534 18.561 9.007 1.00 0.00 H ATOM 634 N GLU A 647 24.514 21.891 7.075 1.00 20.47 N ATOM 635 CA GLU A 647 24.676 22.528 5.774 1.00 20.65 C ATOM 636 C GLU A 647 25.983 23.319 5.740 1.00 19.97 C ATOM 637 O GLU A 647 26.137 24.308 6.454 1.00 21.42 O ATOM 638 CB GLU A 647 23.485 23.448 5.470 1.00 22.19 C ATOM 639 CG GLU A 647 23.509 24.013 4.052 1.00 23.93 C ATOM 640 CD GLU A 647 22.283 24.849 3.709 1.00 28.80 C ATOM 641 OE1 GLU A 647 21.240 24.739 4.397 1.00 32.03 O ATOM 642 OE2 GLU A 647 22.369 25.610 2.734 1.00 32.76 O ATOM 643 H GLU A 647 24.816 22.408 7.925 1.00 0.00 H ATOM 644 N HIS A 648 26.927 22.860 4.917 1.00 19.91 N ATOM 645 CA HIS A 648 28.229 23.515 4.769 1.00 20.94 C ATOM 646 C HIS A 648 28.852 23.052 3.454 1.00 20.48 C ATOM 647 O HIS A 648 28.688 21.889 3.083 1.00 19.55 O ATOM 648 CB HIS A 648 29.147 23.162 5.949 1.00 21.00 C ATOM 649 CG HIS A 648 30.449 23.903 5.950 1.00 22.68 C ATOM 650 ND1 HIS A 648 31.558 23.458 5.263 1.00 25.01 N ATOM 651 CD2 HIS A 648 30.818 25.061 6.549 1.00 23.66 C ATOM 652 CE1 HIS A 648 32.554 24.309 5.437 1.00 24.90 C ATOM 653 NE2 HIS A 648 32.133 25.288 6.219 1.00 26.25 N ATOM 654 H HIS A 648 26.731 22.004 4.359 1.00 0.00 H ATOM 655 N PRO A 649 29.569 23.953 2.750 1.00 22.95 N ATOM 656 CA PRO A 649 30.172 23.597 1.456 1.00 23.94 C ATOM 657 C PRO A 649 31.051 22.332 1.490 1.00 24.06 C ATOM 658 O PRO A 649 31.122 21.614 0.490 1.00 23.99 O ATOM 659 CB PRO A 649 31.023 24.818 1.121 1.00 26.52 C ATOM 660 CG PRO A 649 30.349 25.947 1.808 1.00 28.94 C ATOM 661 CD PRO A 649 29.775 25.381 3.071 1.00 23.19 C ATOM 662 N GLY A 650 31.701 22.073 2.624 1.00 23.72 N ATOM 663 CA GLY A 650 32.597 20.918 2.773 1.00 22.62 C ATOM 664 C GLY A 650 31.987 19.701 3.457 1.00 22.19 C ATOM 665 O GLY A 650 32.704 18.768 3.805 1.00 22.19 O ATOM 666 H GLY A 650 31.569 22.712 3.434 1.00 0.00 H ATOM 667 N ILE A 651 30.671 19.717 3.668 1.00 20.57 N ATOM 668 CA ILE A 651 29.968 18.574 4.267 1.00 20.76 C ATOM 669 C ILE A 651 29.021 17.965 3.234 1.00 20.21 C ATOM 670 O ILE A 651 28.280 18.686 2.553 1.00 19.82 O ATOM 671 CB ILE A 651 29.183 18.975 5.562 1.00 19.90 C ATOM 672 CG1 ILE A 651 30.133 19.489 6.661 1.00 22.03 C ATOM 673 CG2 ILE A 651 28.326 17.813 6.083 1.00 20.72 C ATOM 674 CD1 ILE A 651 31.019 18.403 7.325 1.00 22.51 C ATOM 675 H ILE A 651 30.127 20.562 3.401 1.00 0.00 H ATOM 676 N VAL A 652 29.046 16.641 3.116 1.00 20.51 N ATOM 677 CA VAL A 652 28.123 15.913 2.226 1.00 21.07 C ATOM 678 C VAL A 652 26.688 16.445 2.312 1.00 20.41 C ATOM 679 O VAL A 652 26.166 16.680 3.408 1.00 20.34 O ATOM 680 CB VAL A 652 28.147 14.377 2.496 1.00 21.80 C ATOM 681 CG1 VAL A 652 29.457 13.801 2.030 1.00 24.80 C ATOM 682 CG2 VAL A 652 27.963 14.066 3.976 1.00 23.01 C ATOM 683 H VAL A 652 29.740 16.100 3.670 1.00 0.00 H ATOM 684 N ARG A 653 26.077 16.674 1.152 1.00 19.42 N ATOM 685 CA ARG A 653 24.738 17.284 1.091 1.00 18.95 C ATOM 686 C ARG A 653 23.615 16.267 1.284 1.00 17.57 C ATOM 687 O ARG A 653 23.503 15.287 0.539 1.00 17.12 O ATOM 688 CB ARG A 653 24.535 18.040 -0.230 1.00 19.74 C ATOM 689 CG ARG A 653 23.159 18.709 -0.349 1.00 20.28 C ATOM 690 CD ARG A 653 22.968 19.434 -1.685 1.00 23.12 C ATOM 691 NE ARG A 653 21.579 19.888 -1.838 1.00 23.29 N ATOM 692 CZ ARG A 653 21.051 20.350 -2.973 1.00 25.60 C ATOM 693 NH1 ARG A 653 21.793 20.428 -4.080 1.00 24.23 N ATOM 694 NH2 ARG A 653 19.771 20.730 -3.003 1.00 21.11 N ATOM 695 HE ARG A 653 20.963 19.846 -1.001 1.00 0.00 H ATOM 696 HH12 ARG A 653 21.376 20.789 -4.961 1.00 0.00 H ATOM 697 HH11 ARG A 653 22.789 20.128 -4.061 1.00 0.00 H ATOM 698 HH22 ARG A 653 19.356 21.091 -3.886 1.00 0.00 H ATOM 699 HH21 ARG A 653 19.189 20.665 -2.143 1.00 0.00 H ATOM 700 H ARG A 653 26.557 16.416 0.266 1.00 0.00 H ATOM 701 N TYR A 654 22.771 16.541 2.270 1.00 16.61 N ATOM 702 CA TYR A 654 21.638 15.678 2.631 1.00 18.10 C ATOM 703 C TYR A 654 20.364 16.009 1.845 1.00 17.91 C ATOM 704 O TYR A 654 20.047 17.181 1.629 1.00 18.49 O ATOM 705 CB TYR A 654 21.376 15.821 4.135 1.00 17.83 C ATOM 706 CG TYR A 654 20.089 15.200 4.619 1.00 19.09 C ATOM 707 CD1 TYR A 654 19.994 13.823 4.827 1.00 18.56 C ATOM 708 CD2 TYR A 654 18.970 15.990 4.884 1.00 19.39 C ATOM 709 CE1 TYR A 654 18.806 13.241 5.274 1.00 19.90 C ATOM 710 CE2 TYR A 654 17.777 15.420 5.337 1.00 20.68 C ATOM 711 CZ TYR A 654 17.710 14.042 5.527 1.00 19.36 C ATOM 712 OH TYR A 654 16.543 13.469 5.975 1.00 20.55 O ATOM 713 HH TYR A 654 15.815 13.660 5.332 1.00 0.00 H ATOM 714 H TYR A 654 22.919 17.413 2.817 1.00 0.00 H ATOM 715 N PHE A 655 19.629 14.968 1.451 1.00 17.22 N ATOM 716 CA PHE A 655 18.314 15.131 0.829 1.00 17.96 C ATOM 717 C PHE A 655 17.137 14.527 1.599 1.00 18.10 C ATOM 718 O PHE A 655 16.151 15.219 1.818 1.00 19.37 O ATOM 719 CB PHE A 655 18.319 14.595 -0.603 1.00 18.21 C ATOM 720 CG PHE A 655 19.114 15.445 -1.553 1.00 16.36 C ATOM 721 CD1 PHE A 655 20.491 15.265 -1.673 1.00 17.14 C ATOM 722 CD2 PHE A 655 18.490 16.424 -2.317 1.00 18.94 C ATOM 723 CE1 PHE A 655 21.241 16.058 -2.548 1.00 18.91 C ATOM 724 CE2 PHE A 655 19.225 17.228 -3.200 1.00 18.27 C ATOM 725 CZ PHE A 655 20.602 17.042 -3.317 1.00 19.01 C ATOM 726 H PHE A 655 20.003 14.008 1.590 1.00 0.00 H ATOM 727 N ASN A 656 17.226 13.243 1.972 1.00 18.09 N ATOM 728 CA ASN A 656 16.103 12.548 2.620 1.00 18.39 C ATOM 729 C ASN A 656 16.560 11.337 3.420 1.00 18.58 C ATOM 730 O ASN A 656 17.672 10.826 3.234 1.00 18.87 O ATOM 731 CB ASN A 656 15.051 12.081 1.592 1.00 18.36 C ATOM 732 CG ASN A 656 14.429 13.225 0.811 1.00 17.53 C ATOM 733 OD1 ASN A 656 13.595 13.980 1.331 1.00 17.82 O ATOM 734 ND2 ASN A 656 14.827 13.355 -0.453 1.00 16.40 N ATOM 735 HD22 ASN A 656 15.530 12.697 -0.847 1.00 0.00 H ATOM 736 HD21 ASN A 656 14.435 14.114 -1.046 1.00 0.00 H ATOM 737 H ASN A 656 18.111 12.725 1.799 1.00 0.00 H ATOM 738 N ALA A 657 15.699 10.900 4.336 1.00 18.97 N ATOM 739 CA ALA A 657 15.912 9.686 5.108 1.00 19.03 C ATOM 740 C ALA A 657 14.552 9.092 5.396 1.00 20.21 C ATOM 741 O ALA A 657 13.600 9.824 5.675 1.00 21.37 O ATOM 742 CB ALA A 657 16.654 9.980 6.411 1.00 19.80 C ATOM 743 H ALA A 657 14.834 11.452 4.508 1.00 0.00 H ATOM 744 N TRP A 658 14.451 7.767 5.315 1.00 20.50 N ATOM 745 CA TRP A 658 13.182 7.091 5.583 1.00 22.57 C ATOM 746 C TRP A 658 13.395 5.652 6.025 1.00 23.22 C ATOM 747 O TRP A 658 14.486 5.103 5.858 1.00 23.45 O ATOM 748 CB TRP A 658 12.261 7.148 4.354 1.00 23.42 C ATOM 749 CG TRP A 658 12.692 6.294 3.190 1.00 23.20 C ATOM 750 CD1 TRP A 658 12.301 5.007 2.926 1.00 23.66 C ATOM 751 CD2 TRP A 658 13.565 6.676 2.119 1.00 23.17 C ATOM 752 NE1 TRP A 658 12.891 4.562 1.764 1.00 25.03 N ATOM 753 CE2 TRP A 658 13.670 5.566 1.248 1.00 23.55 C ATOM 754 CE3 TRP A 658 14.281 7.847 1.816 1.00 22.76 C ATOM 755 CZ2 TRP A 658 14.458 5.592 0.086 1.00 23.96 C ATOM 756 CZ3 TRP A 658 15.066 7.873 0.659 1.00 21.65 C ATOM 757 CH2 TRP A 658 15.145 6.752 -0.191 1.00 21.50 C ATOM 758 HE1 TRP A 658 12.766 3.618 1.346 1.00 0.00 H ATOM 759 H TRP A 658 15.287 7.204 5.057 1.00 0.00 H ATOM 760 N LEU A 659 12.342 5.050 6.576 1.00 24.72 N ATOM 761 CA LEU A 659 12.396 3.668 7.048 1.00 26.62 C ATOM 762 C LEU A 659 11.544 2.746 6.185 1.00 28.06 C ATOM 763 O LEU A 659 10.458 3.126 5.723 1.00 27.45 O ATOM 764 CB LEU A 659 11.932 3.573 8.505 1.00 27.87 C ATOM 765 CG LEU A 659 12.764 4.278 9.580 1.00 28.78 C ATOM 766 CD1 LEU A 659 11.955 4.394 10.870 1.00 31.94 C ATOM 767 CD2 LEU A 659 14.088 3.561 9.829 1.00 29.72 C ATOM 768 H LEU A 659 11.453 5.581 6.673 1.00 0.00 H ATOM 769 N GLU A 660 12.046 1.533 5.965 1.00 28.71 N ATOM 770 CA GLU A 660 11.270 0.484 5.304 1.00 31.20 C ATOM 771 C GLU A 660 11.333 -0.782 6.141 1.00 33.56 C ATOM 772 O GLU A 660 12.402 -1.156 6.633 1.00 33.02 O ATOM 773 CB GLU A 660 11.774 0.215 3.877 1.00 31.40 C ATOM 774 CG GLU A 660 11.650 1.409 2.938 1.00 29.98 C ATOM 775 CD GLU A 660 11.871 1.076 1.464 1.00 31.70 C ATOM 776 OE1 GLU A 660 11.756 -0.106 1.059 1.00 32.60 O ATOM 777 OE2 GLU A 660 12.148 2.021 0.699 1.00 29.20 O ATOM 778 H GLU A 660 13.018 1.325 6.272 1.00 0.00 H ATOM 779 N ALA A 661 10.179 -1.419 6.319 1.00 36.53 N ATOM 780 CA ALA A 661 10.075 -2.656 7.086 1.00 40.54 C ATOM 781 C ALA A 661 9.369 -3.724 6.254 1.00 44.02 C ATOM 782 O ALA A 661 8.172 -3.969 6.440 1.00 45.93 O ATOM 783 CB ALA A 661 9.334 -2.412 8.396 1.00 41.38 C ATOM 784 H ALA A 661 9.317 -1.020 5.895 1.00 0.00 H ATOM 785 N PRO A 662 10.107 -4.360 5.322 1.00 45.55 N ATOM 786 CA PRO A 662 9.505 -5.360 4.443 1.00 49.15 C ATOM 787 C PRO A 662 9.164 -6.645 5.203 1.00 52.96 C ATOM 788 O PRO A 662 9.968 -7.101 6.022 1.00 53.37 O ATOM 789 CB PRO A 662 10.599 -5.623 3.392 1.00 48.28 C ATOM 790 CG PRO A 662 11.685 -4.613 3.656 1.00 45.62 C ATOM 791 CD PRO A 662 11.555 -4.232 5.086 1.00 43.99 C ATOM 792 N PRO A 663 7.967 -7.215 4.952 1.00 56.72 N ATOM 793 CA PRO A 663 7.525 -8.451 5.607 1.00 59.88 C ATOM 794 C PRO A 663 8.447 -9.632 5.312 1.00 61.73 C ATOM 795 O PRO A 663 8.443 -10.617 6.054 1.00 64.91 O ATOM 796 CB PRO A 663 6.137 -8.698 4.998 1.00 62.60 C ATOM 797 CG PRO A 663 6.108 -7.890 3.740 1.00 60.92 C ATOM 798 CD PRO A 663 6.933 -6.683 4.048 1.00 57.25 C TER 799 PRO A 663 ATOM 800 N LYS A 881 13.256 -7.412 9.707 1.00 44.35 N ATOM 801 CA LYS A 881 14.327 -6.490 9.349 1.00 41.45 C ATOM 802 C LYS A 881 13.777 -5.102 9.033 1.00 38.64 C ATOM 803 O LYS A 881 12.791 -4.971 8.306 1.00 38.60 O ATOM 804 CB LYS A 881 15.115 -7.028 8.150 1.00 42.94 C ATOM 805 HN3 LYS A 881 12.589 -7.491 8.913 1.00 0.00 H ATOM 806 HN2 LYS A 881 12.757 -7.053 10.546 1.00 0.00 H ATOM 807 HN1 LYS A 881 13.661 -8.347 9.916 1.00 0.00 H ATOM 808 N VAL A 882 14.414 -4.077 9.596 1.00 35.20 N ATOM 809 CA VAL A 882 14.078 -2.684 9.301 1.00 32.72 C ATOM 810 C VAL A 882 15.297 -2.006 8.676 1.00 29.98 C ATOM 811 O VAL A 882 16.420 -2.147 9.168 1.00 28.87 O ATOM 812 CB VAL A 882 13.628 -1.900 10.569 1.00 32.23 C ATOM 813 CG1 VAL A 882 13.241 -0.456 10.216 1.00 32.20 C ATOM 814 CG2 VAL A 882 12.472 -2.606 11.265 1.00 36.40 C ATOM 815 H VAL A 882 15.180 -4.274 10.271 1.00 0.00 H ATOM 816 N TYR A 883 15.065 -1.283 7.586 1.00 28.42 N ATOM 817 CA TYR A 883 16.124 -0.552 6.900 1.00 27.25 C ATOM 818 C TYR A 883 15.928 0.952 7.039 1.00 26.26 C ATOM 819 O TYR A 883 14.808 1.449 6.903 1.00 26.29 O ATOM 820 CB TYR A 883 16.152 -0.924 5.410 1.00 28.28 C ATOM 821 CG TYR A 883 16.544 -2.362 5.135 1.00 32.09 C ATOM 822 CD1 TYR A 883 17.860 -2.794 5.320 1.00 32.46 C ATOM 823 CD2 TYR A 883 15.606 -3.286 4.682 1.00 38.34 C ATOM 824 CE1 TYR A 883 18.228 -4.113 5.068 1.00 38.48 C ATOM 825 CE2 TYR A 883 15.963 -4.611 4.429 1.00 43.68 C ATOM 826 CZ TYR A 883 17.277 -5.015 4.622 1.00 43.78 C ATOM 827 OH TYR A 883 17.642 -6.323 4.374 1.00 47.91 O ATOM 828 HH TYR A 883 18.607 -6.436 4.562 1.00 0.00 H ATOM 829 H TYR A 883 14.097 -1.237 7.210 1.00 0.00 H ATOM 830 N LEU A 884 17.018 1.666 7.318 1.00 24.17 N ATOM 831 CA LEU A 884 17.027 3.126 7.217 1.00 23.94 C ATOM 832 C LEU A 884 17.764 3.505 5.944 1.00 23.67 C ATOM 833 O LEU A 884 18.941 3.161 5.772 1.00 24.72 O ATOM 834 CB LEU A 884 17.706 3.778 8.431 1.00 24.25 C ATOM 835 CG LEU A 884 17.994 5.291 8.346 1.00 24.62 C ATOM 836 CD1 LEU A 884 16.707 6.102 8.337 1.00 26.44 C ATOM 837 CD2 LEU A 884 18.907 5.745 9.501 1.00 27.48 C ATOM 838 H LEU A 884 17.884 1.173 7.615 1.00 0.00 H ATOM 839 N TYR A 885 17.059 4.190 5.049 1.00 22.44 N ATOM 840 CA TYR A 885 17.651 4.722 3.830 1.00 21.27 C ATOM 841 C TYR A 885 18.043 6.175 4.042 1.00 20.39 C ATOM 842 O TYR A 885 17.273 6.945 4.617 1.00 20.88 O ATOM 843 CB TYR A 885 16.650 4.650 2.679 1.00 20.96 C ATOM 844 CG TYR A 885 16.408 3.259 2.138 1.00 23.41 C ATOM 845 CD1 TYR A 885 17.088 2.811 1.008 1.00 24.90 C ATOM 846 CD2 TYR A 885 15.495 2.399 2.747 1.00 25.19 C ATOM 847 CE1 TYR A 885 16.870 1.534 0.494 1.00 26.08 C ATOM 848 CE2 TYR A 885 15.265 1.111 2.240 1.00 25.98 C ATOM 849 CZ TYR A 885 15.961 0.692 1.112 1.00 27.58 C ATOM 850 OH TYR A 885 15.747 -0.567 0.593 1.00 29.64 O ATOM 851 HH TYR A 885 16.321 -0.697 -0.203 1.00 0.00 H ATOM 852 H TYR A 885 16.047 4.352 5.226 1.00 0.00 H ATOM 853 N ILE A 886 19.240 6.540 3.580 1.00 19.64 N ATOM 854 CA ILE A 886 19.712 7.929 3.643 1.00 18.85 C ATOM 855 C ILE A 886 20.188 8.350 2.252 1.00 18.89 C ATOM 856 O ILE A 886 21.102 7.738 1.685 1.00 20.07 O ATOM 857 CB ILE A 886 20.847 8.121 4.684 1.00 18.49 C ATOM 858 CG1 ILE A 886 20.421 7.589 6.067 1.00 18.81 C ATOM 859 CG2 ILE A 886 21.265 9.612 4.762 1.00 20.19 C ATOM 860 CD1 ILE A 886 21.531 7.651 7.138 1.00 20.97 C ATOM 861 H ILE A 886 19.859 5.817 3.161 1.00 0.00 H ATOM 862 N GLN A 887 19.556 9.395 1.720 1.00 18.33 N ATOM 863 CA GLN A 887 19.801 9.879 0.358 1.00 17.88 C ATOM 864 C GLN A 887 20.629 11.163 0.376 1.00 18.31 C ATOM 865 O GLN A 887 20.227 12.162 0.984 1.00 17.38 O ATOM 866 CB GLN A 887 18.451 10.136 -0.321 1.00 18.64 C ATOM 867 CG GLN A 887 18.494 10.727 -1.743 1.00 17.89 C ATOM 868 CD GLN A 887 17.111 11.213 -2.172 1.00 19.35 C ATOM 869 OE1 GLN A 887 16.098 10.837 -1.570 1.00 21.33 O ATOM 870 NE2 GLN A 887 17.061 12.047 -3.204 1.00 20.19 N ATOM 871 HE22 GLN A 887 17.938 12.337 -3.681 1.00 0.00 H ATOM 872 HE21 GLN A 887 16.144 12.410 -3.535 1.00 0.00 H ATOM 873 H GLN A 887 18.852 9.893 2.301 1.00 0.00 H ATOM 874 N MET A 888 21.780 11.123 -0.296 1.00 18.55 N ATOM 875 CA MET A 888 22.724 12.245 -0.320 1.00 18.36 C ATOM 876 C MET A 888 23.124 12.581 -1.749 1.00 18.51 C ATOM 877 O MET A 888 22.875 11.809 -2.677 1.00 18.22 O ATOM 878 CB MET A 888 23.996 11.889 0.457 1.00 17.43 C ATOM 879 CG MET A 888 23.758 11.273 1.829 1.00 19.57 C ATOM 880 SD MET A 888 23.082 12.411 3.045 1.00 21.16 S ATOM 881 CE MET A 888 24.527 13.412 3.377 1.00 18.19 C ATOM 882 H MET A 888 22.018 10.260 -0.825 1.00 0.00 H ATOM 883 N GLN A 889 23.777 13.726 -1.916 1.00 18.31 N ATOM 884 CA GLN A 889 24.374 14.089 -3.192 1.00 19.11 C ATOM 885 C GLN A 889 25.432 13.063 -3.605 1.00 19.73 C ATOM 886 O GLN A 889 26.231 12.604 -2.768 1.00 20.55 O ATOM 887 CB GLN A 889 25.010 15.471 -3.072 1.00 20.21 C ATOM 888 CG GLN A 889 25.520 16.042 -4.376 1.00 25.08 C ATOM 889 CD GLN A 889 25.955 17.477 -4.205 1.00 29.31 C ATOM 890 OE1 GLN A 889 26.876 17.763 -3.441 1.00 27.17 O ATOM 891 NE2 GLN A 889 25.277 18.393 -4.896 1.00 32.29 N ATOM 892 HE22 GLN A 889 24.506 18.101 -5.530 1.00 0.00 H ATOM 893 HE21 GLN A 889 25.519 19.400 -4.802 1.00 0.00 H ATOM 894 H GLN A 889 23.864 14.381 -1.113 1.00 0.00 H ATOM 895 N LEU A 890 25.419 12.702 -4.886 1.00 26.37 N ATOM 896 CA LEU A 890 26.385 11.759 -5.444 1.00 26.12 C ATOM 897 C LEU A 890 27.729 12.440 -5.685 1.00 24.86 C ATOM 898 O LEU A 890 27.792 13.440 -6.400 1.00 26.05 O ATOM 899 CB LEU A 890 25.846 11.164 -6.755 1.00 27.45 C ATOM 900 CG LEU A 890 26.701 10.133 -7.508 1.00 28.93 C ATOM 901 CD1 LEU A 890 26.858 8.854 -6.676 1.00 29.20 C ATOM 902 CD2 LEU A 890 26.083 9.820 -8.866 1.00 27.55 C ATOM 903 H LEU A 890 24.694 13.106 -5.513 1.00 0.00 H ATOM 904 N CYS A 891 28.785 11.884 -5.092 1.00 21.48 N ATOM 905 CA CYS A 891 30.164 12.344 -5.298 1.00 22.13 C ATOM 906 C CYS A 891 30.871 11.473 -6.331 1.00 22.21 C ATOM 907 O CYS A 891 30.338 10.447 -6.752 1.00 22.58 O ATOM 908 CB CYS A 891 30.950 12.304 -3.983 1.00 21.83 C ATOM 909 SG CYS A 891 30.368 13.464 -2.692 1.00 25.70 S ATOM 910 H CYS A 891 28.624 11.082 -4.450 1.00 0.00 H ATOM 911 N ARG A 892 32.070 11.895 -6.738 1.00 21.43 N ATOM 912 CA ARG A 892 32.896 11.128 -7.679 1.00 23.34 C ATOM 913 C ARG A 892 33.307 9.788 -7.067 1.00 22.73 C ATOM 914 O ARG A 892 33.412 9.669 -5.844 1.00 22.53 O ATOM 915 CB ARG A 892 34.144 11.935 -8.077 1.00 22.67 C ATOM 916 CG ARG A 892 33.826 13.263 -8.783 1.00 26.32 C ATOM 917 CD ARG A 892 35.088 13.914 -9.379 1.00 29.73 C ATOM 918 NE ARG A 892 35.562 13.164 -10.539 1.00 36.56 N ATOM 919 CZ ARG A 892 35.049 13.255 -11.765 1.00 39.98 C ATOM 920 NH1 ARG A 892 34.035 14.079 -12.019 1.00 42.46 N ATOM 921 NH2 ARG A 892 35.557 12.519 -12.746 1.00 42.22 N ATOM 922 HE ARG A 892 36.359 12.511 -10.397 1.00 0.00 H ATOM 923 HH12 ARG A 892 33.643 14.141 -12.981 1.00 0.00 H ATOM 924 HH11 ARG A 892 33.634 14.661 -11.256 1.00 0.00 H ATOM 925 HH22 ARG A 892 35.161 12.586 -13.705 1.00 0.00 H ATOM 926 HH21 ARG A 892 36.351 11.875 -12.555 1.00 0.00 H ATOM 927 H ARG A 892 32.432 12.800 -6.376 1.00 0.00 H ATOM 928 N LYS A 893 33.539 8.786 -7.919 1.00 25.46 N ATOM 929 CA LYS A 893 33.947 7.452 -7.458 1.00 26.31 C ATOM 930 C LYS A 893 35.285 7.463 -6.706 1.00 26.85 C ATOM 931 O LYS A 893 35.449 6.747 -5.707 1.00 27.81 O ATOM 932 CB LYS A 893 34.003 6.466 -8.631 1.00 29.01 C ATOM 933 H LYS A 893 33.428 8.955 -8.939 1.00 0.00 H ATOM 934 N GLU A 894 36.231 8.279 -7.173 1.00 26.06 N ATOM 935 CA GLU A 894 37.562 8.364 -6.545 1.00 25.85 C ATOM 936 C GLU A 894 37.619 9.354 -5.378 1.00 24.24 C ATOM 937 O GLU A 894 37.469 10.568 -5.568 1.00 24.07 O ATOM 938 CB GLU A 894 38.651 8.687 -7.588 1.00 27.53 C ATOM 939 CG GLU A 894 38.984 7.505 -8.507 1.00 31.96 C ATOM 940 CD GLU A 894 40.125 7.788 -9.485 1.00 37.50 C ATOM 941 OE1 GLU A 894 40.926 8.727 -9.253 1.00 37.27 O ATOM 942 OE2 GLU A 894 40.217 7.055 -10.491 1.00 39.20 O ATOM 943 H GLU A 894 36.024 8.871 -8.002 1.00 0.00 H ATOM 944 N ASN A 895 37.827 8.825 -4.172 1.00 21.89 N ATOM 945 CA ASN A 895 37.946 9.648 -2.964 1.00 21.96 C ATOM 946 C ASN A 895 39.373 10.163 -2.753 1.00 21.11 C ATOM 947 O ASN A 895 40.212 10.017 -3.645 1.00 22.52 O ATOM 948 CB ASN A 895 37.430 8.891 -1.728 1.00 21.81 C ATOM 949 CG ASN A 895 38.243 7.639 -1.406 1.00 22.17 C ATOM 950 OD1 ASN A 895 39.408 7.508 -1.804 1.00 22.10 O ATOM 951 ND2 ASN A 895 37.620 6.702 -0.686 1.00 22.88 N ATOM 952 HD22 ASN A 895 36.640 6.853 -0.372 1.00 0.00 H ATOM 953 HD21 ASN A 895 38.115 5.821 -0.439 1.00 0.00 H ATOM 954 H ASN A 895 37.908 7.792 -4.085 1.00 0.00 H ATOM 955 N LEU A 896 39.645 10.762 -1.587 1.00 19.96 N ATOM 956 CA LEU A 896 40.969 11.348 -1.316 1.00 19.24 C ATOM 957 C LEU A 896 42.090 10.305 -1.278 1.00 19.98 C ATOM 958 O LEU A 896 43.192 10.566 -1.782 1.00 20.26 O ATOM 959 CB LEU A 896 40.977 12.184 -0.024 1.00 18.73 C ATOM 960 CG LEU A 896 42.268 12.972 0.252 1.00 20.08 C ATOM 961 CD1 LEU A 896 42.525 14.045 -0.835 1.00 20.65 C ATOM 962 CD2 LEU A 896 42.223 13.607 1.631 1.00 22.35 C ATOM 963 H LEU A 896 38.906 10.815 -0.857 1.00 0.00 H ATOM 964 N LYS A 897 41.806 9.144 -0.681 1.00 19.34 N ATOM 965 CA LYS A 897 42.726 8.004 -0.713 1.00 20.33 C ATOM 966 C LYS A 897 43.099 7.639 -2.152 1.00 21.38 C ATOM 967 O LYS A 897 44.288 7.465 -2.467 1.00 21.87 O ATOM 968 CB LYS A 897 42.119 6.785 0.004 1.00 21.40 C ATOM 969 CG LYS A 897 43.033 5.556 0.029 1.00 23.63 C ATOM 970 CD LYS A 897 42.360 4.373 0.736 1.00 31.05 C ATOM 971 CE LYS A 897 43.272 3.144 0.785 1.00 38.05 C ATOM 972 NZ LYS A 897 44.290 3.253 1.879 1.00 40.21 N ATOM 973 HZ1 LYS A 897 44.881 4.094 1.719 1.00 0.00 H ATOM 974 HZ2 LYS A 897 43.805 3.338 2.795 1.00 0.00 H ATOM 975 HZ3 LYS A 897 44.888 2.402 1.880 1.00 0.00 H ATOM 976 H LYS A 897 40.902 9.046 -0.177 1.00 0.00 H ATOM 977 N ASP A 898 42.088 7.518 -3.017 1.00 20.58 N ATOM 978 CA ASP A 898 42.311 7.187 -4.429 1.00 22.60 C ATOM 979 C ASP A 898 43.101 8.292 -5.136 1.00 20.94 C ATOM 980 O ASP A 898 44.009 8.008 -5.925 1.00 22.42 O ATOM 981 CB ASP A 898 40.980 6.955 -5.174 1.00 22.46 C ATOM 982 CG ASP A 898 40.143 5.819 -4.578 1.00 28.33 C ATOM 983 OD1 ASP A 898 40.717 4.780 -4.175 1.00 26.51 O ATOM 984 OD2 ASP A 898 38.894 5.967 -4.531 1.00 27.44 O ATOM 985 H ASP A 898 41.115 7.663 -2.680 1.00 0.00 H ATOM 986 N TRP A 899 42.741 9.545 -4.853 1.00 20.48 N ATOM 987 CA TRP A 899 43.371 10.709 -5.473 1.00 21.62 C ATOM 988 C TRP A 899 44.869 10.738 -5.163 1.00 22.04 C ATOM 989 O TRP A 899 45.698 10.978 -6.052 1.00 21.85 O ATOM 990 CB TRP A 899 42.678 11.994 -4.997 1.00 21.09 C ATOM 991 CG TRP A 899 43.151 13.273 -5.664 1.00 21.99 C ATOM 992 CD1 TRP A 899 42.698 13.806 -6.838 1.00 23.59 C ATOM 993 CD2 TRP A 899 44.144 14.180 -5.168 1.00 20.62 C ATOM 994 NE1 TRP A 899 43.358 14.987 -7.113 1.00 23.10 N ATOM 995 CE2 TRP A 899 44.249 15.240 -6.101 1.00 22.02 C ATOM 996 CE3 TRP A 899 44.968 14.192 -4.031 1.00 21.31 C ATOM 997 CZ2 TRP A 899 45.136 16.309 -5.924 1.00 22.48 C ATOM 998 CZ3 TRP A 899 45.852 15.250 -3.859 1.00 23.87 C ATOM 999 CH2 TRP A 899 45.936 16.289 -4.806 1.00 22.21 C ATOM 1000 HE1 TRP A 899 43.205 15.586 -7.949 1.00 0.00 H ATOM 1001 H TRP A 899 41.980 9.700 -4.162 1.00 0.00 H ATOM 1002 N MET A 900 45.215 10.470 -3.905 1.00 21.14 N ATOM 1003 CA MET A 900 46.622 10.405 -3.505 1.00 21.06 C ATOM 1004 C MET A 900 47.353 9.212 -4.133 1.00 22.53 C ATOM 1005 O MET A 900 48.521 9.324 -4.525 1.00 23.69 O ATOM 1006 CB MET A 900 46.747 10.406 -1.982 1.00 20.70 C ATOM 1007 CG MET A 900 46.451 11.765 -1.384 1.00 20.22 C ATOM 1008 SD MET A 900 46.878 11.900 0.358 1.00 25.30 S ATOM 1009 CE MET A 900 45.735 10.700 1.048 1.00 20.58 C ATOM 1010 H MET A 900 44.473 10.304 -3.195 1.00 0.00 H ATOM 1011 N ASN A 901 46.660 8.082 -4.262 1.00 22.19 N ATOM 1012 CA ASN A 901 47.244 6.908 -4.915 1.00 24.34 C ATOM 1013 C ASN A 901 47.473 7.081 -6.420 1.00 24.91 C ATOM 1014 O ASN A 901 48.219 6.317 -7.027 1.00 27.25 O ATOM 1015 CB ASN A 901 46.408 5.654 -4.638 1.00 25.26 C ATOM 1016 CG ASN A 901 46.616 5.113 -3.233 1.00 26.67 C ATOM 1017 OD1 ASN A 901 47.574 5.475 -2.552 1.00 31.13 O ATOM 1018 ND2 ASN A 901 45.728 4.224 -2.804 1.00 29.10 N ATOM 1019 HD22 ASN A 901 44.933 3.947 -3.414 1.00 0.00 H ATOM 1020 HD21 ASN A 901 45.828 3.805 -1.858 1.00 0.00 H ATOM 1021 H ASN A 901 45.689 8.032 -3.893 1.00 0.00 H ATOM 1022 N GLY A 902 46.838 8.090 -7.012 1.00 24.46 N ATOM 1023 CA GLY A 902 47.033 8.397 -8.430 1.00 24.42 C ATOM 1024 C GLY A 902 47.982 9.565 -8.651 1.00 25.27 C ATOM 1025 O GLY A 902 48.172 10.021 -9.786 1.00 25.67 O ATOM 1026 H GLY A 902 46.186 8.676 -6.452 1.00 0.00 H ATOM 1027 N ARG A 903 48.561 10.060 -7.558 1.00 23.31 N ATOM 1028 CA ARG A 903 49.534 11.150 -7.595 1.00 23.25 C ATOM 1029 C ARG A 903 50.741 10.772 -6.734 1.00 23.89 C ATOM 1030 O ARG A 903 50.888 11.248 -5.611 1.00 22.70 O ATOM 1031 CB ARG A 903 48.888 12.459 -7.107 1.00 21.80 C ATOM 1032 CG ARG A 903 47.971 13.105 -8.141 1.00 21.97 C ATOM 1033 CD ARG A 903 47.229 14.294 -7.565 1.00 21.81 C ATOM 1034 NE ARG A 903 46.426 15.009 -8.567 1.00 21.20 N ATOM 1035 CZ ARG A 903 46.653 16.260 -8.967 1.00 22.89 C ATOM 1036 NH1 ARG A 903 47.677 16.955 -8.472 1.00 22.13 N ATOM 1037 NH2 ARG A 903 45.849 16.824 -9.864 1.00 23.08 N ATOM 1038 HE ARG A 903 45.624 14.503 -8.994 1.00 0.00 H ATOM 1039 HH12 ARG A 903 47.846 17.931 -8.791 1.00 0.00 H ATOM 1040 HH11 ARG A 903 48.307 16.522 -7.767 1.00 0.00 H ATOM 1041 HH22 ARG A 903 46.024 17.800 -10.178 1.00 0.00 H ATOM 1042 HH21 ARG A 903 45.046 16.289 -10.251 1.00 0.00 H ATOM 1043 H ARG A 903 48.309 9.652 -6.635 1.00 0.00 H ATOM 1044 N CYS A 904 51.604 9.916 -7.277 1.00 25.13 N ATOM 1045 CA CYS A 904 52.692 9.325 -6.492 1.00 25.72 C ATOM 1046 C CYS A 904 54.057 10.003 -6.672 1.00 26.43 C ATOM 1047 O CYS A 904 55.091 9.429 -6.318 1.00 26.51 O ATOM 1048 CB CYS A 904 52.790 7.824 -6.790 1.00 27.04 C ATOM 1049 SG CYS A 904 51.255 6.939 -6.403 1.00 26.88 S ATOM 1050 H CYS A 904 51.504 9.661 -8.280 1.00 0.00 H ATOM 1051 N THR A 905 54.064 11.214 -7.228 1.00 26.78 N ATOM 1052 CA THR A 905 55.311 11.984 -7.362 1.00 27.77 C ATOM 1053 C THR A 905 55.161 13.369 -6.738 1.00 26.82 C ATOM 1054 O THR A 905 54.051 13.896 -6.635 1.00 24.99 O ATOM 1055 CB THR A 905 55.756 12.152 -8.838 1.00 30.09 C ATOM 1056 OG1 THR A 905 54.763 12.896 -9.554 1.00 29.26 O ATOM 1057 CG2 THR A 905 55.979 10.798 -9.514 1.00 30.51 C ATOM 1058 HG1 THR A 905 53.901 12.410 -9.522 1.00 0.00 H ATOM 1059 H THR A 905 53.172 11.622 -7.573 1.00 0.00 H ATOM 1060 N ILE A 906 56.285 13.956 -6.338 1.00 28.72 N ATOM 1061 CA ILE A 906 56.293 15.287 -5.722 1.00 29.30 C ATOM 1062 C ILE A 906 55.686 16.364 -6.637 1.00 28.14 C ATOM 1063 O ILE A 906 55.001 17.267 -6.156 1.00 27.65 O ATOM 1064 CB ILE A 906 57.724 15.687 -5.220 1.00 31.18 C ATOM 1065 CG1 ILE A 906 57.683 16.970 -4.383 1.00 35.35 C ATOM 1066 CG2 ILE A 906 58.714 15.810 -6.371 1.00 34.60 C ATOM 1067 CD1 ILE A 906 57.180 16.766 -2.963 1.00 39.79 C ATOM 1068 H ILE A 906 57.187 13.455 -6.466 1.00 0.00 H ATOM 1069 N GLU A 907 55.917 16.238 -7.945 1.00 29.19 N ATOM 1070 CA GLU A 907 55.374 17.168 -8.944 1.00 29.68 C ATOM 1071 C GLU A 907 53.842 17.159 -8.936 1.00 28.15 C ATOM 1072 O GLU A 907 53.193 18.170 -9.240 1.00 27.64 O ATOM 1073 CB GLU A 907 55.896 16.814 -10.344 1.00 31.27 C ATOM 1074 CG GLU A 907 57.394 17.077 -10.580 1.00 36.43 C ATOM 1075 CD GLU A 907 58.325 15.985 -10.032 1.00 41.00 C ATOM 1076 OE1 GLU A 907 59.558 16.187 -10.100 1.00 47.13 O ATOM 1077 OE2 GLU A 907 57.847 14.936 -9.536 1.00 36.66 O ATOM 1078 H GLU A 907 56.507 15.447 -8.272 1.00 0.00 H ATOM 1079 N GLU A 908 53.276 16.015 -8.563 1.00 25.29 N ATOM 1080 CA GLU A 908 51.827 15.826 -8.510 1.00 24.56 C ATOM 1081 C GLU A 908 51.220 16.197 -7.157 1.00 23.28 C ATOM 1082 O GLU A 908 50.022 16.029 -6.941 1.00 22.25 O ATOM 1083 CB GLU A 908 51.485 14.383 -8.872 1.00 23.93 C ATOM 1084 CG GLU A 908 51.775 14.061 -10.327 1.00 25.20 C ATOM 1085 CD GLU A 908 51.602 12.592 -10.635 1.00 31.17 C ATOM 1086 OE1 GLU A 908 52.346 11.775 -10.056 1.00 29.50 O ATOM 1087 OE2 GLU A 908 50.732 12.263 -11.464 1.00 33.33 O ATOM 1088 H GLU A 908 53.891 15.220 -8.297 1.00 0.00 H ATOM 1089 N ARG A 909 52.056 16.707 -6.257 1.00 24.05 N ATOM 1090 CA ARG A 909 51.600 17.189 -4.953 1.00 23.41 C ATOM 1091 C ARG A 909 52.115 18.609 -4.737 1.00 24.22 C ATOM 1092 O ARG A 909 52.769 18.900 -3.728 1.00 24.98 O ATOM 1093 CB ARG A 909 52.099 16.273 -3.827 1.00 24.06 C ATOM 1094 CG ARG A 909 51.691 14.801 -3.947 1.00 22.10 C ATOM 1095 CD ARG A 909 50.178 14.562 -3.800 1.00 21.66 C ATOM 1096 NE ARG A 909 49.968 13.119 -3.698 1.00 22.36 N ATOM 1097 CZ ARG A 909 50.042 12.425 -2.566 1.00 22.19 C ATOM 1098 NH1 ARG A 909 50.246 13.041 -1.404 1.00 20.75 N ATOM 1099 NH2 ARG A 909 49.902 11.107 -2.602 1.00 21.81 N ATOM 1100 HE ARG A 909 49.745 12.599 -4.571 1.00 0.00 H ATOM 1101 HH12 ARG A 909 50.302 12.488 -0.525 1.00 0.00 H ATOM 1102 HH11 ARG A 909 50.349 14.075 -1.375 1.00 0.00 H ATOM 1103 HH22 ARG A 909 49.958 10.554 -1.723 1.00 0.00 H ATOM 1104 HH21 ARG A 909 49.736 10.626 -3.509 1.00 0.00 H ATOM 1105 H ARG A 909 53.068 16.765 -6.488 1.00 0.00 H ATOM 1106 N GLU A 910 51.827 19.495 -5.685 1.00 23.99 N ATOM 1107 CA GLU A 910 52.294 20.874 -5.569 1.00 26.14 C ATOM 1108 C GLU A 910 51.703 21.489 -4.301 1.00 24.63 C ATOM 1109 O GLU A 910 50.521 21.308 -4.005 1.00 22.99 O ATOM 1110 CB GLU A 910 51.957 21.697 -6.818 1.00 26.88 C ATOM 1111 CG GLU A 910 52.655 23.069 -6.876 1.00 36.05 C ATOM 1112 CD GLU A 910 51.867 24.165 -6.158 1.00 39.63 C ATOM 1113 OE1 GLU A 910 50.624 24.168 -6.279 1.00 43.30 O ATOM 1114 OE2 GLU A 910 52.482 25.028 -5.485 1.00 40.75 O ATOM 1115 H GLU A 910 51.267 19.205 -6.512 1.00 0.00 H ATOM 1116 N ARG A 911 52.548 22.203 -3.561 1.00 25.32 N ATOM 1117 CA ARG A 911 52.204 22.723 -2.240 1.00 25.21 C ATOM 1118 C ARG A 911 50.845 23.427 -2.187 1.00 24.35 C ATOM 1119 O ARG A 911 50.024 23.117 -1.331 1.00 23.38 O ATOM 1120 CB ARG A 911 53.314 23.661 -1.747 1.00 26.90 C ATOM 1121 CG ARG A 911 53.110 24.186 -0.329 1.00 29.49 C ATOM 1122 CD ARG A 911 54.160 25.237 0.026 1.00 34.14 C ATOM 1123 NE ARG A 911 53.946 25.763 1.374 1.00 37.66 N ATOM 1124 CZ ARG A 911 54.323 26.968 1.793 1.00 41.96 C ATOM 1125 NH1 ARG A 911 54.942 27.810 0.973 1.00 44.95 N ATOM 1126 NH2 ARG A 911 54.072 27.337 3.043 1.00 44.07 N ATOM 1127 HE ARG A 911 53.462 25.147 2.058 1.00 0.00 H ATOM 1128 HH12 ARG A 911 55.231 28.749 1.313 1.00 0.00 H ATOM 1129 HH11 ARG A 911 55.137 27.530 -0.009 1.00 0.00 H ATOM 1130 HH22 ARG A 911 54.364 28.278 3.376 1.00 0.00 H ATOM 1131 HH21 ARG A 911 53.583 26.685 3.689 1.00 0.00 H ATOM 1132 H ARG A 911 53.496 22.400 -3.940 1.00 0.00 H ATOM 1133 N SER A 912 50.609 24.371 -3.094 1.00 25.58 N ATOM 1134 CA SER A 912 49.358 25.146 -3.055 1.00 25.74 C ATOM 1135 C SER A 912 48.107 24.302 -3.298 1.00 24.95 C ATOM 1136 O SER A 912 47.076 24.526 -2.663 1.00 23.85 O ATOM 1137 CB SER A 912 49.416 26.322 -4.020 1.00 27.07 C ATOM 1138 OG SER A 912 50.358 27.270 -3.559 1.00 29.93 O ATOM 1139 HG SER A 912 50.392 28.033 -4.189 1.00 0.00 H ATOM 1140 H SER A 912 51.313 24.563 -3.835 1.00 0.00 H ATOM 1141 N VAL A 913 48.198 23.340 -4.213 1.00 24.14 N ATOM 1142 CA VAL A 913 47.102 22.391 -4.442 1.00 24.53 C ATOM 1143 C VAL A 913 46.786 21.588 -3.176 1.00 23.35 C ATOM 1144 O VAL A 913 45.621 21.462 -2.778 1.00 21.98 O ATOM 1145 CB VAL A 913 47.430 21.415 -5.605 1.00 24.93 C ATOM 1146 CG1 VAL A 913 46.303 20.397 -5.791 1.00 26.22 C ATOM 1147 CG2 VAL A 913 47.673 22.186 -6.889 1.00 26.86 C ATOM 1148 H VAL A 913 49.066 23.259 -4.779 1.00 0.00 H ATOM 1149 N CYS A 914 47.827 21.049 -2.545 1.00 23.46 N ATOM 1150 CA CYS A 914 47.662 20.261 -1.330 1.00 23.49 C ATOM 1151 C CYS A 914 47.072 21.076 -0.187 1.00 22.37 C ATOM 1152 O CYS A 914 46.212 20.587 0.551 1.00 21.24 O ATOM 1153 CB CYS A 914 48.991 19.655 -0.896 1.00 24.15 C ATOM 1154 SG CYS A 914 49.637 18.463 -2.076 1.00 30.78 S ATOM 1155 H CYS A 914 48.783 21.194 -2.929 1.00 0.00 H ATOM 1156 N LEU A 915 47.538 22.316 -0.048 1.00 23.27 N ATOM 1157 CA LEU A 915 47.053 23.195 1.015 1.00 23.26 C ATOM 1158 C LEU A 915 45.605 23.615 0.783 1.00 23.40 C ATOM 1159 O LEU A 915 44.848 23.772 1.743 1.00 22.10 O ATOM 1160 CB LEU A 915 47.958 24.423 1.180 1.00 24.20 C ATOM 1161 CG LEU A 915 49.361 24.214 1.772 1.00 24.58 C ATOM 1162 CD1 LEU A 915 50.130 25.538 1.804 1.00 26.15 C ATOM 1163 CD2 LEU A 915 49.314 23.578 3.170 1.00 27.50 C ATOM 1164 H LEU A 915 48.261 22.666 -0.709 1.00 0.00 H ATOM 1165 N HIS A 916 45.235 23.795 -0.487 1.00 22.92 N ATOM 1166 CA HIS A 916 43.855 24.108 -0.879 1.00 22.19 C ATOM 1167 C HIS A 916 42.899 22.970 -0.503 1.00 21.90 C ATOM 1168 O HIS A 916 41.812 23.210 0.047 1.00 20.17 O ATOM 1169 CB HIS A 916 43.807 24.415 -2.386 1.00 24.22 C ATOM 1170 CG HIS A 916 42.429 24.625 -2.940 1.00 24.18 C ATOM 1171 ND1 HIS A 916 41.612 25.665 -2.546 1.00 25.19 N ATOM 1172 CD2 HIS A 916 41.745 23.953 -3.897 1.00 23.97 C ATOM 1173 CE1 HIS A 916 40.476 25.609 -3.218 1.00 26.13 C ATOM 1174 NE2 HIS A 916 40.535 24.586 -4.052 1.00 24.91 N ATOM 1175 H HIS A 916 45.956 23.710 -1.232 1.00 0.00 H ATOM 1176 N ILE A 917 43.309 21.736 -0.787 1.00 20.22 N ATOM 1177 CA ILE A 917 42.518 20.572 -0.399 1.00 19.95 C ATOM 1178 C ILE A 917 42.448 20.469 1.125 1.00 19.69 C ATOM 1179 O ILE A 917 41.355 20.300 1.697 1.00 19.11 O ATOM 1180 CB ILE A 917 43.055 19.274 -1.039 1.00 20.09 C ATOM 1181 CG1 ILE A 917 42.750 19.284 -2.543 1.00 19.25 C ATOM 1182 CG2 ILE A 917 42.439 18.029 -0.366 1.00 19.32 C ATOM 1183 CD1 ILE A 917 43.615 18.331 -3.366 1.00 20.91 C ATOM 1184 H ILE A 917 44.207 21.599 -1.293 1.00 0.00 H ATOM 1185 N PHE A 918 43.597 20.590 1.785 1.00 20.44 N ATOM 1186 CA PHE A 918 43.617 20.494 3.251 1.00 20.94 C ATOM 1187 C PHE A 918 42.765 21.573 3.918 1.00 20.48 C ATOM 1188 O PHE A 918 42.031 21.293 4.873 1.00 20.58 O ATOM 1189 CB PHE A 918 45.037 20.537 3.822 1.00 21.38 C ATOM 1190 CG PHE A 918 45.063 20.493 5.327 1.00 20.91 C ATOM 1191 CD1 PHE A 918 44.908 19.285 6.002 1.00 22.23 C ATOM 1192 CD2 PHE A 918 45.185 21.666 6.067 1.00 22.55 C ATOM 1193 CE1 PHE A 918 44.894 19.242 7.400 1.00 21.67 C ATOM 1194 CE2 PHE A 918 45.180 21.635 7.470 1.00 23.83 C ATOM 1195 CZ PHE A 918 45.039 20.418 8.134 1.00 21.61 C ATOM 1196 H PHE A 918 44.482 20.753 1.263 1.00 0.00 H ATOM 1197 N LEU A 919 42.876 22.808 3.434 1.00 20.37 N ATOM 1198 CA LEU A 919 42.093 23.909 3.999 1.00 20.83 C ATOM 1199 C LEU A 919 40.597 23.583 3.995 1.00 20.78 C ATOM 1200 O LEU A 919 39.900 23.841 4.981 1.00 21.12 O ATOM 1201 CB LEU A 919 42.361 25.218 3.248 1.00 22.23 C ATOM 1202 CG LEU A 919 41.590 26.458 3.715 1.00 23.78 C ATOM 1203 CD1 LEU A 919 41.882 26.784 5.182 1.00 24.92 C ATOM 1204 CD2 LEU A 919 41.895 27.653 2.817 1.00 23.73 C ATOM 1205 H LEU A 919 43.527 22.993 2.645 1.00 0.00 H ATOM 1206 N GLN A 920 40.113 23.016 2.889 1.00 19.92 N ATOM 1207 CA GLN A 920 38.698 22.645 2.779 1.00 20.00 C ATOM 1208 C GLN A 920 38.303 21.594 3.821 1.00 19.21 C ATOM 1209 O GLN A 920 37.219 21.680 4.406 1.00 19.96 O ATOM 1210 CB GLN A 920 38.379 22.126 1.380 1.00 19.06 C ATOM 1211 CG GLN A 920 38.372 23.178 0.295 1.00 20.64 C ATOM 1212 CD GLN A 920 38.211 22.553 -1.076 1.00 24.07 C ATOM 1213 OE1 GLN A 920 37.110 22.137 -1.461 1.00 21.10 O ATOM 1214 NE2 GLN A 920 39.315 22.462 -1.816 1.00 22.15 N ATOM 1215 HE22 GLN A 920 40.218 22.826 -1.450 1.00 0.00 H ATOM 1216 HE21 GLN A 920 39.274 22.027 -2.760 1.00 0.00 H ATOM 1217 H GLN A 920 40.751 22.833 2.089 1.00 0.00 H ATOM 1218 N ILE A 921 39.174 20.612 4.044 1.00 18.91 N ATOM 1219 CA ILE A 921 38.940 19.592 5.084 1.00 18.29 C ATOM 1220 C ILE A 921 38.902 20.250 6.469 1.00 19.84 C ATOM 1221 O ILE A 921 37.982 20.005 7.261 1.00 18.95 O ATOM 1222 CB ILE A 921 40.012 18.475 5.072 1.00 18.01 C ATOM 1223 CG1 ILE A 921 40.119 17.821 3.684 1.00 18.25 C ATOM 1224 CG2 ILE A 921 39.688 17.405 6.125 1.00 18.56 C ATOM 1225 CD1 ILE A 921 41.395 16.976 3.487 1.00 19.67 C ATOM 1226 H ILE A 921 40.041 20.563 3.471 1.00 0.00 H ATOM 1227 N ALA A 922 39.901 21.085 6.757 1.00 19.77 N ATOM 1228 CA ALA A 922 39.969 21.788 8.045 1.00 20.73 C ATOM 1229 C ALA A 922 38.756 22.698 8.275 1.00 21.47 C ATOM 1230 O ALA A 922 38.273 22.812 9.400 1.00 22.59 O ATOM 1231 CB ALA A 922 41.267 22.576 8.161 1.00 21.83 C ATOM 1232 H ALA A 922 40.650 21.242 6.053 1.00 0.00 H ATOM 1233 N GLU A 923 38.272 23.337 7.210 1.00 21.54 N ATOM 1234 CA GLU A 923 37.090 24.201 7.302 1.00 22.77 C ATOM 1235 C GLU A 923 35.818 23.404 7.618 1.00 22.09 C ATOM 1236 O GLU A 923 34.969 23.865 8.393 1.00 22.57 O ATOM 1237 CB GLU A 923 36.919 25.023 6.024 1.00 23.98 C ATOM 1238 CG GLU A 923 37.908 26.191 5.907 1.00 26.44 C ATOM 1239 CD GLU A 923 37.877 26.871 4.540 1.00 30.08 C ATOM 1240 OE1 GLU A 923 37.633 26.190 3.518 1.00 32.72 O ATOM 1241 OE2 GLU A 923 38.121 28.090 4.488 1.00 34.05 O ATOM 1242 H GLU A 923 38.744 23.220 6.291 1.00 0.00 H ATOM 1243 N ALA A 924 35.693 22.216 7.024 1.00 20.63 N ATOM 1244 CA ALA A 924 34.578 21.311 7.347 1.00 20.89 C ATOM 1245 C ALA A 924 34.631 20.879 8.820 1.00 21.01 C ATOM 1246 O ALA A 924 33.604 20.815 9.496 1.00 21.27 O ATOM 1247 CB ALA A 924 34.589 20.085 6.427 1.00 21.18 C ATOM 1248 H ALA A 924 36.398 21.923 6.318 1.00 0.00 H ATOM 1249 N VAL A 925 35.836 20.586 9.303 1.00 20.39 N ATOM 1250 CA VAL A 925 36.039 20.201 10.705 1.00 20.32 C ATOM 1251 C VAL A 925 35.711 21.365 11.642 1.00 21.12 C ATOM 1252 O VAL A 925 35.014 21.179 12.649 1.00 21.41 O ATOM 1253 CB VAL A 925 37.473 19.656 10.953 1.00 20.15 C ATOM 1254 CG1 VAL A 925 37.726 19.441 12.444 1.00 22.49 C ATOM 1255 CG2 VAL A 925 37.671 18.349 10.196 1.00 19.75 C ATOM 1256 H VAL A 925 36.659 20.631 8.668 1.00 0.00 H ATOM 1257 N GLU A 926 36.182 22.568 11.299 1.00 21.34 N ATOM 1258 CA GLU A 926 35.859 23.766 12.091 1.00 22.31 C ATOM 1259 C GLU A 926 34.347 23.975 12.176 1.00 23.08 C ATOM 1260 O GLU A 926 33.820 24.338 13.231 1.00 22.68 O ATOM 1261 CB GLU A 926 36.541 25.016 11.513 1.00 23.63 C ATOM 1262 CG GLU A 926 36.575 26.227 12.471 1.00 26.35 C ATOM 1263 CD GLU A 926 35.295 27.041 12.470 1.00 32.56 C ATOM 1264 OE1 GLU A 926 34.640 27.139 11.406 1.00 32.61 O ATOM 1265 OE2 GLU A 926 34.948 27.593 13.538 1.00 33.11 O ATOM 1266 H GLU A 926 36.787 22.659 10.458 1.00 0.00 H ATOM 1267 N PHE A 927 33.656 23.750 11.061 1.00 22.43 N ATOM 1268 CA PHE A 927 32.202 23.866 11.040 1.00 23.38 C ATOM 1269 C PHE A 927 31.562 22.901 12.055 1.00 23.34 C ATOM 1270 O PHE A 927 30.731 23.307 12.871 1.00 24.81 O ATOM 1271 CB PHE A 927 31.671 23.615 9.623 1.00 23.65 C ATOM 1272 CG PHE A 927 30.191 23.361 9.569 1.00 24.06 C ATOM 1273 CD1 PHE A 927 29.292 24.417 9.628 1.00 26.41 C ATOM 1274 CD2 PHE A 927 29.699 22.056 9.471 1.00 25.37 C ATOM 1275 CE1 PHE A 927 27.915 24.192 9.588 1.00 28.28 C ATOM 1276 CE2 PHE A 927 28.324 21.817 9.431 1.00 25.55 C ATOM 1277 CZ PHE A 927 27.432 22.889 9.486 1.00 29.58 C ATOM 1278 H PHE A 927 34.161 23.487 10.191 1.00 0.00 H ATOM 1279 N LEU A 928 31.954 21.630 12.006 1.00 22.67 N ATOM 1280 CA LEU A 928 31.435 20.638 12.964 1.00 23.21 C ATOM 1281 C LEU A 928 31.692 21.059 14.408 1.00 24.32 C ATOM 1282 O LEU A 928 30.781 21.040 15.243 1.00 24.32 O ATOM 1283 CB LEU A 928 32.035 19.251 12.704 1.00 21.38 C ATOM 1284 CG LEU A 928 31.661 18.558 11.390 1.00 22.44 C ATOM 1285 CD1 LEU A 928 32.437 17.268 11.224 1.00 21.60 C ATOM 1286 CD2 LEU A 928 30.155 18.298 11.324 1.00 22.66 C ATOM 1287 H LEU A 928 32.637 21.332 11.280 1.00 0.00 H ATOM 1288 N HIS A 929 32.930 21.456 14.695 1.00 23.87 N ATOM 1289 CA HIS A 929 33.303 21.869 16.051 1.00 25.66 C ATOM 1290 C HIS A 929 32.526 23.106 16.512 1.00 27.30 C ATOM 1291 O HIS A 929 32.154 23.203 17.684 1.00 28.07 O ATOM 1292 CB HIS A 929 34.819 22.079 16.152 1.00 25.21 C ATOM 1293 CG HIS A 929 35.617 20.820 15.986 1.00 23.90 C ATOM 1294 ND1 HIS A 929 36.985 20.779 16.146 1.00 23.41 N ATOM 1295 CD2 HIS A 929 35.236 19.553 15.686 1.00 23.81 C ATOM 1296 CE1 HIS A 929 37.414 19.545 15.943 1.00 22.56 C ATOM 1297 NE2 HIS A 929 36.373 18.782 15.662 1.00 21.42 N ATOM 1298 H HIS A 929 33.647 21.473 13.942 1.00 0.00 H ATOM 1299 N SER A 930 32.256 24.034 15.592 1.00 27.32 N ATOM 1300 CA SER A 930 31.475 25.231 15.927 1.00 30.46 C ATOM 1301 C SER A 930 30.020 24.890 16.282 1.00 31.55 C ATOM 1302 O SER A 930 29.349 25.665 16.963 1.00 33.08 O ATOM 1303 CB SER A 930 31.522 26.266 14.795 1.00 30.82 C ATOM 1304 OG SER A 930 30.709 25.875 13.699 1.00 30.32 O ATOM 1305 HG SER A 930 31.029 25.008 13.345 1.00 0.00 H ATOM 1306 H SER A 930 32.605 23.907 14.621 1.00 0.00 H ATOM 1307 N LYS A 931 29.549 23.733 15.817 1.00 31.17 N ATOM 1308 CA LYS A 931 28.206 23.242 16.136 1.00 33.41 C ATOM 1309 C LYS A 931 28.183 22.343 17.373 1.00 33.28 C ATOM 1310 O LYS A 931 27.135 21.796 17.726 1.00 34.84 O ATOM 1311 CB LYS A 931 27.609 22.480 14.944 1.00 32.79 C ATOM 1312 CG LYS A 931 27.425 23.299 13.669 1.00 36.33 C ATOM 1313 CD LYS A 931 26.251 24.256 13.779 1.00 41.74 C ATOM 1314 CE LYS A 931 26.105 25.088 12.522 1.00 44.15 C ATOM 1315 NZ LYS A 931 24.920 25.978 12.596 1.00 48.90 N ATOM 1316 HZ1 LYS A 931 24.062 25.402 12.713 1.00 0.00 H ATOM 1317 HZ2 LYS A 931 25.021 26.620 13.408 1.00 0.00 H ATOM 1318 HZ3 LYS A 931 24.850 26.533 11.719 1.00 0.00 H ATOM 1319 H LYS A 931 30.159 23.156 15.203 1.00 0.00 H ATOM 1320 N GLY A 932 29.333 22.187 18.025 1.00 32.60 N ATOM 1321 CA GLY A 932 29.445 21.305 19.186 1.00 32.47 C ATOM 1322 C GLY A 932 29.403 19.844 18.779 1.00 31.53 C ATOM 1323 O GLY A 932 28.974 18.984 19.553 1.00 32.40 O ATOM 1324 H GLY A 932 30.174 22.706 17.700 1.00 0.00 H ATOM 1325 N LEU A 933 29.842 19.571 17.552 1.00 28.99 N ATOM 1326 CA LEU A 933 29.916 18.215 17.025 1.00 27.70 C ATOM 1327 C LEU A 933 31.373 17.850 16.748 1.00 26.47 C ATOM 1328 O LEU A 933 32.264 18.698 16.807 1.00 26.87 O ATOM 1329 CB LEU A 933 29.079 18.086 15.740 1.00 27.54 C ATOM 1330 CG LEU A 933 27.602 18.509 15.780 1.00 28.48 C ATOM 1331 CD1 LEU A 933 27.004 18.428 14.384 1.00 30.81 C ATOM 1332 CD2 LEU A 933 26.792 17.661 16.769 1.00 29.64 C ATOM 1333 H LEU A 933 30.145 20.359 16.944 1.00 0.00 H ATOM 1334 N MET A 934 31.618 16.577 16.476 1.00 26.09 N ATOM 1335 CA MET A 934 32.937 16.140 16.040 1.00 25.57 C ATOM 1336 C MET A 934 32.788 15.002 15.043 1.00 25.31 C ATOM 1337 O MET A 934 31.719 14.394 14.942 1.00 26.28 O ATOM 1338 CB MET A 934 33.835 15.752 17.223 1.00 27.02 C ATOM 1339 CG MET A 934 33.182 14.913 18.310 1.00 26.27 C ATOM 1340 SD MET A 934 34.370 14.408 19.573 1.00 26.54 S ATOM 1341 CE MET A 934 33.315 14.294 21.004 1.00 31.58 C ATOM 1342 H MET A 934 30.855 15.877 16.576 1.00 0.00 H ATOM 1343 N HIS A 935 33.850 14.734 14.293 1.00 24.09 N ATOM 1344 CA HIS A 935 33.802 13.678 13.296 1.00 22.96 C ATOM 1345 C HIS A 935 34.093 12.315 13.923 1.00 23.29 C ATOM 1346 O HIS A 935 33.283 11.390 13.793 1.00 24.26 O ATOM 1347 CB HIS A 935 34.760 13.957 12.135 1.00 22.16 C ATOM 1348 CG HIS A 935 34.518 13.074 10.954 1.00 22.94 C ATOM 1349 ND1 HIS A 935 34.785 11.721 10.973 1.00 24.53 N ATOM 1350 CD2 HIS A 935 33.997 13.340 9.732 1.00 23.12 C ATOM 1351 CE1 HIS A 935 34.443 11.191 9.811 1.00 23.96 C ATOM 1352 NE2 HIS A 935 33.970 12.154 9.037 1.00 22.45 N ATOM 1353 H HIS A 935 34.723 15.284 14.420 1.00 0.00 H ATOM 1354 N ARG A 936 35.257 12.204 14.572 1.00 22.25 N ATOM 1355 CA ARG A 936 35.708 11.006 15.320 1.00 23.40 C ATOM 1356 C ARG A 936 36.407 9.961 14.450 1.00 23.96 C ATOM 1357 O ARG A 936 37.148 9.120 14.967 1.00 24.89 O ATOM 1358 CB ARG A 936 34.565 10.310 16.081 1.00 24.87 C ATOM 1359 CG ARG A 936 33.853 11.133 17.137 1.00 24.82 C ATOM 1360 CD ARG A 936 32.631 10.364 17.634 1.00 26.48 C ATOM 1361 NE ARG A 936 31.928 11.072 18.703 1.00 28.60 N ATOM 1362 CZ ARG A 936 31.022 12.026 18.501 1.00 28.99 C ATOM 1363 NH1 ARG A 936 30.703 12.404 17.265 1.00 28.40 N ATOM 1364 NH2 ARG A 936 30.439 12.612 19.540 1.00 30.76 N ATOM 1365 HE ARG A 936 32.150 10.813 19.685 1.00 0.00 H ATOM 1366 HH12 ARG A 936 29.994 13.150 17.116 1.00 0.00 H ATOM 1367 HH11 ARG A 936 31.163 11.953 16.448 1.00 0.00 H ATOM 1368 HH22 ARG A 936 29.731 13.358 19.386 1.00 0.00 H ATOM 1369 HH21 ARG A 936 30.691 12.325 20.507 1.00 0.00 H ATOM 1370 H ARG A 936 35.897 13.023 14.550 1.00 0.00 H ATOM 1371 N ASN A 937 36.154 10.001 13.142 1.00 22.44 N ATOM 1372 CA ASN A 937 36.689 8.997 12.222 1.00 24.05 C ATOM 1373 C ASN A 937 37.241 9.610 10.945 1.00 22.61 C ATOM 1374 O ASN A 937 37.059 9.064 9.851 1.00 22.62 O ATOM 1375 CB ASN A 937 35.617 7.949 11.897 1.00 25.27 C ATOM 1376 CG ASN A 937 35.351 7.018 13.061 1.00 28.51 C ATOM 1377 OD1 ASN A 937 36.201 6.199 13.423 1.00 33.06 O ATOM 1378 ND2 ASN A 937 34.173 7.141 13.661 1.00 32.08 N ATOM 1379 HD22 ASN A 937 33.487 7.845 13.321 1.00 0.00 H ATOM 1380 HD21 ASN A 937 33.936 6.533 14.471 1.00 0.00 H ATOM 1381 H ASN A 937 35.560 10.767 12.765 1.00 0.00 H ATOM 1382 N LEU A 938 37.918 10.746 11.086 1.00 20.72 N ATOM 1383 CA LEU A 938 38.435 11.464 9.925 1.00 20.59 C ATOM 1384 C LEU A 938 39.638 10.727 9.341 1.00 20.82 C ATOM 1385 O LEU A 938 40.566 10.352 10.065 1.00 21.60 O ATOM 1386 CB LEU A 938 38.794 12.910 10.293 1.00 20.81 C ATOM 1387 CG LEU A 938 39.042 13.892 9.142 1.00 23.02 C ATOM 1388 CD1 LEU A 938 37.750 14.191 8.360 1.00 22.46 C ATOM 1389 CD2 LEU A 938 39.654 15.178 9.684 1.00 24.14 C ATOM 1390 H LEU A 938 38.082 11.129 12.039 1.00 0.00 H ATOM 1391 N LYS A 939 39.589 10.514 8.027 1.00 20.36 N ATOM 1392 CA LYS A 939 40.608 9.772 7.276 1.00 20.38 C ATOM 1393 C LYS A 939 40.311 9.960 5.787 1.00 20.51 C ATOM 1394 O LYS A 939 39.176 10.304 5.426 1.00 20.06 O ATOM 1395 CB LYS A 939 40.602 8.278 7.652 1.00 21.00 C ATOM 1396 CG LYS A 939 39.266 7.572 7.458 1.00 21.49 C ATOM 1397 CD LYS A 939 39.302 6.138 7.976 1.00 24.59 C ATOM 1398 CE LYS A 939 37.918 5.501 7.898 1.00 29.31 C ATOM 1399 NZ LYS A 939 37.948 4.075 8.316 1.00 31.97 N ATOM 1400 HZ1 LYS A 939 38.590 3.545 7.692 1.00 0.00 H ATOM 1401 HZ2 LYS A 939 38.285 4.010 9.298 1.00 0.00 H ATOM 1402 HZ3 LYS A 939 36.990 3.675 8.250 1.00 0.00 H ATOM 1403 H LYS A 939 38.778 10.897 7.501 1.00 0.00 H ATOM 1404 N PRO A 940 41.312 9.734 4.911 1.00 20.23 N ATOM 1405 CA PRO A 940 41.101 9.957 3.472 1.00 20.41 C ATOM 1406 C PRO A 940 39.947 9.165 2.853 1.00 20.69 C ATOM 1407 O PRO A 940 39.346 9.637 1.888 1.00 20.87 O ATOM 1408 CB PRO A 940 42.440 9.543 2.853 1.00 20.39 C ATOM 1409 CG PRO A 940 43.437 9.845 3.945 1.00 20.53 C ATOM 1410 CD PRO A 940 42.719 9.393 5.198 1.00 21.06 C ATOM 1411 N SER A 941 39.630 7.986 3.392 1.00 19.96 N ATOM 1412 CA SER A 941 38.508 7.192 2.856 1.00 20.97 C ATOM 1413 C SER A 941 37.130 7.759 3.244 1.00 21.26 C ATOM 1414 O SER A 941 36.099 7.257 2.787 1.00 22.02 O ATOM 1415 CB SER A 941 38.635 5.709 3.243 1.00 22.91 C ATOM 1416 OG SER A 941 38.466 5.515 4.638 1.00 23.51 O ATOM 1417 HG SER A 941 38.554 4.552 4.849 1.00 0.00 H ATOM 1418 H SER A 941 40.179 7.624 4.197 1.00 0.00 H ATOM 1419 N ASN A 942 37.127 8.791 4.087 1.00 20.01 N ATOM 1420 CA ASN A 942 35.904 9.525 4.453 1.00 20.01 C ATOM 1421 C ASN A 942 35.863 10.933 3.854 1.00 19.55 C ATOM 1422 O ASN A 942 35.102 11.795 4.299 1.00 18.21 O ATOM 1423 CB ASN A 942 35.742 9.582 5.982 1.00 20.62 C ATOM 1424 CG ASN A 942 34.997 8.378 6.540 1.00 22.54 C ATOM 1425 OD1 ASN A 942 34.205 7.739 5.842 1.00 23.57 O ATOM 1426 ND2 ASN A 942 35.235 8.072 7.818 1.00 20.74 N ATOM 1427 HD22 ASN A 942 35.911 8.637 8.371 1.00 0.00 H ATOM 1428 HD21 ASN A 942 34.745 7.269 8.260 1.00 0.00 H ATOM 1429 H ASN A 942 38.030 9.092 4.506 1.00 0.00 H ATOM 1430 N ILE A 943 36.687 11.156 2.831 1.00 17.95 N ATOM 1431 CA ILE A 943 36.799 12.465 2.196 1.00 18.56 C ATOM 1432 C ILE A 943 36.673 12.250 0.693 1.00 18.95 C ATOM 1433 O ILE A 943 37.515 11.591 0.081 1.00 18.43 O ATOM 1434 CB ILE A 943 38.149 13.165 2.555 1.00 18.83 C ATOM 1435 CG1 ILE A 943 38.279 13.338 4.075 1.00 19.45 C ATOM 1436 CG2 ILE A 943 38.251 14.531 1.851 1.00 17.75 C ATOM 1437 CD1 ILE A 943 39.689 13.735 4.572 1.00 18.30 C ATOM 1438 H ILE A 943 37.269 10.372 2.474 1.00 0.00 H ATOM 1439 N PHE A 944 35.599 12.777 0.115 1.00 18.77 N ATOM 1440 CA PHE A 944 35.294 12.579 -1.298 1.00 19.62 C ATOM 1441 C PHE A 944 35.277 13.934 -2.008 1.00 20.00 C ATOM 1442 O PHE A 944 35.552 14.967 -1.395 1.00 20.50 O ATOM 1443 CB PHE A 944 33.938 11.868 -1.461 1.00 19.43 C ATOM 1444 CG PHE A 944 33.992 10.365 -1.257 1.00 20.45 C ATOM 1445 CD1 PHE A 944 33.622 9.507 -2.285 1.00 20.91 C ATOM 1446 CD2 PHE A 944 34.397 9.815 -0.033 1.00 21.17 C ATOM 1447 CE1 PHE A 944 33.658 8.117 -2.117 1.00 22.13 C ATOM 1448 CE2 PHE A 944 34.434 8.419 0.150 1.00 20.15 C ATOM 1449 CZ PHE A 944 34.061 7.577 -0.896 1.00 21.33 C ATOM 1450 H PHE A 944 34.952 13.352 0.691 1.00 0.00 H ATOM 1451 N PHE A 945 34.964 13.923 -3.299 1.00 20.10 N ATOM 1452 CA PHE A 945 34.899 15.156 -4.088 1.00 20.33 C ATOM 1453 C PHE A 945 33.572 15.206 -4.831 1.00 21.46 C ATOM 1454 O PHE A 945 33.095 14.185 -5.344 1.00 21.61 O ATOM 1455 CB PHE A 945 36.024 15.208 -5.132 1.00 21.27 C ATOM 1456 CG PHE A 945 37.418 15.184 -4.556 1.00 21.42 C ATOM 1457 CD1 PHE A 945 38.095 13.977 -4.388 1.00 22.50 C ATOM 1458 CD2 PHE A 945 38.066 16.369 -4.223 1.00 22.91 C ATOM 1459 CE1 PHE A 945 39.398 13.949 -3.873 1.00 21.64 C ATOM 1460 CE2 PHE A 945 39.369 16.358 -3.708 1.00 20.16 C ATOM 1461 CZ PHE A 945 40.036 15.144 -3.536 1.00 23.25 C ATOM 1462 H PHE A 945 34.760 13.015 -3.762 1.00 0.00 H ATOM 1463 N THR A 946 32.983 16.395 -4.920 1.00 21.21 N ATOM 1464 CA THR A 946 31.861 16.603 -5.835 1.00 21.81 C ATOM 1465 C THR A 946 32.320 16.481 -7.289 1.00 24.11 C ATOM 1466 O THR A 946 33.527 16.428 -7.580 1.00 23.18 O ATOM 1467 CB THR A 946 31.224 17.993 -5.670 1.00 22.75 C ATOM 1468 OG1 THR A 946 32.152 18.994 -6.115 1.00 23.22 O ATOM 1469 CG2 THR A 946 30.832 18.243 -4.213 1.00 21.04 C ATOM 1470 HG1 THR A 946 31.745 19.890 -6.010 1.00 0.00 H ATOM 1471 H THR A 946 33.323 17.184 -4.334 1.00 0.00 H ATOM 1472 N MET A 947 31.352 16.463 -8.200 1.00 25.40 N ATOM 1473 CA MET A 947 31.642 16.400 -9.627 1.00 28.77 C ATOM 1474 C MET A 947 32.568 17.536 -10.076 1.00 29.30 C ATOM 1475 O MET A 947 33.274 17.387 -11.069 1.00 30.93 O ATOM 1476 CB MET A 947 30.353 16.376 -10.458 1.00 30.78 C ATOM 1477 CG MET A 947 29.435 15.195 -10.147 1.00 35.95 C ATOM 1478 SD MET A 947 30.239 13.578 -10.307 1.00 41.20 S ATOM 1479 CE MET A 947 28.935 12.490 -9.724 1.00 43.31 C ATOM 1480 H MET A 947 30.361 16.495 -7.886 1.00 0.00 H ATOM 1481 N ASP A 948 32.571 18.652 -9.340 1.00 28.67 N ATOM 1482 CA ASP A 948 33.428 19.806 -9.623 1.00 29.17 C ATOM 1483 C ASP A 948 34.603 19.942 -8.638 1.00 27.58 C ATOM 1484 O ASP A 948 35.086 21.061 -8.396 1.00 28.08 O ATOM 1485 CB ASP A 948 32.598 21.096 -9.615 1.00 30.71 C ATOM 1486 CG ASP A 948 31.483 21.084 -10.640 1.00 33.45 C ATOM 1487 OD1 ASP A 948 30.368 21.529 -10.306 1.00 36.34 O ATOM 1488 OD2 ASP A 948 31.715 20.624 -11.776 1.00 38.29 O ATOM 1489 H ASP A 948 31.930 18.704 -8.522 1.00 0.00 H ATOM 1490 N ASP A 949 35.039 18.821 -8.058 1.00 24.90 N ATOM 1491 CA ASP A 949 36.222 18.771 -7.180 1.00 23.56 C ATOM 1492 C ASP A 949 36.133 19.526 -5.846 1.00 23.45 C ATOM 1493 O ASP A 949 37.161 19.769 -5.208 1.00 24.09 O ATOM 1494 CB ASP A 949 37.492 19.205 -7.943 1.00 24.86 C ATOM 1495 CG ASP A 949 37.972 18.163 -8.936 1.00 26.75 C ATOM 1496 OD1 ASP A 949 38.758 18.532 -9.835 1.00 28.83 O ATOM 1497 OD2 ASP A 949 37.584 16.977 -8.824 1.00 28.31 O ATOM 1498 H ASP A 949 34.518 17.939 -8.235 1.00 0.00 H ATOM 1499 N VAL A 950 34.928 19.897 -5.418 1.00 22.33 N ATOM 1500 CA VAL A 950 34.751 20.444 -4.066 1.00 22.36 C ATOM 1501 C VAL A 950 34.897 19.298 -3.054 1.00 20.86 C ATOM 1502 O VAL A 950 34.247 18.252 -3.192 1.00 20.28 O ATOM 1503 CB VAL A 950 33.396 21.173 -3.891 1.00 22.93 C ATOM 1504 CG1 VAL A 950 33.205 21.635 -2.442 1.00 22.36 C ATOM 1505 CG2 VAL A 950 33.300 22.379 -4.840 1.00 26.40 C ATOM 1506 H VAL A 950 34.105 19.799 -6.046 1.00 0.00 H ATOM 1507 N VAL A 951 35.763 19.494 -2.060 1.00 19.29 N ATOM 1508 CA VAL A 951 36.012 18.481 -1.029 1.00 19.11 C ATOM 1509 C VAL A 951 34.753 18.298 -0.171 1.00 19.39 C ATOM 1510 O VAL A 951 34.122 19.281 0.231 1.00 19.26 O ATOM 1511 CB VAL A 951 37.227 18.877 -0.137 1.00 18.98 C ATOM 1512 CG1 VAL A 951 37.323 17.989 1.108 1.00 22.01 C ATOM 1513 CG2 VAL A 951 38.532 18.830 -0.940 1.00 21.00 C ATOM 1514 H VAL A 951 36.280 20.395 -2.014 1.00 0.00 H ATOM 1515 N LYS A 952 34.393 17.041 0.090 1.00 17.82 N ATOM 1516 CA LYS A 952 33.230 16.720 0.919 1.00 18.75 C ATOM 1517 C LYS A 952 33.598 15.721 2.010 1.00 19.60 C ATOM 1518 O LYS A 952 34.048 14.610 1.712 1.00 20.16 O ATOM 1519 CB LYS A 952 32.090 16.154 0.066 1.00 19.11 C ATOM 1520 CG LYS A 952 31.404 17.178 -0.826 1.00 21.21 C ATOM 1521 CD LYS A 952 30.658 18.233 -0.010 1.00 19.92 C ATOM 1522 CE LYS A 952 29.684 19.010 -0.888 1.00 22.32 C ATOM 1523 NZ LYS A 952 28.859 19.953 -0.055 1.00 22.69 N ATOM 1524 HZ1 LYS A 952 28.320 19.410 0.650 1.00 0.00 H ATOM 1525 HZ2 LYS A 952 29.487 20.625 0.430 1.00 0.00 H ATOM 1526 HZ3 LYS A 952 28.202 20.473 -0.671 1.00 0.00 H ATOM 1527 H LYS A 952 34.957 16.263 -0.308 1.00 0.00 H ATOM 1528 N VAL A 953 33.395 16.130 3.263 1.00 18.87 N ATOM 1529 CA VAL A 953 33.645 15.278 4.432 1.00 18.71 C ATOM 1530 C VAL A 953 32.338 14.628 4.888 1.00 19.58 C ATOM 1531 O VAL A 953 31.277 15.265 4.886 1.00 19.23 O ATOM 1532 CB VAL A 953 34.294 16.091 5.584 1.00 18.41 C ATOM 1533 CG1 VAL A 953 34.407 15.264 6.866 1.00 20.08 C ATOM 1534 CG2 VAL A 953 35.668 16.602 5.161 1.00 17.83 C ATOM 1535 H VAL A 953 33.044 17.096 3.419 1.00 0.00 H ATOM 1536 N GLY A 954 32.421 13.351 5.258 1.00 19.28 N ATOM 1537 CA GLY A 954 31.269 12.614 5.760 1.00 20.32 C ATOM 1538 C GLY A 954 31.701 11.336 6.457 1.00 20.96 C ATOM 1539 O GLY A 954 32.883 11.153 6.761 1.00 20.11 O ATOM 1540 H GLY A 954 33.337 12.865 5.186 1.00 0.00 H ATOM 1541 N ASP A 955 30.726 10.474 6.729 1.00 20.07 N ATOM 1542 CA ASP A 955 30.970 9.116 7.200 1.00 21.49 C ATOM 1543 C ASP A 955 30.486 8.185 6.088 1.00 21.37 C ATOM 1544 O ASP A 955 29.320 7.789 6.050 1.00 21.61 O ATOM 1545 CB ASP A 955 30.213 8.862 8.513 1.00 22.27 C ATOM 1546 CG ASP A 955 30.474 7.468 9.092 1.00 27.41 C ATOM 1547 OD1 ASP A 955 31.203 6.665 8.469 1.00 27.06 O ATOM 1548 OD2 ASP A 955 29.930 7.178 10.172 1.00 30.80 O ATOM 1549 H ASP A 955 29.742 10.783 6.600 1.00 0.00 H ATOM 1550 N PHE A 956 31.386 7.851 5.164 1.00 21.78 N ATOM 1551 CA PHE A 956 30.970 7.206 3.915 1.00 24.90 C ATOM 1552 C PHE A 956 30.642 5.723 4.040 1.00 28.43 C ATOM 1553 O PHE A 956 29.640 5.258 3.488 1.00 30.73 O ATOM 1554 CB PHE A 956 31.983 7.494 2.799 1.00 22.84 C ATOM 1555 CG PHE A 956 31.867 8.893 2.241 1.00 21.64 C ATOM 1556 CD1 PHE A 956 32.400 9.980 2.932 1.00 20.72 C ATOM 1557 CD2 PHE A 956 31.184 9.121 1.040 1.00 24.97 C ATOM 1558 CE1 PHE A 956 32.275 11.278 2.429 1.00 22.05 C ATOM 1559 CE2 PHE A 956 31.048 10.411 0.527 1.00 22.00 C ATOM 1560 CZ PHE A 956 31.600 11.491 1.222 1.00 20.81 C ATOM 1561 H PHE A 956 32.393 8.050 5.330 1.00 0.00 H ATOM 1562 N GLY A 957 31.468 4.993 4.779 1.00 30.99 N ATOM 1563 CA GLY A 957 31.217 3.569 5.028 1.00 36.03 C ATOM 1564 C GLY A 957 31.314 2.711 3.780 1.00 38.50 C ATOM 1565 O GLY A 957 30.492 1.814 3.569 1.00 40.61 O ATOM 1566 H GLY A 957 32.312 5.440 5.191 1.00 0.00 H ATOM 1567 N LEU A 958 32.304 3.006 2.939 1.00 39.12 N ATOM 1568 CA LEU A 958 32.613 2.149 1.798 1.00 41.96 C ATOM 1569 C LEU A 958 33.918 1.412 2.089 1.00 44.44 C ATOM 1570 O LEU A 958 35.006 1.879 1.738 1.00 44.28 O ATOM 1571 CB LEU A 958 32.704 2.952 0.490 1.00 40.63 C ATOM 1572 CG LEU A 958 31.483 3.729 -0.025 1.00 39.35 C ATOM 1573 CD1 LEU A 958 31.814 4.437 -1.338 1.00 37.24 C ATOM 1574 CD2 LEU A 958 30.265 2.836 -0.206 1.00 39.97 C ATOM 1575 H LEU A 958 32.869 3.865 3.098 1.00 0.00 H ATOM 1576 N VAL A 959 33.792 0.270 2.758 1.00 48.35 N ATOM 1577 CA VAL A 959 34.933 -0.558 3.139 1.00 51.44 C ATOM 1578 C VAL A 959 35.380 -1.411 1.949 1.00 53.59 C ATOM 1579 O VAL A 959 34.609 -2.223 1.426 1.00 55.39 O ATOM 1580 CB VAL A 959 34.596 -1.431 4.381 1.00 53.14 C ATOM 1581 CG1 VAL A 959 35.709 -2.434 4.676 1.00 55.70 C ATOM 1582 CG2 VAL A 959 34.339 -0.538 5.594 1.00 52.96 C ATOM 1583 H VAL A 959 32.838 -0.048 3.022 1.00 0.00 H ATOM 1584 N THR A 960 36.627 -1.206 1.525 1.00 54.18 N ATOM 1585 CA THR A 960 37.167 -1.851 0.327 1.00 56.54 C ATOM 1586 C THR A 960 37.979 -3.101 0.666 1.00 59.42 C ATOM 1587 O THR A 960 39.201 -3.132 0.509 1.00 60.04 O ATOM 1588 CB THR A 960 38.005 -0.853 -0.489 1.00 55.01 C ATOM 1589 H THR A 960 37.240 -0.563 2.066 1.00 0.00 H TER 1590 THR A 960 ATOM 1591 N THR A 987 40.882 1.041 9.292 1.00 43.88 N ATOM 1592 CA THR A 987 42.227 1.468 9.669 1.00 43.09 C ATOM 1593 C THR A 987 42.228 2.369 10.903 1.00 41.50 C ATOM 1594 O THR A 987 41.322 3.188 11.087 1.00 41.28 O ATOM 1595 CB THR A 987 42.965 2.188 8.501 1.00 42.37 C ATOM 1596 OG1 THR A 987 44.273 2.591 8.931 1.00 41.12 O ATOM 1597 CG2 THR A 987 42.195 3.427 8.015 1.00 40.64 C ATOM 1598 HG1 THR A 987 44.738 3.048 8.186 1.00 0.00 H ATOM 1599 HN3 THR A 987 40.301 1.877 9.080 1.00 0.00 H ATOM 1600 HN2 THR A 987 40.455 0.510 10.078 1.00 0.00 H ATOM 1601 HN1 THR A 987 40.936 0.433 8.450 1.00 0.00 H ATOM 1602 N LYS A 988 43.256 2.219 11.734 1.00 40.26 N ATOM 1603 CA LYS A 988 43.422 3.077 12.907 1.00 37.69 C ATOM 1604 C LYS A 988 44.597 4.050 12.770 1.00 34.97 C ATOM 1605 O LYS A 988 44.943 4.745 13.725 1.00 33.37 O ATOM 1606 CB LYS A 988 43.556 2.232 14.179 1.00 40.34 C ATOM 1607 CG LYS A 988 42.300 1.442 14.519 1.00 43.17 C ATOM 1608 CD LYS A 988 42.418 0.776 15.871 1.00 49.36 C ATOM 1609 CE LYS A 988 41.132 0.053 16.232 1.00 52.12 C ATOM 1610 NZ LYS A 988 41.145 -0.386 17.651 1.00 56.28 N ATOM 1611 HZ1 LYS A 988 41.945 -1.032 17.805 1.00 0.00 H ATOM 1612 HZ2 LYS A 988 41.245 0.445 18.269 1.00 0.00 H ATOM 1613 HZ3 LYS A 988 40.254 -0.877 17.869 1.00 0.00 H ATOM 1614 H LYS A 988 43.958 1.475 11.545 1.00 0.00 H ATOM 1615 N LEU A 989 45.186 4.126 11.575 1.00 33.15 N ATOM 1616 CA LEU A 989 46.361 4.972 11.355 1.00 31.90 C ATOM 1617 C LEU A 989 46.132 6.453 11.646 1.00 29.58 C ATOM 1618 O LEU A 989 47.067 7.149 12.021 1.00 30.54 O ATOM 1619 CB LEU A 989 46.915 4.804 9.934 1.00 32.00 C ATOM 1620 CG LEU A 989 47.846 3.625 9.657 1.00 35.49 C ATOM 1621 CD1 LEU A 989 48.116 3.521 8.161 1.00 34.08 C ATOM 1622 CD2 LEU A 989 49.159 3.731 10.442 1.00 37.04 C ATOM 1623 H LEU A 989 44.802 3.572 10.783 1.00 0.00 H ATOM 1624 N TYR A 990 44.895 6.925 11.480 1.00 26.64 N ATOM 1625 CA TYR A 990 44.571 8.345 11.658 1.00 24.65 C ATOM 1626 C TYR A 990 43.886 8.624 12.999 1.00 24.77 C ATOM 1627 O TYR A 990 43.529 9.760 13.300 1.00 25.71 O ATOM 1628 CB TYR A 990 43.669 8.829 10.510 1.00 23.80 C ATOM 1629 CG TYR A 990 44.255 8.545 9.150 1.00 21.27 C ATOM 1630 CD1 TYR A 990 45.058 9.489 8.510 1.00 21.00 C ATOM 1631 CD2 TYR A 990 44.020 7.324 8.511 1.00 24.13 C ATOM 1632 CE1 TYR A 990 45.615 9.223 7.267 1.00 20.38 C ATOM 1633 CE2 TYR A 990 44.571 7.049 7.269 1.00 23.10 C ATOM 1634 CZ TYR A 990 45.366 8.002 6.655 1.00 22.07 C ATOM 1635 OH TYR A 990 45.908 7.735 5.418 1.00 23.41 O ATOM 1636 HH TYR A 990 46.446 8.511 5.120 1.00 0.00 H ATOM 1637 H TYR A 990 44.136 6.265 11.216 1.00 0.00 H ATOM 1638 N MET A 991 43.712 7.579 13.795 1.00 26.33 N ATOM 1639 CA MET A 991 42.959 7.683 15.038 1.00 26.60 C ATOM 1640 C MET A 991 43.821 8.199 16.192 1.00 27.16 C ATOM 1641 O MET A 991 44.948 7.752 16.375 1.00 28.30 O ATOM 1642 CB MET A 991 42.348 6.323 15.381 1.00 28.08 C ATOM 1643 CG MET A 991 41.436 6.336 16.592 1.00 31.21 C ATOM 1644 SD MET A 991 40.513 4.801 16.798 1.00 34.65 S ATOM 1645 CE MET A 991 39.256 5.008 15.537 1.00 34.31 C ATOM 1646 H MET A 991 44.123 6.662 13.526 1.00 0.00 H ATOM 1647 N SER A 992 43.265 9.127 16.974 1.00 26.07 N ATOM 1648 CA SER A 992 43.947 9.683 18.147 1.00 26.24 C ATOM 1649 C SER A 992 44.361 8.593 19.142 1.00 27.77 C ATOM 1650 O SER A 992 43.686 7.567 19.257 1.00 27.89 O ATOM 1651 CB SER A 992 43.045 10.701 18.842 1.00 25.36 C ATOM 1652 OG SER A 992 41.983 10.048 19.516 1.00 26.25 O ATOM 1653 HG SER A 992 41.445 9.535 18.862 1.00 0.00 H ATOM 1654 H SER A 992 42.311 9.469 16.742 1.00 0.00 H ATOM 1655 N PRO A 993 45.475 8.813 19.871 1.00 28.90 N ATOM 1656 CA PRO A 993 45.920 7.857 20.894 1.00 31.06 C ATOM 1657 C PRO A 993 44.841 7.579 21.943 1.00 31.63 C ATOM 1658 O PRO A 993 44.676 6.432 22.372 1.00 32.73 O ATOM 1659 CB PRO A 993 47.117 8.556 21.558 1.00 32.57 C ATOM 1660 CG PRO A 993 47.510 9.649 20.655 1.00 30.62 C ATOM 1661 CD PRO A 993 46.360 9.987 19.764 1.00 29.21 C ATOM 1662 N GLU A 994 44.105 8.617 22.342 1.00 31.10 N ATOM 1663 CA GLU A 994 43.074 8.458 23.371 1.00 32.35 C ATOM 1664 C GLU A 994 41.947 7.523 22.913 1.00 31.06 C ATOM 1665 O GLU A 994 41.440 6.733 23.710 1.00 32.23 O ATOM 1666 CB GLU A 994 42.536 9.817 23.869 1.00 31.75 C ATOM 1667 CG GLU A 994 41.962 10.748 22.799 1.00 29.26 C ATOM 1668 CD GLU A 994 42.977 11.742 22.225 1.00 30.66 C ATOM 1669 OE1 GLU A 994 44.190 11.423 22.139 1.00 28.93 O ATOM 1670 OE2 GLU A 994 42.539 12.848 21.830 1.00 26.79 O ATOM 1671 H GLU A 994 44.265 9.553 21.917 1.00 0.00 H ATOM 1672 N GLN A 995 41.593 7.584 21.629 1.00 28.97 N ATOM 1673 CA GLN A 995 40.594 6.672 21.059 1.00 28.48 C ATOM 1674 C GLN A 995 41.096 5.231 20.933 1.00 30.53 C ATOM 1675 O GLN A 995 40.389 4.290 21.301 1.00 30.80 O ATOM 1676 CB GLN A 995 40.125 7.164 19.700 1.00 27.68 C ATOM 1677 CG GLN A 995 39.082 8.251 19.757 1.00 26.50 C ATOM 1678 CD GLN A 995 38.907 8.899 18.416 1.00 25.89 C ATOM 1679 OE1 GLN A 995 39.819 9.556 17.911 1.00 24.95 O ATOM 1680 NE2 GLN A 995 37.742 8.699 17.810 1.00 25.42 N ATOM 1681 HE22 GLN A 995 37.002 8.137 18.277 1.00 0.00 H ATOM 1682 HE21 GLN A 995 37.569 9.105 16.868 1.00 0.00 H ATOM 1683 H GLN A 995 42.036 8.297 21.015 1.00 0.00 H ATOM 1684 N ILE A 996 42.309 5.064 20.407 1.00 30.29 N ATOM 1685 CA ILE A 996 42.925 3.731 20.309 1.00 33.33 C ATOM 1686 C ILE A 996 42.931 3.006 21.657 1.00 35.32 C ATOM 1687 O ILE A 996 42.644 1.806 21.729 1.00 37.08 O ATOM 1688 CB ILE A 996 44.351 3.790 19.697 1.00 32.76 C ATOM 1689 CG1 ILE A 996 44.266 4.236 18.230 1.00 32.12 C ATOM 1690 CG2 ILE A 996 45.057 2.423 19.815 1.00 35.01 C ATOM 1691 CD1 ILE A 996 45.596 4.582 17.594 1.00 35.28 C ATOM 1692 H ILE A 996 42.831 5.893 20.058 1.00 0.00 H ATOM 1693 N HIS A 997 43.237 3.744 22.723 1.00 36.32 N ATOM 1694 CA HIS A 997 43.283 3.178 24.069 1.00 38.81 C ATOM 1695 C HIS A 997 41.907 3.037 24.732 1.00 38.13 C ATOM 1696 O HIS A 997 41.810 2.560 25.861 1.00 39.08 O ATOM 1697 CB HIS A 997 44.236 3.985 24.957 1.00 41.03 C ATOM 1698 CG HIS A 997 45.678 3.802 24.602 1.00 46.43 C ATOM 1699 ND1 HIS A 997 46.340 4.631 23.722 1.00 50.75 N ATOM 1700 CD2 HIS A 997 46.580 2.869 24.989 1.00 53.52 C ATOM 1701 CE1 HIS A 997 47.590 4.225 23.592 1.00 52.08 C ATOM 1702 NE2 HIS A 997 47.761 3.156 24.349 1.00 56.11 N ATOM 1703 H HIS A 997 43.450 4.754 22.593 1.00 0.00 H ATOM 1704 N GLY A 998 40.853 3.443 24.027 1.00 35.81 N ATOM 1705 CA GLY A 998 39.485 3.343 24.545 1.00 36.03 C ATOM 1706 C GLY A 998 39.193 4.287 25.699 1.00 35.99 C ATOM 1707 O GLY A 998 38.355 3.997 26.550 1.00 37.24 O ATOM 1708 H GLY A 998 41.005 3.844 23.079 1.00 0.00 H ATOM 1709 N ASN A 999 39.885 5.424 25.726 1.00 34.68 N ATOM 1710 CA ASN A 999 39.691 6.415 26.783 1.00 34.56 C ATOM 1711 C ASN A 999 38.644 7.442 26.370 1.00 31.49 C ATOM 1712 O ASN A 999 38.255 7.494 25.204 1.00 29.87 O ATOM 1713 CB ASN A 999 41.015 7.115 27.110 1.00 35.51 C ATOM 1714 CG ASN A 999 42.035 6.178 27.743 1.00 39.11 C ATOM 1715 OD1 ASN A 999 41.682 5.219 28.433 1.00 45.17 O ATOM 1716 ND2 ASN A 999 43.309 6.463 27.516 1.00 45.49 N ATOM 1717 HD22 ASN A 999 43.562 7.282 26.927 1.00 0.00 H ATOM 1718 HD21 ASN A 999 44.056 5.867 27.926 1.00 0.00 H ATOM 1719 H ASN A 999 40.581 5.612 24.976 1.00 0.00 H ATOM 1720 N SER A1000 38.180 8.247 27.327 1.00 31.37 N ATOM 1721 CA SER A1000 37.304 9.372 27.002 1.00 29.97 C ATOM 1722 C SER A1000 38.060 10.382 26.151 1.00 28.62 C ATOM 1723 O SER A1000 39.295 10.397 26.144 1.00 28.36 O ATOM 1724 CB SER A1000 36.763 10.037 28.265 1.00 30.83 C ATOM 1725 OG SER A1000 37.813 10.501 29.088 1.00 32.58 O ATOM 1726 HG SER A1000 37.433 10.926 29.897 1.00 0.00 H ATOM 1727 H SER A1000 38.445 8.072 28.317 1.00 0.00 H ATOM 1728 N TYR A1001 37.323 11.214 25.423 1.00 27.26 N ATOM 1729 CA TYR A1001 37.945 12.100 24.438 1.00 25.44 C ATOM 1730 C TYR A1001 37.093 13.335 24.166 1.00 25.78 C ATOM 1731 O TYR A1001 35.951 13.436 24.638 1.00 25.73 O ATOM 1732 CB TYR A1001 38.252 11.339 23.133 1.00 24.93 C ATOM 1733 CG TYR A1001 37.032 10.736 22.470 1.00 24.45 C ATOM 1734 CD1 TYR A1001 36.294 11.462 21.536 1.00 26.50 C ATOM 1735 CD2 TYR A1001 36.606 9.442 22.790 1.00 26.84 C ATOM 1736 CE1 TYR A1001 35.159 10.916 20.927 1.00 26.24 C ATOM 1737 CE2 TYR A1001 35.469 8.886 22.187 1.00 29.80 C ATOM 1738 CZ TYR A1001 34.756 9.630 21.258 1.00 29.31 C ATOM 1739 OH TYR A1001 33.636 9.097 20.656 1.00 28.07 O ATOM 1740 HH TYR A1001 33.887 8.276 20.162 1.00 0.00 H ATOM 1741 H TYR A1001 36.292 11.236 25.555 1.00 0.00 H ATOM 1742 N SER A1002 37.670 14.269 23.413 1.00 25.05 N ATOM 1743 CA SER A1002 37.008 15.516 23.040 1.00 26.99 C ATOM 1744 C SER A1002 37.153 15.739 21.540 1.00 25.04 C ATOM 1745 O SER A1002 37.724 14.906 20.833 1.00 24.24 O ATOM 1746 CB SER A1002 37.651 16.693 23.795 1.00 27.53 C ATOM 1747 OG SER A1002 38.931 16.984 23.245 1.00 28.27 O ATOM 1748 HG SER A1002 39.513 16.187 23.327 1.00 0.00 H ATOM 1749 H SER A1002 38.639 14.102 23.074 1.00 0.00 H ATOM 1750 N HIS A1003 36.656 16.880 21.061 1.00 24.51 N ATOM 1751 CA HIS A1003 36.766 17.256 19.652 1.00 24.18 C ATOM 1752 C HIS A1003 38.220 17.312 19.162 1.00 23.68 C ATOM 1753 O HIS A1003 38.477 17.282 17.955 1.00 23.33 O ATOM 1754 CB HIS A1003 36.078 18.604 19.422 1.00 24.12 C ATOM 1755 CG HIS A1003 36.760 19.748 20.105 1.00 26.03 C ATOM 1756 ND1 HIS A1003 36.646 19.985 21.458 1.00 29.00 N ATOM 1757 CD2 HIS A1003 37.582 20.711 19.621 1.00 28.15 C ATOM 1758 CE1 HIS A1003 37.361 21.051 21.778 1.00 32.13 C ATOM 1759 NE2 HIS A1003 37.940 21.508 20.681 1.00 28.84 N ATOM 1760 H HIS A1003 36.171 17.528 21.715 1.00 0.00 H ATOM 1761 N LYS A1004 39.163 17.388 20.105 1.00 23.99 N ATOM 1762 CA LYS A1004 40.589 17.394 19.779 1.00 24.75 C ATOM 1763 C LYS A1004 41.054 16.139 19.021 1.00 23.66 C ATOM 1764 O LYS A1004 42.107 16.154 18.378 1.00 23.03 O ATOM 1765 CB LYS A1004 41.434 17.627 21.043 1.00 26.53 C ATOM 1766 CG LYS A1004 41.348 19.055 21.600 1.00 29.25 C ATOM 1767 CD LYS A1004 41.809 20.098 20.571 1.00 29.85 C ATOM 1768 CE LYS A1004 41.753 21.520 21.126 1.00 32.81 C ATOM 1769 NZ LYS A1004 42.852 21.790 22.085 1.00 31.23 N ATOM 1770 HZ1 LYS A1004 42.784 21.128 22.884 1.00 0.00 H ATOM 1771 HZ2 LYS A1004 43.767 21.665 21.606 1.00 0.00 H ATOM 1772 HZ3 LYS A1004 42.773 22.766 22.435 1.00 0.00 H ATOM 1773 H LYS A1004 38.874 17.445 21.102 1.00 0.00 H ATOM 1774 N VAL A1005 40.266 15.063 19.084 1.00 23.75 N ATOM 1775 CA VAL A1005 40.570 13.847 18.311 1.00 22.61 C ATOM 1776 C VAL A1005 40.661 14.116 16.809 1.00 21.53 C ATOM 1777 O VAL A1005 41.467 13.492 16.113 1.00 22.41 O ATOM 1778 CB VAL A1005 39.568 12.685 18.588 1.00 21.67 C ATOM 1779 CG1 VAL A1005 39.562 12.328 20.071 1.00 22.20 C ATOM 1780 CG2 VAL A1005 38.141 13.015 18.078 1.00 21.31 C ATOM 1781 H VAL A1005 39.421 15.084 19.691 1.00 0.00 H ATOM 1782 N ASP A1006 39.841 15.047 16.318 1.00 20.40 N ATOM 1783 CA ASP A1006 39.811 15.375 14.894 1.00 20.34 C ATOM 1784 C ASP A1006 41.059 16.128 14.463 1.00 20.08 C ATOM 1785 O ASP A1006 41.481 16.022 13.311 1.00 20.24 O ATOM 1786 CB ASP A1006 38.580 16.205 14.549 1.00 20.27 C ATOM 1787 CG ASP A1006 37.285 15.409 14.646 1.00 21.79 C ATOM 1788 OD1 ASP A1006 37.317 14.159 14.544 1.00 21.09 O ATOM 1789 OD2 ASP A1006 36.232 16.055 14.811 1.00 22.61 O ATOM 1790 H ASP A1006 39.205 15.554 16.967 1.00 0.00 H ATOM 1791 N ILE A1007 41.640 16.886 15.389 1.00 21.79 N ATOM 1792 CA ILE A1007 42.864 17.649 15.106 1.00 21.75 C ATOM 1793 C ILE A1007 44.052 16.709 14.860 1.00 21.63 C ATOM 1794 O ILE A1007 44.856 16.934 13.951 1.00 20.46 O ATOM 1795 CB ILE A1007 43.175 18.679 16.238 1.00 22.76 C ATOM 1796 CG1 ILE A1007 41.952 19.575 16.525 1.00 22.96 C ATOM 1797 CG2 ILE A1007 44.439 19.495 15.914 1.00 24.10 C ATOM 1798 CD1 ILE A1007 41.385 20.362 15.321 1.00 22.96 C ATOM 1799 H ILE A1007 41.217 16.940 16.338 1.00 0.00 H ATOM 1800 N PHE A1008 44.142 15.648 15.661 1.00 21.51 N ATOM 1801 CA PHE A1008 45.146 14.608 15.462 1.00 22.17 C ATOM 1802 C PHE A1008 45.037 13.997 14.059 1.00 21.20 C ATOM 1803 O PHE A1008 46.029 13.911 13.337 1.00 21.78 O ATOM 1804 CB PHE A1008 45.033 13.530 16.552 1.00 22.99 C ATOM 1805 CG PHE A1008 46.197 12.578 16.591 1.00 25.38 C ATOM 1806 CD1 PHE A1008 47.266 12.801 17.464 1.00 24.56 C ATOM 1807 CD2 PHE A1008 46.224 11.452 15.765 1.00 22.90 C ATOM 1808 CE1 PHE A1008 48.346 11.923 17.506 1.00 27.36 C ATOM 1809 CE2 PHE A1008 47.302 10.566 15.805 1.00 24.97 C ATOM 1810 CZ PHE A1008 48.360 10.799 16.676 1.00 27.01 C ATOM 1811 H PHE A1008 43.475 15.558 16.454 1.00 0.00 H ATOM 1812 N SER A1009 43.825 13.603 13.666 1.00 20.97 N ATOM 1813 CA SER A1009 43.572 13.084 12.313 1.00 20.62 C ATOM 1814 C SER A1009 44.002 14.074 11.222 1.00 20.88 C ATOM 1815 O SER A1009 44.644 13.687 10.249 1.00 20.65 O ATOM 1816 CB SER A1009 42.090 12.729 12.150 1.00 19.10 C ATOM 1817 OG SER A1009 41.679 11.878 13.209 1.00 22.82 O ATOM 1818 HG SER A1009 42.218 11.048 13.192 1.00 0.00 H ATOM 1819 H SER A1009 43.033 13.665 14.338 1.00 0.00 H ATOM 1820 N LEU A1010 43.647 15.346 11.398 1.00 20.50 N ATOM 1821 CA LEU A1010 44.030 16.405 10.458 1.00 21.41 C ATOM 1822 C LEU A1010 45.545 16.509 10.267 1.00 21.99 C ATOM 1823 O LEU A1010 46.020 16.729 9.149 1.00 21.37 O ATOM 1824 CB LEU A1010 43.480 17.756 10.923 1.00 21.31 C ATOM 1825 CG LEU A1010 42.012 18.092 10.625 1.00 21.10 C ATOM 1826 CD1 LEU A1010 41.644 19.419 11.279 1.00 21.55 C ATOM 1827 CD2 LEU A1010 41.729 18.150 9.124 1.00 21.39 C ATOM 1828 H LEU A1010 43.078 15.597 12.232 1.00 0.00 H ATOM 1829 N GLY A1011 46.293 16.353 11.360 1.00 21.58 N ATOM 1830 CA GLY A1011 47.760 16.421 11.318 1.00 23.27 C ATOM 1831 C GLY A1011 48.351 15.409 10.356 1.00 23.45 C ATOM 1832 O GLY A1011 49.188 15.752 9.510 1.00 23.76 O ATOM 1833 H GLY A1011 45.823 16.178 12.271 1.00 0.00 H ATOM 1834 N LEU A1012 47.903 14.159 10.473 1.00 22.32 N ATOM 1835 CA LEU A1012 48.413 13.081 9.630 1.00 22.27 C ATOM 1836 C LEU A1012 47.994 13.261 8.178 1.00 21.49 C ATOM 1837 O LEU A1012 48.754 12.941 7.261 1.00 22.13 O ATOM 1838 CB LEU A1012 47.957 11.721 10.158 1.00 22.32 C ATOM 1839 CG LEU A1012 48.678 11.274 11.428 1.00 23.37 C ATOM 1840 CD1 LEU A1012 47.805 10.331 12.231 1.00 23.36 C ATOM 1841 CD2 LEU A1012 50.021 10.641 11.097 1.00 24.70 C ATOM 1842 H LEU A1012 47.172 13.946 11.182 1.00 0.00 H ATOM 1843 N ILE A1013 46.784 13.780 7.976 1.00 20.91 N ATOM 1844 CA ILE A1013 46.267 14.039 6.628 1.00 20.64 C ATOM 1845 C ILE A1013 47.067 15.146 5.930 1.00 21.42 C ATOM 1846 O ILE A1013 47.392 15.030 4.741 1.00 20.44 O ATOM 1847 CB ILE A1013 44.748 14.351 6.644 1.00 20.38 C ATOM 1848 CG1 ILE A1013 43.961 13.097 7.056 1.00 19.97 C ATOM 1849 CG2 ILE A1013 44.270 14.840 5.270 1.00 21.03 C ATOM 1850 CD1 ILE A1013 42.486 13.368 7.434 1.00 21.82 C ATOM 1851 H ILE A1013 46.189 14.008 8.798 1.00 0.00 H ATOM 1852 N LEU A1014 47.398 16.205 6.669 1.00 20.98 N ATOM 1853 CA LEU A1014 48.239 17.269 6.109 1.00 22.04 C ATOM 1854 C LEU A1014 49.591 16.716 5.659 1.00 22.70 C ATOM 1855 O LEU A1014 50.036 16.998 4.542 1.00 22.53 O ATOM 1856 CB LEU A1014 48.422 18.427 7.096 1.00 23.25 C ATOM 1857 CG LEU A1014 49.325 19.588 6.632 1.00 24.36 C ATOM 1858 CD1 LEU A1014 48.870 20.202 5.297 1.00 23.83 C ATOM 1859 CD2 LEU A1014 49.418 20.664 7.710 1.00 24.11 C ATOM 1860 H LEU A1014 47.058 16.278 7.649 1.00 0.00 H ATOM 1861 N PHE A1015 50.238 15.926 6.516 1.00 21.61 N ATOM 1862 CA PHE A1015 51.503 15.309 6.138 1.00 23.96 C ATOM 1863 C PHE A1015 51.344 14.447 4.881 1.00 23.21 C ATOM 1864 O PHE A1015 52.115 14.577 3.930 1.00 24.21 O ATOM 1865 CB PHE A1015 52.098 14.455 7.263 1.00 24.86 C ATOM 1866 CG PHE A1015 53.275 13.646 6.813 1.00 25.69 C ATOM 1867 CD1 PHE A1015 54.550 14.214 6.771 1.00 27.20 C ATOM 1868 CD2 PHE A1015 53.104 12.337 6.367 1.00 25.93 C ATOM 1869 CE1 PHE A1015 55.644 13.481 6.319 1.00 30.57 C ATOM 1870 CE2 PHE A1015 54.192 11.602 5.908 1.00 26.12 C ATOM 1871 CZ PHE A1015 55.464 12.176 5.888 1.00 30.54 C ATOM 1872 H PHE A1015 49.838 15.749 7.459 1.00 0.00 H ATOM 1873 N GLU A1016 50.345 13.567 4.896 1.00 22.15 N ATOM 1874 CA GLU A1016 50.140 12.617 3.798 1.00 21.94 C ATOM 1875 C GLU A1016 49.864 13.302 2.455 1.00 21.40 C ATOM 1876 O GLU A1016 50.323 12.828 1.412 1.00 23.41 O ATOM 1877 CB GLU A1016 49.008 11.644 4.120 1.00 20.18 C ATOM 1878 CG GLU A1016 48.962 10.454 3.156 1.00 20.41 C ATOM 1879 CD GLU A1016 47.958 9.403 3.568 1.00 24.12 C ATOM 1880 OE1 GLU A1016 48.009 8.284 3.015 1.00 23.45 O ATOM 1881 OE2 GLU A1016 47.125 9.699 4.444 1.00 22.46 O ATOM 1882 H GLU A1016 49.694 13.553 5.707 1.00 0.00 H ATOM 1883 N LEU A1017 49.118 14.402 2.484 1.00 20.23 N ATOM 1884 CA LEU A1017 48.869 15.193 1.269 1.00 20.79 C ATOM 1885 C LEU A1017 50.157 15.729 0.650 1.00 22.22 C ATOM 1886 O LEU A1017 50.300 15.752 -0.578 1.00 23.49 O ATOM 1887 CB LEU A1017 47.918 16.360 1.561 1.00 20.23 C ATOM 1888 CG LEU A1017 46.431 16.006 1.640 1.00 21.37 C ATOM 1889 CD1 LEU A1017 45.656 17.158 2.284 1.00 22.14 C ATOM 1890 CD2 LEU A1017 45.885 15.686 0.255 1.00 22.39 C ATOM 1891 H LEU A1017 48.701 14.710 3.386 1.00 0.00 H ATOM 1892 N LEU A1018 51.084 16.161 1.501 1.00 22.66 N ATOM 1893 CA LEU A1018 52.336 16.777 1.039 1.00 23.90 C ATOM 1894 C LEU A1018 53.419 15.765 0.657 1.00 24.49 C ATOM 1895 O LEU A1018 54.348 16.093 -0.084 1.00 27.18 O ATOM 1896 CB LEU A1018 52.872 17.739 2.107 1.00 24.20 C ATOM 1897 CG LEU A1018 52.020 18.989 2.378 1.00 25.10 C ATOM 1898 CD1 LEU A1018 52.393 19.637 3.704 1.00 27.75 C ATOM 1899 CD2 LEU A1018 52.132 19.990 1.227 1.00 27.22 C ATOM 1900 H LEU A1018 50.918 16.060 2.523 1.00 0.00 H ATOM 1901 N TYR A1019 53.286 14.536 1.150 1.00 24.34 N ATOM 1902 CA TYR A1019 54.339 13.530 1.020 1.00 25.27 C ATOM 1903 C TYR A1019 53.842 12.285 0.267 1.00 25.53 C ATOM 1904 O TYR A1019 53.186 11.419 0.859 1.00 25.16 O ATOM 1905 CB TYR A1019 54.862 13.163 2.416 1.00 25.34 C ATOM 1906 CG TYR A1019 56.184 12.430 2.425 1.00 28.45 C ATOM 1907 CD1 TYR A1019 57.388 13.129 2.527 1.00 29.98 C ATOM 1908 CD2 TYR A1019 56.235 11.037 2.342 1.00 29.83 C ATOM 1909 CE1 TYR A1019 58.607 12.459 2.548 1.00 34.52 C ATOM 1910 CE2 TYR A1019 57.453 10.355 2.358 1.00 32.30 C ATOM 1911 CZ TYR A1019 58.634 11.074 2.460 1.00 36.40 C ATOM 1912 OH TYR A1019 59.844 10.415 2.475 1.00 40.01 O ATOM 1913 HH TYR A1019 60.577 11.076 2.552 1.00 0.00 H ATOM 1914 H TYR A1019 52.406 14.283 1.643 1.00 0.00 H ATOM 1915 N PRO A1020 54.145 12.193 -1.045 1.00 27.14 N ATOM 1916 CA PRO A1020 53.659 11.057 -1.845 1.00 27.33 C ATOM 1917 C PRO A1020 54.407 9.747 -1.575 1.00 27.74 C ATOM 1918 O PRO A1020 55.604 9.757 -1.270 1.00 29.69 O ATOM 1919 CB PRO A1020 53.896 11.517 -3.287 1.00 27.47 C ATOM 1920 CG PRO A1020 55.066 12.459 -3.194 1.00 29.74 C ATOM 1921 CD PRO A1020 54.902 13.163 -1.865 1.00 28.20 C ATOM 1922 N PHE A1021 53.686 8.635 -1.688 1.00 27.78 N ATOM 1923 CA PHE A1021 54.244 7.296 -1.502 1.00 29.20 C ATOM 1924 C PHE A1021 54.213 6.482 -2.791 1.00 30.71 C ATOM 1925 O PHE A1021 53.347 6.705 -3.646 1.00 30.31 O ATOM 1926 CB PHE A1021 53.477 6.546 -0.409 1.00 29.09 C ATOM 1927 CG PHE A1021 53.572 7.188 0.946 1.00 27.86 C ATOM 1928 CD1 PHE A1021 54.796 7.264 1.604 1.00 30.15 C ATOM 1929 CD2 PHE A1021 52.441 7.710 1.564 1.00 27.10 C ATOM 1930 CE1 PHE A1021 54.896 7.858 2.857 1.00 30.18 C ATOM 1931 CE2 PHE A1021 52.528 8.305 2.823 1.00 27.60 C ATOM 1932 CZ PHE A1021 53.762 8.378 3.467 1.00 28.34 C ATOM 1933 H PHE A1021 52.676 8.722 -1.920 1.00 0.00 H ATOM 1934 N SER A1022 55.157 5.542 -2.904 1.00 32.28 N ATOM 1935 CA SER A1022 55.272 4.625 -4.040 1.00 36.23 C ATOM 1936 C SER A1022 54.752 3.215 -3.724 1.00 36.95 C ATOM 1937 O SER A1022 54.448 2.451 -4.639 1.00 37.93 O ATOM 1938 CB SER A1022 56.736 4.503 -4.487 1.00 39.03 C ATOM 1939 OG SER A1022 57.311 5.771 -4.739 1.00 44.31 O ATOM 1940 HG SER A1022 58.252 5.655 -5.024 1.00 0.00 H ATOM 1941 H SER A1022 55.854 5.457 -2.137 1.00 0.00 H ATOM 1942 N THR A1023 54.700 2.862 -2.438 1.00 36.81 N ATOM 1943 CA THR A1023 54.204 1.549 -1.992 1.00 37.81 C ATOM 1944 C THR A1023 53.355 1.689 -0.733 1.00 37.30 C ATOM 1945 O THR A1023 53.481 2.676 0.001 1.00 34.38 O ATOM 1946 CB THR A1023 55.349 0.543 -1.680 1.00 41.10 C ATOM 1947 OG1 THR A1023 56.128 1.019 -0.575 1.00 39.58 O ATOM 1948 CG2 THR A1023 56.259 0.317 -2.886 1.00 41.70 C ATOM 1949 HG1 THR A1023 56.519 1.899 -0.803 1.00 0.00 H ATOM 1950 H THR A1023 55.023 3.542 -1.721 1.00 0.00 H ATOM 1951 N GLN A1024 52.500 0.697 -0.484 1.00 37.67 N ATOM 1952 CA GLN A1024 51.707 0.654 0.743 1.00 38.60 C ATOM 1953 C GLN A1024 52.620 0.462 1.955 1.00 39.04 C ATOM 1954 O GLN A1024 52.416 1.098 2.990 1.00 38.46 O ATOM 1955 CB GLN A1024 50.620 -0.435 0.661 1.00 40.13 C ATOM 1956 CG GLN A1024 49.995 -0.880 2.004 1.00 42.38 C ATOM 1957 CD GLN A1024 48.988 0.106 2.608 1.00 43.74 C ATOM 1958 OE1 GLN A1024 48.950 1.293 2.267 1.00 38.30 O ATOM 1959 NE2 GLN A1024 48.174 -0.393 3.534 1.00 45.46 N ATOM 1960 HE22 GLN A1024 48.236 -1.398 3.794 1.00 0.00 H ATOM 1961 HE21 GLN A1024 47.475 0.222 3.998 1.00 0.00 H ATOM 1962 H GLN A1024 52.394 -0.067 -1.182 1.00 0.00 H ATOM 1963 N MET A1025 53.632 -0.395 1.812 1.00 41.06 N ATOM 1964 CA MET A1025 54.602 -0.637 2.885 1.00 43.36 C ATOM 1965 C MET A1025 55.292 0.658 3.325 1.00 41.23 C ATOM 1966 O MET A1025 55.410 0.923 4.521 1.00 40.68 O ATOM 1967 CB MET A1025 55.633 -1.686 2.464 1.00 46.47 C ATOM 1968 CG MET A1025 56.489 -2.219 3.607 1.00 53.72 C ATOM 1969 SD MET A1025 57.598 -3.541 3.083 1.00 68.27 S ATOM 1970 CE MET A1025 56.453 -4.916 2.915 1.00 68.41 C ATOM 1971 H MET A1025 53.736 -0.907 0.913 1.00 0.00 H ATOM 1972 N GLU A1026 55.730 1.460 2.354 1.00 39.95 N ATOM 1973 CA GLU A1026 56.338 2.762 2.627 1.00 38.43 C ATOM 1974 C GLU A1026 55.353 3.681 3.356 1.00 34.53 C ATOM 1975 O GLU A1026 55.721 4.343 4.330 1.00 33.39 O ATOM 1976 CB GLU A1026 56.808 3.416 1.322 1.00 39.79 C ATOM 1977 CG GLU A1026 57.522 4.756 1.493 1.00 42.82 C ATOM 1978 CD GLU A1026 57.559 5.595 0.214 1.00 47.47 C ATOM 1979 OE1 GLU A1026 58.121 6.710 0.262 1.00 50.32 O ATOM 1980 OE2 GLU A1026 57.031 5.155 -0.835 1.00 45.29 O ATOM 1981 H GLU A1026 55.636 1.148 1.366 1.00 0.00 H ATOM 1982 N ARG A1027 54.106 3.705 2.887 1.00 31.16 N ATOM 1983 CA ARG A1027 53.061 4.529 3.495 1.00 29.15 C ATOM 1984 C ARG A1027 52.842 4.187 4.972 1.00 29.94 C ATOM 1985 O ARG A1027 52.839 5.083 5.826 1.00 28.52 O ATOM 1986 CB ARG A1027 51.739 4.408 2.725 1.00 27.50 C ATOM 1987 CG ARG A1027 50.592 5.170 3.372 1.00 26.19 C ATOM 1988 CD ARG A1027 49.301 5.108 2.567 1.00 25.69 C ATOM 1989 NE ARG A1027 48.169 5.444 3.428 1.00 27.35 N ATOM 1990 CZ ARG A1027 47.522 4.574 4.206 1.00 29.03 C ATOM 1991 NH1 ARG A1027 46.515 4.991 4.966 1.00 29.08 N ATOM 1992 NH2 ARG A1027 47.868 3.291 4.226 1.00 30.76 N ATOM 1993 HE ARG A1027 47.844 6.432 3.435 1.00 0.00 H ATOM 1994 HH12 ARG A1027 46.008 4.316 5.574 1.00 0.00 H ATOM 1995 HH11 ARG A1027 46.234 5.992 4.953 1.00 0.00 H ATOM 1996 HH22 ARG A1027 47.355 2.624 4.837 1.00 0.00 H ATOM 1997 HH21 ARG A1027 48.651 2.954 3.631 1.00 0.00 H ATOM 1998 H ARG A1027 53.868 3.119 2.062 1.00 0.00 H ATOM 1999 N VAL A1028 52.662 2.898 5.261 1.00 31.28 N ATOM 2000 CA VAL A1028 52.374 2.443 6.623 1.00 33.19 C ATOM 2001 C VAL A1028 53.551 2.752 7.556 1.00 34.43 C ATOM 2002 O VAL A1028 53.357 3.286 8.652 1.00 33.86 O ATOM 2003 CB VAL A1028 52.001 0.933 6.662 1.00 35.68 C ATOM 2004 CG1 VAL A1028 51.853 0.438 8.102 1.00 38.87 C ATOM 2005 CG2 VAL A1028 50.711 0.684 5.885 1.00 35.77 C ATOM 2006 H VAL A1028 52.728 2.195 4.497 1.00 0.00 H ATOM 2007 N ARG A1029 54.765 2.436 7.107 1.00 35.44 N ATOM 2008 CA ARG A1029 55.966 2.694 7.898 1.00 37.85 C ATOM 2009 C ARG A1029 56.107 4.187 8.212 1.00 35.76 C ATOM 2010 O ARG A1029 56.321 4.565 9.368 1.00 35.88 O ATOM 2011 CB ARG A1029 57.210 2.162 7.179 1.00 40.24 C ATOM 2012 CG ARG A1029 58.539 2.457 7.880 1.00 46.36 C ATOM 2013 CD ARG A1029 59.744 1.875 7.125 1.00 54.09 C ATOM 2014 NE ARG A1029 59.753 2.238 5.704 1.00 58.80 N ATOM 2015 CZ ARG A1029 59.655 1.368 4.698 1.00 61.82 C ATOM 2016 NH1 ARG A1029 59.554 0.064 4.941 1.00 65.88 N ATOM 2017 NH2 ARG A1029 59.670 1.800 3.442 1.00 58.03 N ATOM 2018 HE ARG A1029 59.842 3.246 5.464 1.00 0.00 H ATOM 2019 HH12 ARG A1029 59.478 -0.608 4.151 1.00 0.00 H ATOM 2020 HH11 ARG A1029 59.551 -0.284 5.921 1.00 0.00 H ATOM 2021 HH22 ARG A1029 59.594 1.121 2.658 1.00 0.00 H ATOM 2022 HH21 ARG A1029 59.758 2.817 3.243 1.00 0.00 H ATOM 2023 H ARG A1029 54.860 1.995 6.170 1.00 0.00 H ATOM 2024 N THR A1030 55.965 5.026 7.187 1.00 33.33 N ATOM 2025 CA THR A1030 56.177 6.465 7.336 1.00 31.90 C ATOM 2026 C THR A1030 55.100 7.118 8.213 1.00 30.53 C ATOM 2027 O THR A1030 55.423 7.893 9.118 1.00 30.88 O ATOM 2028 CB THR A1030 56.274 7.183 5.963 1.00 31.11 C ATOM 2029 OG1 THR A1030 57.274 6.550 5.153 1.00 32.83 O ATOM 2030 CG2 THR A1030 56.639 8.656 6.138 1.00 30.78 C ATOM 2031 HG1 THR A1030 57.030 5.601 5.010 1.00 0.00 H ATOM 2032 H THR A1030 55.696 4.647 6.256 1.00 0.00 H ATOM 2033 N LEU A1031 53.832 6.800 7.955 1.00 28.78 N ATOM 2034 CA LEU A1031 52.733 7.350 8.754 1.00 27.67 C ATOM 2035 C LEU A1031 52.807 6.906 10.223 1.00 28.97 C ATOM 2036 O LEU A1031 52.482 7.680 11.120 1.00 27.87 O ATOM 2037 CB LEU A1031 51.363 7.009 8.146 1.00 27.39 C ATOM 2038 CG LEU A1031 50.970 7.598 6.783 1.00 28.24 C ATOM 2039 CD1 LEU A1031 49.548 7.168 6.426 1.00 27.17 C ATOM 2040 CD2 LEU A1031 51.090 9.130 6.750 1.00 28.89 C ATOM 2041 H LEU A1031 53.618 6.150 7.172 1.00 0.00 H ATOM 2042 N THR A1032 53.241 5.668 10.455 1.00 30.75 N ATOM 2043 CA THR A1032 53.480 5.168 11.815 1.00 33.19 C ATOM 2044 C THR A1032 54.571 5.979 12.520 1.00 34.25 C ATOM 2045 O THR A1032 54.412 6.361 13.685 1.00 34.92 O ATOM 2046 CB THR A1032 53.831 3.660 11.819 1.00 35.26 C ATOM 2047 OG1 THR A1032 52.716 2.921 11.306 1.00 35.92 O ATOM 2048 CG2 THR A1032 54.150 3.161 13.240 1.00 38.37 C ATOM 2049 HG1 THR A1032 52.523 3.217 10.381 1.00 0.00 H ATOM 2050 H THR A1032 53.416 5.036 9.648 1.00 0.00 H ATOM 2051 N ASP A1033 55.661 6.255 11.808 1.00 34.46 N ATOM 2052 CA ASP A1033 56.726 7.110 12.334 1.00 36.42 C ATOM 2053 C ASP A1033 56.215 8.528 12.618 1.00 34.22 C ATOM 2054 O ASP A1033 56.498 9.088 13.679 1.00 35.42 O ATOM 2055 CB ASP A1033 57.922 7.153 11.375 1.00 37.09 C ATOM 2056 CG ASP A1033 58.812 5.919 11.476 1.00 42.68 C ATOM 2057 OD1 ASP A1033 58.762 5.195 12.497 1.00 42.32 O ATOM 2058 OD2 ASP A1033 59.583 5.681 10.521 1.00 43.79 O ATOM 2059 H ASP A1033 55.758 5.853 10.854 1.00 0.00 H ATOM 2060 N VAL A1034 55.448 9.090 11.683 1.00 32.29 N ATOM 2061 CA VAL A1034 54.917 10.454 11.825 1.00 31.14 C ATOM 2062 C VAL A1034 53.993 10.589 13.048 1.00 31.06 C ATOM 2063 O VAL A1034 54.069 11.585 13.770 1.00 30.17 O ATOM 2064 CB VAL A1034 54.259 10.968 10.508 1.00 29.94 C ATOM 2065 CG1 VAL A1034 53.521 12.287 10.723 1.00 28.57 C ATOM 2066 CG2 VAL A1034 55.328 11.156 9.434 1.00 30.38 C ATOM 2067 H VAL A1034 55.218 8.547 10.827 1.00 0.00 H ATOM 2068 N ARG A1035 53.158 9.575 13.288 1.00 30.82 N ATOM 2069 CA ARG A1035 52.345 9.491 14.516 1.00 33.01 C ATOM 2070 C ARG A1035 53.195 9.708 15.767 1.00 35.21 C ATOM 2071 O ARG A1035 52.742 10.313 16.746 1.00 36.38 O ATOM 2072 CB ARG A1035 51.678 8.116 14.636 1.00 33.40 C ATOM 2073 CG ARG A1035 50.501 7.863 13.722 1.00 32.97 C ATOM 2074 CD ARG A1035 49.814 6.554 14.110 1.00 34.54 C ATOM 2075 NE ARG A1035 49.288 6.624 15.474 1.00 35.53 N ATOM 2076 CZ ARG A1035 48.025 6.906 15.779 1.00 31.95 C ATOM 2077 NH1 ARG A1035 47.129 7.118 14.821 1.00 29.46 N ATOM 2078 NH2 ARG A1035 47.652 6.963 17.048 1.00 33.14 N ATOM 2079 HE ARG A1035 49.947 6.441 16.258 1.00 0.00 H ATOM 2080 HH12 ARG A1035 46.144 7.338 15.070 1.00 0.00 H ATOM 2081 HH11 ARG A1035 47.413 7.064 13.822 1.00 0.00 H ATOM 2082 HH22 ARG A1035 46.665 7.183 17.290 1.00 0.00 H ATOM 2083 HH21 ARG A1035 48.346 6.787 17.802 1.00 0.00 H ATOM 2084 H ARG A1035 53.078 8.815 12.582 1.00 0.00 H ATOM 2085 N ASN A1036 54.423 9.195 15.729 1.00 36.94 N ATOM 2086 CA ASN A1036 55.359 9.316 16.844 1.00 39.51 C ATOM 2087 C ASN A1036 56.326 10.492 16.692 1.00 39.38 C ATOM 2088 O ASN A1036 57.366 10.538 17.353 1.00 40.02 O ATOM 2089 CB ASN A1036 56.121 8.001 17.037 1.00 42.73 C ATOM 2090 CG ASN A1036 55.194 6.826 17.297 1.00 46.24 C ATOM 2091 OD1 ASN A1036 55.162 5.867 16.526 1.00 50.55 O ATOM 2092 ND2 ASN A1036 54.423 6.903 18.378 1.00 47.52 N ATOM 2093 HD22 ASN A1036 54.484 7.733 19.002 1.00 0.00 H ATOM 2094 HD21 ASN A1036 53.760 6.133 18.599 1.00 0.00 H ATOM 2095 H ASN A1036 54.727 8.689 14.873 1.00 0.00 H ATOM 2096 N LEU A1037 55.957 11.442 15.829 1.00 36.91 N ATOM 2097 CA LEU A1037 56.715 12.680 15.597 1.00 37.71 C ATOM 2098 C LEU A1037 58.127 12.437 15.042 1.00 39.43 C ATOM 2099 O LEU A1037 59.058 13.205 15.310 1.00 40.71 O ATOM 2100 CB LEU A1037 56.736 13.570 16.857 1.00 39.14 C ATOM 2101 CG LEU A1037 55.370 13.958 17.446 1.00 39.41 C ATOM 2102 CD1 LEU A1037 55.527 14.594 18.827 1.00 42.28 C ATOM 2103 CD2 LEU A1037 54.597 14.882 16.509 1.00 38.76 C ATOM 2104 H LEU A1037 55.080 11.297 15.288 1.00 0.00 H ATOM 2105 N LYS A1038 58.267 11.361 14.270 1.00 38.98 N ATOM 2106 CA LYS A1038 59.502 11.065 13.548 1.00 41.47 C ATOM 2107 C LYS A1038 59.220 11.310 12.069 1.00 39.43 C ATOM 2108 O LYS A1038 58.464 10.568 11.439 1.00 36.81 O ATOM 2109 CB LYS A1038 59.949 9.619 13.808 1.00 43.23 C ATOM 2110 CG LYS A1038 61.252 9.212 13.131 1.00 48.25 C ATOM 2111 CD LYS A1038 61.810 7.932 13.749 1.00 54.85 C ATOM 2112 CE LYS A1038 63.121 7.508 13.099 1.00 60.05 C ATOM 2113 NZ LYS A1038 62.918 6.947 11.735 1.00 61.77 N ATOM 2114 HZ1 LYS A1038 62.301 6.112 11.793 1.00 0.00 H ATOM 2115 HZ2 LYS A1038 62.474 7.666 11.128 1.00 0.00 H ATOM 2116 HZ3 LYS A1038 63.838 6.673 11.334 1.00 0.00 H ATOM 2117 H LYS A1038 57.465 10.705 14.177 1.00 0.00 H ATOM 2118 N PHE A1039 59.817 12.374 11.540 1.00 40.04 N ATOM 2119 CA PHE A1039 59.534 12.848 10.189 1.00 39.52 C ATOM 2120 C PHE A1039 60.698 12.552 9.255 1.00 41.75 C ATOM 2121 O PHE A1039 61.849 12.557 9.689 1.00 44.04 O ATOM 2122 CB PHE A1039 59.295 14.361 10.199 1.00 38.58 C ATOM 2123 CG PHE A1039 58.062 14.788 10.946 1.00 37.07 C ATOM 2124 CD1 PHE A1039 56.875 15.031 10.263 1.00 34.73 C ATOM 2125 CD2 PHE A1039 58.092 14.973 12.328 1.00 39.09 C ATOM 2126 CE1 PHE A1039 55.726 15.439 10.947 1.00 35.00 C ATOM 2127 CE2 PHE A1039 56.948 15.378 13.019 1.00 37.48 C ATOM 2128 CZ PHE A1039 55.766 15.613 12.325 1.00 34.86 C ATOM 2129 H PHE A1039 60.515 12.890 12.113 1.00 0.00 H ATOM 2130 N PRO A1040 60.405 12.289 7.966 1.00 41.86 N ATOM 2131 CA PRO A1040 61.478 12.215 6.969 1.00 44.31 C ATOM 2132 C PRO A1040 62.188 13.565 6.861 1.00 46.44 C ATOM 2133 O PRO A1040 61.519 14.593 6.745 1.00 44.47 O ATOM 2134 CB PRO A1040 60.733 11.904 5.667 1.00 42.45 C ATOM 2135 CG PRO A1040 59.442 11.298 6.094 1.00 41.29 C ATOM 2136 CD PRO A1040 59.087 11.971 7.386 1.00 39.28 C ATOM 2137 N PRO A1041 63.535 13.568 6.922 1.00 50.55 N ATOM 2138 CA PRO A1041 64.318 14.806 6.860 1.00 52.94 C ATOM 2139 C PRO A1041 63.953 15.726 5.691 1.00 52.74 C ATOM 2140 O PRO A1041 63.918 16.945 5.862 1.00 53.71 O ATOM 2141 CB PRO A1041 65.753 14.298 6.715 1.00 56.26 C ATOM 2142 CG PRO A1041 65.746 13.009 7.460 1.00 56.55 C ATOM 2143 CD PRO A1041 64.394 12.397 7.187 1.00 52.40 C ATOM 2144 N LEU A1042 63.661 15.148 4.527 1.00 51.89 N ATOM 2145 CA LEU A1042 63.354 15.944 3.337 1.00 52.06 C ATOM 2146 C LEU A1042 61.985 16.641 3.408 1.00 49.17 C ATOM 2147 O LEU A1042 61.745 17.622 2.700 1.00 49.63 O ATOM 2148 CB LEU A1042 63.510 15.108 2.056 1.00 52.99 C ATOM 2149 CG LEU A1042 64.930 14.617 1.712 1.00 57.64 C ATOM 2150 CD1 LEU A1042 64.915 13.566 0.600 1.00 59.81 C ATOM 2151 CD2 LEU A1042 65.889 15.761 1.356 1.00 61.42 C ATOM 2152 H LEU A1042 63.651 14.110 4.462 1.00 0.00 H ATOM 2153 N PHE A1043 61.097 16.140 4.265 1.00 46.29 N ATOM 2154 CA PHE A1043 59.831 16.820 4.527 1.00 42.45 C ATOM 2155 C PHE A1043 60.054 18.056 5.402 1.00 42.58 C ATOM 2156 O PHE A1043 59.545 19.137 5.097 1.00 41.58 O ATOM 2157 CB PHE A1043 58.812 15.875 5.176 1.00 40.97 C ATOM 2158 CG PHE A1043 57.566 16.567 5.665 1.00 38.58 C ATOM 2159 CD1 PHE A1043 56.576 16.963 4.771 1.00 35.44 C ATOM 2160 CD2 PHE A1043 57.385 16.828 7.024 1.00 38.60 C ATOM 2161 CE1 PHE A1043 55.424 17.606 5.216 1.00 33.66 C ATOM 2162 CE2 PHE A1043 56.237 17.473 7.481 1.00 34.46 C ATOM 2163 CZ PHE A1043 55.251 17.861 6.578 1.00 35.31 C ATOM 2164 H PHE A1043 61.309 15.248 4.757 1.00 0.00 H ATOM 2165 N THR A1044 60.815 17.885 6.481 1.00 43.17 N ATOM 2166 CA THR A1044 61.095 18.969 7.427 1.00 44.80 C ATOM 2167 C THR A1044 61.820 20.131 6.748 1.00 46.41 C ATOM 2168 O THR A1044 61.602 21.294 7.094 1.00 46.82 O ATOM 2169 CB THR A1044 61.937 18.487 8.641 1.00 46.84 C ATOM 2170 OG1 THR A1044 63.262 18.150 8.213 1.00 49.57 O ATOM 2171 CG2 THR A1044 61.304 17.275 9.302 1.00 45.97 C ATOM 2172 HG1 THR A1044 63.216 17.426 7.539 1.00 0.00 H ATOM 2173 H THR A1044 61.226 16.947 6.659 1.00 0.00 H ATOM 2174 N GLN A1045 62.675 19.799 5.779 1.00 47.49 N ATOM 2175 CA GLN A1045 63.463 20.789 5.045 1.00 49.15 C ATOM 2176 C GLN A1045 62.641 21.527 3.990 1.00 46.97 C ATOM 2177 O GLN A1045 62.724 22.750 3.883 1.00 47.85 O ATOM 2178 CB GLN A1045 64.687 20.133 4.397 1.00 51.45 C ATOM 2179 CG GLN A1045 65.754 19.689 5.391 1.00 56.76 C ATOM 2180 CD GLN A1045 67.010 19.161 4.716 1.00 62.97 C ATOM 2181 OE1 GLN A1045 66.976 18.701 3.570 1.00 64.19 O ATOM 2182 NE2 GLN A1045 68.128 19.225 5.429 1.00 67.05 N ATOM 2183 HE22 GLN A1045 68.110 19.621 6.391 1.00 0.00 H ATOM 2184 HE21 GLN A1045 69.022 18.880 5.026 1.00 0.00 H ATOM 2185 H GLN A1045 62.786 18.794 5.535 1.00 0.00 H ATOM 2186 N LYS A1046 61.850 20.784 3.219 1.00 44.54 N ATOM 2187 CA LYS A1046 61.018 21.372 2.168 1.00 42.82 C ATOM 2188 C LYS A1046 59.850 22.185 2.731 1.00 41.26 C ATOM 2189 O LYS A1046 59.523 23.251 2.203 1.00 40.95 O ATOM 2190 CB LYS A1046 60.496 20.287 1.223 1.00 41.54 C ATOM 2191 CG LYS A1046 59.922 20.815 -0.085 1.00 42.28 C ATOM 2192 CD LYS A1046 59.430 19.680 -0.972 1.00 44.45 C ATOM 2193 CE LYS A1046 58.828 20.207 -2.270 1.00 44.37 C ATOM 2194 NZ LYS A1046 59.852 20.821 -3.161 1.00 48.41 N ATOM 2195 HZ1 LYS A1046 60.305 21.617 -2.669 1.00 0.00 H ATOM 2196 HZ2 LYS A1046 60.570 20.109 -3.404 1.00 0.00 H ATOM 2197 HZ3 LYS A1046 59.394 21.164 -4.029 1.00 0.00 H ATOM 2198 H LYS A1046 61.822 19.755 3.368 1.00 0.00 H ATOM 2199 N TYR A1047 59.234 21.679 3.802 1.00 39.04 N ATOM 2200 CA TYR A1047 58.046 22.304 4.389 1.00 37.25 C ATOM 2201 C TYR A1047 58.200 22.618 5.883 1.00 37.56 C ATOM 2202 O TYR A1047 57.521 22.005 6.713 1.00 35.11 O ATOM 2203 CB TYR A1047 56.809 21.415 4.168 1.00 34.43 C ATOM 2204 CG TYR A1047 56.494 21.108 2.717 1.00 35.04 C ATOM 2205 CD1 TYR A1047 56.154 22.127 1.824 1.00 37.80 C ATOM 2206 CD2 TYR A1047 56.525 19.798 2.239 1.00 33.33 C ATOM 2207 CE1 TYR A1047 55.867 21.851 0.492 1.00 37.05 C ATOM 2208 CE2 TYR A1047 56.233 19.509 0.904 1.00 34.45 C ATOM 2209 CZ TYR A1047 55.907 20.543 0.038 1.00 35.53 C ATOM 2210 OH TYR A1047 55.619 20.272 -1.283 1.00 34.85 O ATOM 2211 HH TYR A1047 54.839 19.664 -1.332 1.00 0.00 H ATOM 2212 H TYR A1047 59.610 20.811 4.234 1.00 0.00 H ATOM 2213 N PRO A1048 59.077 23.586 6.233 1.00 39.61 N ATOM 2214 CA PRO A1048 59.308 23.898 7.647 1.00 40.64 C ATOM 2215 C PRO A1048 58.067 24.408 8.390 1.00 39.58 C ATOM 2216 O PRO A1048 57.897 24.098 9.571 1.00 39.21 O ATOM 2217 CB PRO A1048 60.395 24.984 7.598 1.00 43.85 C ATOM 2218 CG PRO A1048 60.288 25.571 6.231 1.00 43.73 C ATOM 2219 CD PRO A1048 59.907 24.429 5.350 1.00 41.26 C ATOM 2220 N CYS A1049 57.216 25.173 7.706 1.00 38.49 N ATOM 2221 CA CYS A1049 56.008 25.727 8.324 1.00 38.26 C ATOM 2222 C CYS A1049 54.964 24.654 8.612 1.00 35.71 C ATOM 2223 O CYS A1049 54.401 24.607 9.706 1.00 34.62 O ATOM 2224 CB CYS A1049 55.398 26.823 7.452 1.00 38.28 C ATOM 2225 SG CYS A1049 56.423 28.300 7.312 1.00 46.99 S ATOM 2226 H CYS A1049 57.415 25.382 6.707 1.00 0.00 H ATOM 2227 N GLU A1050 54.716 23.801 7.622 1.00 33.67 N ATOM 2228 CA GLU A1050 53.742 22.718 7.747 1.00 32.00 C ATOM 2229 C GLU A1050 54.235 21.652 8.722 1.00 32.01 C ATOM 2230 O GLU A1050 53.440 21.028 9.419 1.00 31.38 O ATOM 2231 CB GLU A1050 53.445 22.098 6.378 1.00 30.69 C ATOM 2232 CG GLU A1050 52.703 23.029 5.407 1.00 31.32 C ATOM 2233 CD GLU A1050 53.608 24.015 4.671 1.00 35.28 C ATOM 2234 OE1 GLU A1050 54.842 24.031 4.894 1.00 35.67 O ATOM 2235 OE2 GLU A1050 53.070 24.791 3.855 1.00 39.71 O ATOM 2236 H GLU A1050 55.234 23.908 6.726 1.00 0.00 H ATOM 2237 N TYR A1051 55.552 21.460 8.766 1.00 33.01 N ATOM 2238 CA TYR A1051 56.180 20.555 9.726 1.00 33.91 C ATOM 2239 C TYR A1051 55.823 20.934 11.168 1.00 34.31 C ATOM 2240 O TYR A1051 55.428 20.071 11.955 1.00 33.82 O ATOM 2241 CB TYR A1051 57.695 20.523 9.493 1.00 35.40 C ATOM 2242 CG TYR A1051 58.551 19.996 10.625 1.00 38.91 C ATOM 2243 CD1 TYR A1051 58.420 18.685 11.089 1.00 39.51 C ATOM 2244 CD2 TYR A1051 59.525 20.806 11.204 1.00 41.98 C ATOM 2245 CE1 TYR A1051 59.232 18.208 12.124 1.00 42.59 C ATOM 2246 CE2 TYR A1051 60.335 20.341 12.230 1.00 45.40 C ATOM 2247 CZ TYR A1051 60.184 19.044 12.686 1.00 45.31 C ATOM 2248 OH TYR A1051 60.996 18.594 13.702 1.00 49.44 O ATOM 2249 HH TYR A1051 60.767 17.654 13.914 1.00 0.00 H ATOM 2250 H TYR A1051 56.156 21.973 8.092 1.00 0.00 H ATOM 2251 N VAL A1052 55.946 22.221 11.493 1.00 34.90 N ATOM 2252 CA VAL A1052 55.569 22.742 12.812 1.00 35.79 C ATOM 2253 C VAL A1052 54.073 22.530 13.086 1.00 33.50 C ATOM 2254 O VAL A1052 53.689 22.106 14.181 1.00 33.08 O ATOM 2255 CB VAL A1052 55.964 24.245 12.969 1.00 37.67 C ATOM 2256 CG1 VAL A1052 55.276 24.884 14.175 1.00 38.10 C ATOM 2257 CG2 VAL A1052 57.479 24.392 13.088 1.00 40.62 C ATOM 2258 H VAL A1052 56.324 22.882 10.784 1.00 0.00 H ATOM 2259 N MET A1053 53.244 22.819 12.084 1.00 31.87 N ATOM 2260 CA MET A1053 51.793 22.643 12.189 1.00 30.72 C ATOM 2261 C MET A1053 51.406 21.191 12.472 1.00 29.18 C ATOM 2262 O MET A1053 50.585 20.923 13.356 1.00 28.58 O ATOM 2263 CB MET A1053 51.098 23.122 10.913 1.00 29.59 C ATOM 2264 CG MET A1053 51.286 24.601 10.608 1.00 33.86 C ATOM 2265 SD MET A1053 50.611 25.042 8.993 1.00 37.84 S ATOM 2266 CE MET A1053 48.859 24.923 9.341 1.00 31.96 C ATOM 2267 H MET A1053 53.641 23.183 11.194 1.00 0.00 H ATOM 2268 N VAL A1054 52.000 20.262 11.724 1.00 28.47 N ATOM 2269 CA VAL A1054 51.737 18.832 11.923 1.00 27.76 C ATOM 2270 C VAL A1054 52.183 18.397 13.326 1.00 28.81 C ATOM 2271 O VAL A1054 51.436 17.718 14.038 1.00 27.28 O ATOM 2272 CB VAL A1054 52.386 17.962 10.805 1.00 28.50 C ATOM 2273 CG1 VAL A1054 52.276 16.477 11.129 1.00 27.04 C ATOM 2274 CG2 VAL A1054 51.728 18.247 9.453 1.00 26.76 C ATOM 2275 H VAL A1054 52.666 20.557 10.982 1.00 0.00 H ATOM 2276 N GLN A1055 53.386 18.814 13.728 1.00 29.95 N ATOM 2277 CA GLN A1055 53.882 18.557 15.080 1.00 32.24 C ATOM 2278 C GLN A1055 52.868 18.944 16.154 1.00 31.88 C ATOM 2279 O GLN A1055 52.590 18.158 17.063 1.00 31.93 O ATOM 2280 CB GLN A1055 55.183 19.316 15.338 1.00 34.20 C ATOM 2281 CG GLN A1055 56.439 18.640 14.841 1.00 38.18 C ATOM 2282 CD GLN A1055 57.689 19.387 15.280 1.00 43.52 C ATOM 2283 OE1 GLN A1055 57.727 20.619 15.258 1.00 44.93 O ATOM 2284 NE2 GLN A1055 58.714 18.644 15.694 1.00 45.79 N ATOM 2285 HE22 GLN A1055 58.637 17.607 15.695 1.00 0.00 H ATOM 2286 HE21 GLN A1055 59.591 19.101 16.016 1.00 0.00 H ATOM 2287 H GLN A1055 53.988 19.337 13.060 1.00 0.00 H ATOM 2288 N ASP A1056 52.321 20.155 16.038 1.00 31.77 N ATOM 2289 CA ASP A1056 51.358 20.677 17.007 1.00 31.79 C ATOM 2290 C ASP A1056 50.055 19.872 17.010 1.00 29.19 C ATOM 2291 O ASP A1056 49.530 19.540 18.075 1.00 29.36 O ATOM 2292 CB ASP A1056 51.074 22.161 16.742 1.00 32.06 C ATOM 2293 CG ASP A1056 52.276 23.055 17.029 1.00 36.51 C ATOM 2294 OD1 ASP A1056 52.280 24.211 16.556 1.00 37.89 O ATOM 2295 OD2 ASP A1056 53.213 22.614 17.731 1.00 38.20 O ATOM 2296 H ASP A1056 52.589 20.750 15.228 1.00 0.00 H ATOM 2297 N MET A1057 49.551 19.562 15.816 1.00 27.26 N ATOM 2298 CA MET A1057 48.315 18.787 15.649 1.00 25.82 C ATOM 2299 C MET A1057 48.435 17.360 16.187 1.00 25.46 C ATOM 2300 O MET A1057 47.449 16.781 16.634 1.00 25.61 O ATOM 2301 CB MET A1057 47.875 18.766 14.178 1.00 23.13 C ATOM 2302 CG MET A1057 47.274 20.078 13.678 1.00 26.50 C ATOM 2303 SD MET A1057 46.670 19.967 11.971 1.00 29.99 S ATOM 2304 CE MET A1057 48.077 20.605 11.096 1.00 30.82 C ATOM 2305 H MET A1057 50.055 19.883 14.965 1.00 0.00 H ATOM 2306 N LEU A1058 49.650 16.815 16.168 1.00 27.05 N ATOM 2307 CA LEU A1058 49.901 15.443 16.621 1.00 27.41 C ATOM 2308 C LEU A1058 50.392 15.326 18.069 1.00 29.78 C ATOM 2309 O LEU A1058 50.894 14.272 18.473 1.00 31.08 O ATOM 2310 CB LEU A1058 50.871 14.731 15.662 1.00 27.70 C ATOM 2311 CG LEU A1058 50.348 14.493 14.240 1.00 26.39 C ATOM 2312 CD1 LEU A1058 51.437 13.853 13.379 1.00 27.87 C ATOM 2313 CD2 LEU A1058 49.083 13.635 14.245 1.00 25.63 C ATOM 2314 H LEU A1058 50.449 17.382 15.820 1.00 0.00 H ATOM 2315 N SER A1059 50.241 16.396 18.850 1.00 30.92 N ATOM 2316 CA SER A1059 50.597 16.356 20.271 1.00 34.26 C ATOM 2317 C SER A1059 49.863 15.193 20.945 1.00 34.35 C ATOM 2318 O SER A1059 48.653 15.038 20.754 1.00 32.64 O ATOM 2319 CB SER A1059 50.231 17.670 20.968 1.00 36.05 C ATOM 2320 OG SER A1059 50.959 18.767 20.438 1.00 39.09 O ATOM 2321 HG SER A1059 50.758 18.859 19.473 1.00 0.00 H ATOM 2322 H SER A1059 49.863 17.276 18.443 1.00 0.00 H ATOM 2323 N PRO A1060 50.591 14.359 21.715 1.00 36.29 N ATOM 2324 CA PRO A1060 49.949 13.290 22.487 1.00 36.96 C ATOM 2325 C PRO A1060 48.875 13.824 23.439 1.00 37.35 C ATOM 2326 O PRO A1060 47.848 13.173 23.633 1.00 38.03 O ATOM 2327 CB PRO A1060 51.109 12.686 23.288 1.00 39.36 C ATOM 2328 CG PRO A1060 52.317 12.990 22.497 1.00 40.36 C ATOM 2329 CD PRO A1060 52.063 14.298 21.803 1.00 38.07 C ATOM 2330 N SER A1061 49.123 14.994 24.024 1.00 38.03 N ATOM 2331 CA SER A1061 48.172 15.652 24.916 1.00 38.22 C ATOM 2332 C SER A1061 47.143 16.424 24.090 1.00 35.90 C ATOM 2333 O SER A1061 47.506 17.334 23.339 1.00 34.81 O ATOM 2334 CB SER A1061 48.908 16.588 25.881 1.00 41.17 C ATOM 2335 OG SER A1061 47.995 17.332 26.673 1.00 45.29 O ATOM 2336 HG SER A1061 48.498 17.926 27.285 1.00 0.00 H ATOM 2337 H SER A1061 50.034 15.460 23.838 1.00 0.00 H ATOM 2338 N PRO A1062 45.851 16.056 24.212 1.00 34.73 N ATOM 2339 CA PRO A1062 44.814 16.706 23.400 1.00 33.35 C ATOM 2340 C PRO A1062 44.718 18.215 23.646 1.00 34.33 C ATOM 2341 O PRO A1062 44.471 18.971 22.703 1.00 32.60 O ATOM 2342 CB PRO A1062 43.525 15.993 23.832 1.00 33.80 C ATOM 2343 CG PRO A1062 43.986 14.677 24.383 1.00 34.50 C ATOM 2344 CD PRO A1062 45.311 14.947 25.018 1.00 35.02 C ATOM 2345 N MET A1063 44.945 18.640 24.892 1.00 36.33 N ATOM 2346 CA MET A1063 44.931 20.063 25.258 1.00 39.35 C ATOM 2347 C MET A1063 45.953 20.901 24.487 1.00 38.92 C ATOM 2348 O MET A1063 45.755 22.101 24.291 1.00 39.61 O ATOM 2349 CB MET A1063 45.169 20.240 26.761 1.00 42.39 C ATOM 2350 CG MET A1063 43.923 20.117 27.612 1.00 49.06 C ATOM 2351 SD MET A1063 44.277 20.381 29.363 1.00 64.78 S ATOM 2352 CE MET A1063 42.631 20.204 30.060 1.00 63.42 C ATOM 2353 H MET A1063 45.139 17.936 25.632 1.00 0.00 H ATOM 2354 N GLU A1064 47.038 20.258 24.057 1.00 38.24 N ATOM 2355 CA GLU A1064 48.142 20.942 23.388 1.00 38.47 C ATOM 2356 C GLU A1064 47.907 21.118 21.889 1.00 35.76 C ATOM 2357 O GLU A1064 48.581 21.925 21.245 1.00 36.17 O ATOM 2358 CB GLU A1064 49.466 20.203 23.635 1.00 40.09 C ATOM 2359 CG GLU A1064 49.898 20.129 25.101 1.00 46.41 C ATOM 2360 CD GLU A1064 50.727 21.322 25.553 1.00 55.45 C ATOM 2361 OE1 GLU A1064 50.709 22.374 24.875 1.00 58.99 O ATOM 2362 OE2 GLU A1064 51.404 21.208 26.600 1.00 60.88 O ATOM 2363 H GLU A1064 47.101 19.230 24.203 1.00 0.00 H ATOM 2364 N ARG A1065 46.955 20.363 21.337 1.00 32.24 N ATOM 2365 CA ARG A1065 46.606 20.482 19.926 1.00 30.07 C ATOM 2366 C ARG A1065 45.829 21.777 19.683 1.00 30.18 C ATOM 2367 O ARG A1065 44.988 22.159 20.499 1.00 30.07 O ATOM 2368 CB ARG A1065 45.782 19.271 19.453 1.00 28.32 C ATOM 2369 CG ARG A1065 46.459 17.931 19.695 1.00 26.95 C ATOM 2370 CD ARG A1065 45.560 16.741 19.319 1.00 24.77 C ATOM 2371 NE ARG A1065 46.043 15.544 20.005 1.00 25.96 N ATOM 2372 CZ ARG A1065 45.276 14.539 20.422 1.00 27.61 C ATOM 2373 NH1 ARG A1065 45.832 13.516 21.061 1.00 25.80 N ATOM 2374 NH2 ARG A1065 43.960 14.554 20.213 1.00 24.69 N ATOM 2375 HE ARG A1065 47.065 15.472 20.181 1.00 0.00 H ATOM 2376 HH12 ARG A1065 45.242 12.726 21.391 1.00 0.00 H ATOM 2377 HH11 ARG A1065 46.858 13.505 21.232 1.00 0.00 H ATOM 2378 HH22 ARG A1065 43.372 13.763 20.544 1.00 0.00 H ATOM 2379 HH21 ARG A1065 43.521 15.357 19.719 1.00 0.00 H ATOM 2380 H ARG A1065 46.449 19.672 21.928 1.00 0.00 H ATOM 2381 N PRO A1066 46.122 22.465 18.567 1.00 30.47 N ATOM 2382 CA PRO A1066 45.412 23.698 18.219 1.00 30.71 C ATOM 2383 C PRO A1066 43.950 23.449 17.862 1.00 29.36 C ATOM 2384 O PRO A1066 43.609 22.368 17.377 1.00 28.63 O ATOM 2385 CB PRO A1066 46.157 24.193 16.977 1.00 31.52 C ATOM 2386 CG PRO A1066 46.811 22.973 16.406 1.00 32.37 C ATOM 2387 CD PRO A1066 47.187 22.150 17.596 1.00 29.82 C ATOM 2388 N GLU A1067 43.102 24.448 18.094 1.00 28.78 N ATOM 2389 CA GLU A1067 41.728 24.418 17.588 1.00 27.48 C ATOM 2390 C GLU A1067 41.739 24.557 16.069 1.00 27.32 C ATOM 2391 O GLU A1067 42.645 25.178 15.503 1.00 27.53 O ATOM 2392 CB GLU A1067 40.896 25.548 18.203 1.00 28.99 C ATOM 2393 CG GLU A1067 40.835 25.543 19.730 1.00 31.70 C ATOM 2394 CD GLU A1067 39.908 24.477 20.309 1.00 36.02 C ATOM 2395 OE1 GLU A1067 39.310 23.694 19.548 1.00 36.10 O ATOM 2396 OE2 GLU A1067 39.777 24.426 21.550 1.00 42.41 O ATOM 2397 H GLU A1067 43.422 25.268 18.647 1.00 0.00 H ATOM 2398 N ALA A1068 40.726 23.992 15.412 1.00 25.18 N ATOM 2399 CA ALA A1068 40.618 24.061 13.956 1.00 24.98 C ATOM 2400 C ALA A1068 40.643 25.503 13.430 1.00 26.63 C ATOM 2401 O ALA A1068 41.248 25.773 12.389 1.00 25.86 O ATOM 2402 CB ALA A1068 39.365 23.332 13.476 1.00 24.08 C ATOM 2403 H ALA A1068 39.992 23.488 15.950 1.00 0.00 H ATOM 2404 N ILE A1069 39.993 26.419 14.148 1.00 27.65 N ATOM 2405 CA ILE A1069 39.977 27.836 13.756 1.00 29.94 C ATOM 2406 C ILE A1069 41.392 28.432 13.666 1.00 31.02 C ATOM 2407 O ILE A1069 41.681 29.230 12.772 1.00 32.38 O ATOM 2408 CB ILE A1069 39.028 28.704 14.660 1.00 32.28 C ATOM 2409 CG1 ILE A1069 38.818 30.109 14.069 1.00 36.76 C ATOM 2410 CG2 ILE A1069 39.535 28.795 16.107 1.00 32.79 C ATOM 2411 CD1 ILE A1069 37.985 30.138 12.784 1.00 38.75 C ATOM 2412 H ILE A1069 39.485 26.124 15.006 1.00 0.00 H ATOM 2413 N ASN A1070 42.272 28.027 14.576 1.00 31.00 N ATOM 2414 CA ASN A1070 43.645 28.527 14.585 1.00 32.80 C ATOM 2415 C ASN A1070 44.490 27.933 13.461 1.00 31.49 C ATOM 2416 O ASN A1070 45.389 28.597 12.937 1.00 32.30 O ATOM 2417 CB ASN A1070 44.287 28.301 15.952 1.00 34.11 C ATOM 2418 CG ASN A1070 43.526 29.001 17.067 1.00 38.54 C ATOM 2419 OD1 ASN A1070 43.127 28.373 18.044 1.00 42.20 O ATOM 2420 ND2 ASN A1070 43.306 30.308 16.916 1.00 42.26 N ATOM 2421 HD22 ASN A1070 43.662 30.801 16.072 1.00 0.00 H ATOM 2422 HD21 ASN A1070 42.779 30.834 17.642 1.00 0.00 H ATOM 2423 H ASN A1070 41.977 27.339 15.298 1.00 0.00 H ATOM 2424 N ILE A1071 44.185 26.691 13.089 1.00 29.02 N ATOM 2425 CA ILE A1071 44.805 26.055 11.931 1.00 28.46 C ATOM 2426 C ILE A1071 44.421 26.819 10.665 1.00 28.75 C ATOM 2427 O ILE A1071 45.297 27.214 9.895 1.00 28.92 O ATOM 2428 CB ILE A1071 44.400 24.567 11.791 1.00 26.67 C ATOM 2429 CG1 ILE A1071 44.927 23.750 12.974 1.00 29.32 C ATOM 2430 CG2 ILE A1071 44.929 23.977 10.478 1.00 27.27 C ATOM 2431 CD1 ILE A1071 44.162 22.444 13.200 1.00 30.44 C ATOM 2432 H ILE A1071 43.483 26.158 13.641 1.00 0.00 H ATOM 2433 N ILE A1072 43.122 27.049 10.458 1.00 28.78 N ATOM 2434 CA ILE A1072 42.666 27.704 9.219 1.00 30.19 C ATOM 2435 C ILE A1072 43.146 29.150 9.077 1.00 31.69 C ATOM 2436 O ILE A1072 43.270 29.660 7.963 1.00 32.63 O ATOM 2437 CB ILE A1072 41.126 27.560 8.957 1.00 30.05 C ATOM 2438 CG1 ILE A1072 40.284 28.298 10.002 1.00 34.85 C ATOM 2439 CG2 ILE A1072 40.735 26.086 8.862 1.00 28.84 C ATOM 2440 CD1 ILE A1072 38.770 28.177 9.769 1.00 37.88 C ATOM 2441 H ILE A1072 42.427 26.764 11.177 1.00 0.00 H ATOM 2442 N GLU A1073 43.453 29.793 10.200 1.00 32.27 N ATOM 2443 CA GLU A1073 43.967 31.164 10.182 1.00 34.23 C ATOM 2444 C GLU A1073 45.486 31.253 9.970 1.00 34.86 C ATOM 2445 O GLU A1073 46.034 32.351 9.884 1.00 36.16 O ATOM 2446 CB GLU A1073 43.532 31.918 11.447 1.00 36.05 C ATOM 2447 CG GLU A1073 42.031 32.191 11.485 1.00 37.56 C ATOM 2448 CD GLU A1073 41.568 32.928 12.732 1.00 44.55 C ATOM 2449 OE1 GLU A1073 42.296 32.936 13.751 1.00 43.45 O ATOM 2450 OE2 GLU A1073 40.455 33.496 12.687 1.00 45.90 O ATOM 2451 H GLU A1073 43.325 29.311 11.112 1.00 0.00 H ATOM 2452 N ASN A1074 46.157 30.103 9.867 1.00 33.42 N ATOM 2453 CA ASN A1074 47.607 30.071 9.646 1.00 34.44 C ATOM 2454 C ASN A1074 48.011 30.747 8.337 1.00 34.79 C ATOM 2455 O ASN A1074 47.305 30.642 7.330 1.00 34.11 O ATOM 2456 CB ASN A1074 48.137 28.634 9.682 1.00 33.55 C ATOM 2457 CG ASN A1074 49.652 28.570 9.820 1.00 36.64 C ATOM 2458 OD1 ASN A1074 50.390 28.937 8.901 1.00 35.78 O ATOM 2459 ND2 ASN A1074 50.121 28.096 10.969 1.00 36.90 N ATOM 2460 HD22 ASN A1074 49.462 27.798 11.716 1.00 0.00 H ATOM 2461 HD21 ASN A1074 51.147 28.023 11.121 1.00 0.00 H ATOM 2462 H ASN A1074 45.637 29.206 9.946 1.00 0.00 H ATOM 2463 N ALA A1075 49.156 31.422 8.365 1.00 36.47 N ATOM 2464 CA ALA A1075 49.657 32.190 7.223 1.00 38.31 C ATOM 2465 C ALA A1075 49.866 31.367 5.948 1.00 36.63 C ATOM 2466 O ALA A1075 49.791 31.916 4.846 1.00 37.27 O ATOM 2467 CB ALA A1075 50.941 32.934 7.599 1.00 39.98 C ATOM 2468 H ALA A1075 49.722 31.404 9.238 1.00 0.00 H ATOM 2469 N VAL A1076 50.113 30.063 6.088 1.00 36.00 N ATOM 2470 CA VAL A1076 50.333 29.202 4.910 1.00 35.10 C ATOM 2471 C VAL A1076 49.129 29.163 3.957 1.00 34.99 C ATOM 2472 O VAL A1076 49.284 28.860 2.769 1.00 34.69 O ATOM 2473 CB VAL A1076 50.794 27.752 5.274 1.00 34.34 C ATOM 2474 CG1 VAL A1076 52.026 27.781 6.176 1.00 37.37 C ATOM 2475 CG2 VAL A1076 49.665 26.932 5.907 1.00 30.93 C ATOM 2476 H VAL A1076 50.151 29.648 7.041 1.00 0.00 H ATOM 2477 N PHE A1077 47.941 29.479 4.475 1.00 34.17 N ATOM 2478 CA PHE A1077 46.708 29.372 3.694 1.00 34.53 C ATOM 2479 C PHE A1077 46.298 30.657 2.984 1.00 37.25 C ATOM 2480 O PHE A1077 45.217 30.724 2.393 1.00 37.96 O ATOM 2481 CB PHE A1077 45.557 28.846 4.568 1.00 32.18 C ATOM 2482 CG PHE A1077 45.825 27.497 5.162 1.00 29.64 C ATOM 2483 CD1 PHE A1077 45.966 26.376 4.343 1.00 27.20 C ATOM 2484 CD2 PHE A1077 45.956 27.344 6.541 1.00 30.46 C ATOM 2485 CE1 PHE A1077 46.225 25.126 4.885 1.00 27.77 C ATOM 2486 CE2 PHE A1077 46.211 26.096 7.095 1.00 28.08 C ATOM 2487 CZ PHE A1077 46.347 24.982 6.267 1.00 28.98 C ATOM 2488 H PHE A1077 47.890 29.810 5.460 1.00 0.00 H ATOM 2489 N GLU A1078 47.159 31.668 3.029 1.00 40.61 N ATOM 2490 CA GLU A1078 46.839 32.961 2.434 1.00 44.22 C ATOM 2491 C GLU A1078 47.132 32.989 0.941 1.00 44.61 C ATOM 2492 O GLU A1078 48.189 32.533 0.497 1.00 44.35 O ATOM 2493 CB GLU A1078 47.580 34.090 3.152 1.00 47.40 C ATOM 2494 CG GLU A1078 46.951 34.479 4.486 1.00 51.08 C ATOM 2495 CD GLU A1078 47.842 35.376 5.325 1.00 56.17 C ATOM 2496 OE1 GLU A1078 47.761 35.284 6.569 1.00 59.14 O ATOM 2497 OE2 GLU A1078 48.622 36.167 4.751 1.00 58.21 O ATOM 2498 H GLU A1078 48.078 31.535 3.497 1.00 0.00 H ATOM 2499 N ASP A1079 46.168 33.513 0.183 1.00 45.87 N ATOM 2500 CA ASP A1079 46.285 33.732 -1.268 1.00 46.86 C ATOM 2501 C ASP A1079 46.739 32.499 -2.066 1.00 44.00 C ATOM 2502 O ASP A1079 47.546 32.620 -2.993 1.00 45.79 O ATOM 2503 CB ASP A1079 47.202 34.929 -1.563 1.00 50.28 C ATOM 2504 CG ASP A1079 46.749 36.206 -0.872 1.00 55.61 C ATOM 2505 OD1 ASP A1079 45.535 36.361 -0.613 1.00 58.53 O ATOM 2506 OD2 ASP A1079 47.616 37.061 -0.592 1.00 61.05 O ATOM 2507 H ASP A1079 45.277 33.784 0.646 1.00 0.00 H ATOM 2508 N LEU A1080 46.215 31.326 -1.707 1.00 40.31 N ATOM 2509 CA LEU A1080 46.538 30.081 -2.413 1.00 36.93 C ATOM 2510 C LEU A1080 46.095 30.159 -3.873 1.00 37.25 C ATOM 2511 O LEU A1080 44.964 30.560 -4.170 1.00 37.06 O ATOM 2512 CB LEU A1080 45.890 28.865 -1.736 1.00 34.85 C ATOM 2513 CG LEU A1080 46.305 28.486 -0.310 1.00 33.41 C ATOM 2514 CD1 LEU A1080 45.345 27.446 0.263 1.00 29.48 C ATOM 2515 CD2 LEU A1080 47.744 27.980 -0.245 1.00 33.33 C ATOM 2516 H LEU A1080 45.557 31.293 -0.902 1.00 0.00 H ATOM 2517 N ASP A1081 47.000 29.802 -4.780 1.00 35.36 N ATOM 2518 CA ASP A1081 46.688 29.773 -6.203 1.00 35.12 C ATOM 2519 C ASP A1081 47.514 28.700 -6.908 1.00 33.93 C ATOM 2520 O ASP A1081 48.605 28.348 -6.457 1.00 32.93 O ATOM 2521 CB ASP A1081 46.928 31.146 -6.844 1.00 38.20 C ATOM 2522 CG ASP A1081 46.227 31.302 -8.189 1.00 40.44 C ATOM 2523 OD1 ASP A1081 46.573 32.247 -8.918 1.00 46.73 O ATOM 2524 OD2 ASP A1081 45.336 30.488 -8.523 1.00 40.79 O ATOM 2525 H ASP A1081 47.955 29.537 -4.465 1.00 0.00 H ATOM 2526 N PHE A1082 46.965 28.173 -8.000 1.00 32.38 N ATOM 2527 CA PHE A1082 47.672 27.231 -8.872 1.00 31.40 C ATOM 2528 C PHE A1082 47.062 27.285 -10.266 1.00 32.53 C ATOM 2529 O PHE A1082 45.882 27.613 -10.398 1.00 32.65 O ATOM 2530 CB PHE A1082 47.644 25.797 -8.308 1.00 28.49 C ATOM 2531 CG PHE A1082 46.262 25.279 -7.967 1.00 26.15 C ATOM 2532 CD1 PHE A1082 45.483 24.636 -8.931 1.00 25.11 C ATOM 2533 CD2 PHE A1082 45.765 25.392 -6.672 1.00 25.11 C ATOM 2534 CE1 PHE A1082 44.216 24.129 -8.613 1.00 24.35 C ATOM 2535 CE2 PHE A1082 44.495 24.892 -6.340 1.00 27.45 C ATOM 2536 CZ PHE A1082 43.719 24.265 -7.317 1.00 26.06 C ATOM 2537 H PHE A1082 45.991 28.442 -8.245 1.00 0.00 H ATOM 2538 N PRO A1083 47.855 26.984 -11.314 1.00 33.88 N ATOM 2539 CA PRO A1083 47.256 27.025 -12.648 1.00 35.66 C ATOM 2540 C PRO A1083 46.106 26.021 -12.753 1.00 34.92 C ATOM 2541 O PRO A1083 46.270 24.851 -12.396 1.00 34.33 O ATOM 2542 CB PRO A1083 48.422 26.651 -13.572 1.00 37.07 C ATOM 2543 CG PRO A1083 49.648 27.034 -12.802 1.00 37.30 C ATOM 2544 CD PRO A1083 49.304 26.713 -11.372 1.00 34.69 C ATOM 2545 N GLY A1084 44.944 26.499 -13.194 1.00 35.82 N ATOM 2546 CA GLY A1084 43.740 25.673 -13.302 1.00 34.98 C ATOM 2547 C GLY A1084 42.735 25.854 -12.175 1.00 34.96 C ATOM 2548 O GLY A1084 41.599 25.382 -12.273 1.00 34.03 O ATOM 2549 H GLY A1084 44.890 27.499 -13.473 1.00 0.00 H ATOM 2550 N LYS A1085 43.151 26.524 -11.099 1.00 35.62 N ATOM 2551 CA LYS A1085 42.282 26.767 -9.942 1.00 36.22 C ATOM 2552 C LYS A1085 41.048 27.558 -10.361 1.00 39.53 C ATOM 2553 O LYS A1085 41.151 28.487 -11.161 1.00 39.02 O ATOM 2554 CB LYS A1085 43.044 27.524 -8.846 1.00 36.17 C ATOM 2555 CG LYS A1085 42.303 27.636 -7.516 1.00 34.27 C ATOM 2556 CD LYS A1085 43.118 28.408 -6.494 1.00 33.64 C ATOM 2557 CE LYS A1085 42.589 28.206 -5.081 1.00 35.51 C ATOM 2558 NZ LYS A1085 41.290 28.903 -4.850 1.00 39.30 N ATOM 2559 HZ1 LYS A1085 41.414 29.924 -5.002 1.00 0.00 H ATOM 2560 HZ2 LYS A1085 40.578 28.536 -5.514 1.00 0.00 H ATOM 2561 HZ3 LYS A1085 40.975 28.733 -3.873 1.00 0.00 H ATOM 2562 H LYS A1085 44.125 26.887 -11.080 1.00 0.00 H ATOM 2563 N THR A1086 39.889 27.182 -9.819 1.00 30.27 N ATOM 2564 CA THR A1086 38.628 27.866 -10.119 1.00 35.08 C ATOM 2565 C THR A1086 38.700 29.339 -9.708 1.00 37.55 C ATOM 2566 O THR A1086 39.056 29.654 -8.570 1.00 38.47 O ATOM 2567 CB THR A1086 37.425 27.164 -9.443 1.00 34.72 C ATOM 2568 OG1 THR A1086 37.277 25.852 -9.995 1.00 35.96 O ATOM 2569 CG2 THR A1086 36.121 27.938 -9.677 1.00 37.06 C ATOM 2570 HG1 THR A1086 36.509 25.399 -9.565 1.00 0.00 H ATOM 2571 H THR A1086 39.880 26.376 -9.161 1.00 0.00 H ATOM 2572 N VAL A1087 38.386 30.223 -10.656 1.00 40.90 N ATOM 2573 CA VAL A1087 38.384 31.668 -10.425 1.00 43.28 C ATOM 2574 C VAL A1087 36.961 32.221 -10.442 1.00 44.51 C ATOM 2575 O VAL A1087 36.263 32.201 -9.425 1.00 46.35 O ATOM 2576 CB VAL A1087 39.225 32.414 -11.484 1.00 43.77 C ATOM 2577 H VAL A1087 38.131 29.870 -11.601 1.00 0.00 H TER 2578 VAL A1087 HETATM 2579 O HOH 1 13.532 12.927 5.257 1.00 30.57 O HETATM 2580 O HOH 2 11.232 13.438 3.147 1.00 45.24 O HETATM 2581 O HOH 3 30.038 21.202 -6.224 1.00 27.01 O HETATM 2582 O HOH 4 26.606 9.652 18.271 1.00 24.71 O HETATM 2583 O HOH 5 40.923 11.057 -8.186 1.00 30.21 O HETATM 2584 O HOH 6 49.530 6.563 -1.278 1.00 19.42 O HETATM 2585 O HOH 7 33.752 6.531 20.395 1.00 16.63 O HETATM 2586 O HOH 8 48.557 2.660 0.104 1.00 23.60 O HETATM 2587 O HOH 9 38.529 14.965 -7.474 1.00 30.28 O HETATM 2588 O HOH 10 20.289 27.130 2.377 1.00 24.56 O HETATM 2589 O HOH 11 49.437 10.154 -12.269 1.00 22.22 O HETATM 2590 O HOH 12 44.180 9.936 -12.742 1.00 40.56 O HETATM 2591 O HOH 13 17.881 -4.364 25.767 1.00 18.48 O HETATM 2592 O HOH 14 37.147 2.333 28.232 1.00 28.26 O HETATM 2593 O HOH 15 51.575 9.224 -10.059 1.00 17.07 O HETATM 2594 O HOH 16 24.028 18.482 4.143 1.00 23.50 O HETATM 2595 O HOH 17 16.888 17.052 -13.210 1.00 17.25 O HETATM 2596 O HOH 18 33.000 24.567 -8.294 1.00 51.06 O HETATM 2597 O HOH 19 38.478 12.202 -7.459 1.00 28.46 O HETATM 2598 O HOH 20 39.321 21.235 -4.534 1.00 22.73 O HETATM 2599 O HOH 21 17.174 19.289 6.650 1.00 20.58 O HETATM 2600 O HOH 22 33.964 15.261 24.806 1.00 20.09 O HETATM 2601 O HOH 23 29.179 9.450 15.978 1.00 29.85 O HETATM 2602 O HOH 24 17.793 9.325 21.865 1.00 24.23 O HETATM 2603 O HOH 25 15.634 9.377 13.472 1.00 34.93 O HETATM 2604 O HOH 26 10.431 9.275 -7.886 1.00 16.92 O HETATM 2605 O HOH 27 44.241 5.916 -7.656 1.00 26.64 O HETATM 2606 O HOH 28 54.421 20.544 -9.780 1.00 21.67 O HETATM 2607 O HOH 29 41.946 13.981 -14.965 1.00 31.98 O HETATM 2608 O HOH 30 37.793 11.684 -10.002 1.00 36.15 O HETATM 2609 O HOH 31 19.341 19.272 0.019 1.00 15.03 O HETATM 2610 O HOH 32 44.835 11.061 -8.643 1.00 17.05 O HETATM 2611 O HOH 33 20.888 19.605 5.825 1.00 22.39 O HETATM 2612 O HOH 34 46.553 12.164 -11.330 1.00 15.56 O HETATM 2613 O HOH 35 13.454 10.015 -1.189 1.00 36.84 O HETATM 2614 O HOH 36 36.845 5.707 23.668 1.00 19.84 O HETATM 2615 O HOH 37 17.594 7.919 19.216 1.00 18.17 O HETATM 2616 O HOH 38 26.169 20.206 3.445 1.00 16.73 O HETATM 2617 O HOH 39 13.792 -1.852 26.170 1.00 18.82 O HETATM 2618 O HOH 40 36.350 22.974 -9.960 1.00 21.74 O HETATM 2619 O HOH 41 8.518 4.008 3.918 1.00 44.58 O HETATM 2620 O HOH 42 36.827 9.813 31.614 1.00 14.55 O HETATM 2621 O HOH 43 16.236 21.668 11.611 1.00 34.11 O HETATM 2622 O HOH 44 10.848 10.345 5.573 1.00 20.65 O HETATM 2623 O HOH 45 37.676 10.441 -13.179 1.00 35.51 O HETATM 2624 O HOH 46 55.405 0.403 -6.307 1.00 17.96 O HETATM 2625 O HOH 47 30.797 7.594 17.377 1.00 24.82 O HETATM 2626 O HOH 48 8.745 6.648 3.460 1.00 49.22 O HETATM 2627 O HOH 49 48.658 14.173 -11.565 1.00 20.26 O HETATM 2628 O HOH 50 13.274 10.518 -14.859 1.00 29.50 O HETATM 2629 O HOH 51 28.290 18.718 22.278 1.00 28.18 O HETATM 2630 O HOH 52 21.879 9.664 23.897 1.00 13.41 O HETATM 2631 O HOH 53 40.498 14.309 23.122 1.00 15.55 O HETATM 2632 O HOH 54 16.459 -5.614 20.189 1.00 27.32 O HETATM 2633 O HOH 55 16.697 10.164 17.800 1.00 23.15 O HETATM 2634 O HOH 56 15.136 13.875 -4.235 1.00 26.85 O HETATM 2635 O HOH 57 28.910 2.883 16.873 1.00 32.21 O HETATM 2636 O HOH 58 34.676 18.335 22.768 1.00 38.16 O HETATM 2637 O HOH 59 23.839 13.021 18.612 1.00 25.90 O HETATM 2638 O HOH 60 43.640 9.235 -10.139 1.00 29.31 O HETATM 2639 O HOH 61 57.262 13.493 -11.991 1.00 37.59 O HETATM 2640 O HOH 62 9.772 6.348 7.003 1.00 23.58 O HETATM 2641 O HOH 63 16.894 16.413 -15.983 1.00 30.84 O HETATM 2642 O HOH 64 25.053 2.498 16.049 1.00 18.80 O HETATM 2643 O HOH 65 39.553 4.491 30.339 1.00 33.41 O HETATM 2644 O HOH 66 50.916 8.248 -3.008 1.00 17.98 O HETATM 2645 O HOH 67 22.372 13.658 -11.497 1.00 22.01 O HETATM 2646 O HOH 68 26.855 -3.770 16.801 1.00 32.27 O HETATM 2647 O HOH 69 36.441 23.865 -3.789 1.00 35.04 O HETATM 2648 O HOH 70 24.015 27.543 1.122 1.00 42.53 O HETATM 2649 O HOH 71 39.542 7.741 30.005 1.00 22.78 O HETATM 2650 O HOH 72 37.375 4.897 21.270 1.00 27.40 O HETATM 2651 O HOH 73 29.899 23.149 -1.884 1.00 28.84 O HETATM 2652 O HOH 74 35.441 24.966 -7.616 1.00 35.43 O HETATM 2653 O HOH 75 27.601 13.897 19.037 1.00 38.75 O HETATM 2654 O HOH 76 24.455 25.996 8.547 1.00 40.69 O HETATM 2655 O HOH 77 26.703 24.525 1.341 1.00 28.07 O HETATM 2656 O HOH 78 45.137 0.237 0.995 1.00 47.17 O HETATM 2657 O HOH 79 23.039 22.535 -0.566 1.00 27.02 O HETATM 2658 O HOH 80 14.091 1.164 16.078 1.00 38.33 O HETATM 2659 O HOH 81 25.654 21.676 1.144 1.00 37.53 O HETATM 2660 O HOH 82 21.679 29.245 3.748 1.00 26.81 O HETATM 2661 O HOH 83 7.990 8.251 -8.578 1.00 24.91 O HETATM 2662 O HOH 84 28.187 -0.991 16.086 1.00 44.16 O HETATM 2663 O HOH 85 22.161 16.332 -6.802 1.00 48.97 O HETATM 2664 O HOH 86 18.047 11.990 21.410 1.00 30.28 O HETATM 2665 O HOH 87 22.191 14.925 18.650 1.00 24.33 O HETATM 2666 O HOH 88 14.608 17.807 -17.801 1.00 37.22 O HETATM 2667 O HOH 89 38.753 11.947 13.609 1.00 16.67 O HETATM 2668 O HOH 90 35.165 23.007 3.126 1.00 10.12 O HETATM 2669 O HOH 91 35.014 11.490 -4.592 1.00 17.14 O HETATM 2670 O HOH 92 23.401 14.012 -6.544 1.00 19.10 O HETATM 2671 O HOH 93 41.495 6.149 4.924 1.00 18.16 O HETATM 2672 O HOH 94 34.997 21.995 0.468 1.00 9.99 O HETATM 2673 O HOH 95 50.790 10.243 0.039 1.00 20.41 O HETATM 2674 O HOH 96 24.087 23.590 9.542 1.00 16.73 O HETATM 2675 O HOH 97 42.179 5.830 11.329 1.00 20.68 O HETATM 2676 O HOH 98 48.759 8.335 0.487 1.00 20.22 O HETATM 2677 O HOH 99 54.430 18.115 -1.808 1.00 26.79 O HETATM 2678 O HOH 100 38.540 23.055 16.849 1.00 18.75 O HETATM 2679 O HOH 101 28.695 16.068 -6.852 1.00 22.18 O HETATM 2680 O HOH 102 32.763 19.807 19.533 1.00 22.66 O HETATM 2681 O HOH 103 20.261 14.090 16.961 1.00 19.81 O HETATM 2682 O HOH 104 40.965 10.619 15.763 1.00 19.39 O HETATM 2683 O HOH 105 36.225 9.434 -9.968 1.00 21.49 O HETATM 2684 O HOH 106 34.581 26.514 8.668 1.00 20.76 O HETATM 2685 O HOH 107 55.817 19.851 -5.859 1.00 20.16 O HETATM 2686 O HOH 108 23.446 18.564 13.988 1.00 24.88 O HETATM 2687 O HOH 109 39.768 8.753 14.258 1.00 22.73 O HETATM 2688 O HOH 110 45.266 7.256 2.233 1.00 27.01 O HETATM 2689 O HOH 111 30.026 9.090 -9.145 1.00 19.97 O HETATM 2690 O HOH 112 51.157 27.087 -7.120 1.00 23.34 O HETATM 2691 O HOH 113 40.300 8.043 11.683 1.00 24.29 O HETATM 2692 O HOH 114 38.485 26.892 1.038 1.00 32.29 O HETATM 2693 O HOH 115 55.479 21.675 -3.817 1.00 19.27 O HETATM 2694 O HOH 116 46.427 4.346 0.277 1.00 23.06 O HETATM 2695 O HOH 117 13.678 -1.920 1.756 1.00 24.62 O HETATM 2696 O HOH 118 38.604 3.960 0.163 1.00 20.72 O HETATM 2697 O HOH 119 35.074 25.689 2.898 1.00 18.03 O HETATM 2698 O HOH 120 56.937 25.738 4.631 1.00 23.47 O HETATM 2699 O HOH 121 28.051 1.610 4.679 1.00 25.43 O HETATM 2700 O HOH 122 38.021 25.630 16.087 1.00 22.29 O HETATM 2701 O HOH 123 63.857 12.292 3.907 1.00 30.20 O HETATM 2702 O HOH 124 38.233 5.825 11.633 1.00 29.56 O HETATM 2703 O HOH 125 46.269 7.236 -0.251 1.00 27.89 O HETATM 2704 O HOH 126 30.100 4.212 8.128 1.00 30.77 O HETATM 2705 O HOH 127 29.171 14.558 16.522 1.00 25.83 O HETATM 2706 O HOH 128 21.538 -2.799 4.407 1.00 21.44 O HETATM 2707 O HOH 129 30.618 11.288 14.682 1.00 24.21 O HETATM 2708 O HOH 130 16.611 -4.776 11.464 1.00 20.43 O HETATM 2709 O HOH 131 33.659 6.086 9.229 1.00 27.73 O HETATM 2710 O HOH 132 33.080 9.566 -10.975 1.00 23.42 O HETATM 2711 O HOH 133 19.469 -1.089 -5.596 1.00 28.07 O HETATM 2712 O HOH 134 34.099 4.916 -4.365 1.00 31.72 O HETATM 2713 O HOH 135 53.877 -2.427 -0.281 1.00 25.47 O HETATM 2714 O HOH 136 35.997 6.688 18.822 1.00 27.60 O HETATM 2715 O HOH 137 54.113 26.914 10.922 1.00 21.89 O HETATM 2716 O HOH 138 29.428 9.293 11.907 1.00 26.51 O HETATM 2717 O HOH 139 27.758 3.788 7.158 1.00 40.05 O HETATM 2718 O HOH 140 26.598 -2.884 -9.154 1.00 22.14 O HETATM 2719 O HOH 141 51.290 6.411 18.445 1.00 34.85 O HETATM 2720 O HOH 142 25.805 14.570 -8.142 1.00 22.46 O HETATM 2721 O HOH 143 51.931 27.459 -1.008 1.00 26.37 O HETATM 2722 O HOH 144 8.348 1.707 1.719 1.00 32.41 O HETATM 2723 O HOH 145 27.704 26.432 6.911 1.00 28.60 O HETATM 2724 O HOH 146 52.092 11.938 18.857 1.00 23.71 O HETATM 2725 O HOH 147 29.872 5.046 11.682 1.00 28.98 O HETATM 2726 O HOH 148 45.164 3.077 6.412 1.00 40.13 O HETATM 2727 O HOH 149 26.035 4.066 14.095 1.00 29.38 O HETATM 2728 O HOH 150 61.686 13.956 13.003 1.00 24.69 O HETATM 2729 O HOH 151 51.762 16.795 24.244 1.00 28.52 O HETATM 2730 O HOH 152 34.232 24.412 -0.393 1.00 23.93 O HETATM 2731 O HOH 153 23.545 21.261 14.200 1.00 29.65 O HETATM 2732 O HOH 154 17.207 -2.242 -0.973 1.00 29.03 O HETATM 2733 O HOH 155 31.824 25.277 -2.596 1.00 26.86 O HETATM 2734 O HOH 156 27.363 14.381 -0.828 1.00 34.61 O HETATM 2735 O HOH 157 34.582 5.056 2.433 1.00 32.30 O HETATM 2736 O HOH 158 53.006 28.980 9.319 1.00 26.14 O HETATM 2737 O HOH 159 39.704 3.191 -2.239 1.00 33.42 O HETATM 2738 O HOH 160 48.521 5.624 19.662 1.00 28.39 O HETATM 2739 O HOH 161 49.697 29.875 -3.757 1.00 23.42 O HETATM 2740 O HOH 162 31.145 11.268 11.490 1.00 32.49 O HETATM 2741 O HOH 163 59.695 22.377 15.513 1.00 24.02 O HETATM 2742 O HOH 164 19.836 16.635 16.145 1.00 33.72 O HETATM 2743 O HOH 165 44.444 26.709 19.286 1.00 27.93 O HETATM 2744 O HOH 166 52.366 27.129 12.978 1.00 26.03 O HETATM 2745 O HOH 167 31.531 27.572 -1.355 1.00 29.31 O HETATM 2746 O HOH 168 7.518 0.041 5.955 1.00 26.92 O HETATM 2747 O HOH 169 50.792 25.284 14.558 1.00 28.06 O HETATM 2748 O HOH 170 28.836 6.937 -10.030 1.00 34.93 O HETATM 2749 O HOH 171 44.825 31.587 6.674 1.00 35.08 O HETATM 2750 O HOH 172 54.067 18.013 19.374 1.00 25.20 O HETATM 2751 O HOH 173 30.689 23.993 -7.037 1.00 37.26 O HETATM 2752 O HOH 174 38.400 29.599 2.168 1.00 41.80 O HETATM 2753 O HOH 175 32.045 27.649 11.579 1.00 31.69 O HETATM 2754 O HOH 176 26.119 13.433 16.534 1.00 42.89 O HETATM 2755 O HOH 177 41.468 20.899 24.566 1.00 29.14 O HETATM 2756 O HOH 178 24.434 22.145 16.691 1.00 29.93 O HETATM 2757 O HOH 179 39.767 3.193 5.589 1.00 47.86 O HETATM 2758 O HOH 180 56.045 22.348 16.884 1.00 26.23 O HETATM 2759 O HOH 181 51.213 29.101 0.904 1.00 28.43 O HETATM 2760 O HOH 182 45.278 0.285 11.588 1.00 40.04 O HETATM 2761 O HOH 183 24.929 13.150 -10.353 1.00 41.08 O HETATM 2762 O HOH 184 43.796 6.044 3.667 1.00 32.72 O HETATM 2763 O HOH 185 39.739 2.424 2.063 1.00 32.44 O HETATM 2764 O HOH 186 33.331 6.589 16.354 1.00 39.08 O HETATM 2765 O HOH 187 22.081 7.250 -14.898 1.00 26.08 O HETATM 2766 O HOH 188 59.758 7.368 8.362 1.00 28.23 O HETATM 2767 O HOH 189 22.345 17.860 16.275 1.00 40.62 O HETATM 2768 O HOH 190 27.068 27.207 4.469 1.00 47.54 O HETATM 2769 O HOH 191 24.203 -5.788 -2.751 1.00 36.45 O HETATM 2770 O HOH 192 44.803 29.311 -13.760 1.00 35.52 O HETATM 2771 O HOH 193 22.609 -4.437 11.140 1.00 32.94 O HETATM 2772 O HOH 194 50.367 32.043 10.829 1.00 23.36 O HETATM 2773 O HOH 195 26.945 -5.435 3.407 1.00 37.86 O HETATM 2774 O HOH 196 19.911 6.128 -16.040 1.00 39.65 O HETATM 2775 O HOH 197 48.469 26.648 15.327 1.00 41.22 O HETATM 2776 O HOH 198 48.243 30.213 -10.978 1.00 32.36 O HETATM 2777 O HOH 199 57.876 5.319 15.083 1.00 29.20 O HETATM 2778 O HOH 200 56.562 27.925 11.605 1.00 29.87 O HETATM 2779 O HOH 201 20.349 23.586 10.801 1.00 42.76 O HETATM 2780 O HOH 202 28.770 28.134 8.527 1.00 37.66 O HETATM 2781 O HOH 203 45.999 11.095 24.182 1.00 27.57 O HETATM 2782 O HOH 204 58.601 12.306 -6.338 1.00 25.66 O HETATM 2783 O HOH 205 32.662 -1.287 -0.353 1.00 31.51 O HETATM 2784 O HOH 206 32.430 9.014 12.302 1.00 41.02 O HETATM 2785 O HOH 207 22.115 -5.353 4.650 1.00 31.97 O HETATM 2786 O HOH 208 50.945 31.312 -5.960 1.00 40.16 O HETATM 2787 O HOH 209 46.172 0.525 8.541 1.00 48.56 O HETATM 2788 O HOH 210 44.045 16.826 27.832 1.00 31.87 O HETATM 2789 O HOH 211 21.515 -5.762 -2.269 1.00 40.58 O HETATM 2790 O HOH 212 35.912 4.182 0.412 1.00 37.23 O HETATM 2791 O HOH 213 28.249 28.897 1.261 1.00 45.85 O HETATM 2792 O HOH 214 43.662 31.149 0.132 1.00 32.70 O HETATM 2793 O HOH 215 59.218 15.920 15.839 1.00 28.84 O HETATM 2794 O HOH 216 44.321 30.401 -11.355 1.00 30.42 O HETATM 2795 O HOH 217 26.344 16.979 -9.066 1.00 37.64 O HETATM 2796 O HOH 218 57.501 2.523 11.524 1.00 26.80 O HETATM 2797 O HOH 219 53.881 26.077 17.328 1.00 29.05 O HETATM 2798 O HOH 220 42.313 24.694 22.912 1.00 35.61 O HETATM 2799 O HOH 221 50.685 9.758 19.890 1.00 33.97 O HETATM 2800 O HOH 222 58.363 2.886 -1.542 1.00 33.53 O HETATM 2801 O HOH 223 12.684 0.712 -9.480 1.00 27.77 O HETATM 2802 O HOH 224 48.055 27.737 12.949 1.00 38.68 O HETATM 2803 O HOH 225 33.536 27.710 4.141 1.00 36.98 O HETATM 2804 O HOH 226 60.379 24.494 11.021 1.00 31.77 O HETATM 2805 O HOH 227 33.655 22.005 20.186 1.00 37.28 O HETATM 2806 O HOH 228 33.411 27.754 6.804 1.00 29.27 O HETATM 2807 O HOH 229 21.909 -7.232 14.712 1.00 32.38 O HETATM 2808 O HOH 230 54.629 29.656 4.328 1.00 35.89 O HETATM 2809 O HOH 231 54.576 11.612 20.161 1.00 28.05 O HETATM 2810 O HOH 232 26.564 9.145 -12.521 1.00 39.14 O HETATM 2811 O HOH 233 58.179 8.589 -1.629 1.00 33.58 O HETATM 2812 O HOH 234 62.161 11.679 2.131 1.00 28.43 O HETATM 2813 O HOH 235 61.488 16.154 14.405 1.00 30.82 O HETATM 2814 O HOH 236 59.246 7.615 2.858 1.00 36.86 O HETATM 2815 O HOH 237 47.588 3.379 14.829 1.00 43.46 O HETATM 2816 O HOH 238 49.609 31.115 -1.266 1.00 38.46 O HETATM 2817 O HOH 239 48.927 3.238 17.042 1.00 33.19 O HETATM 2818 O HOH 240 33.688 5.283 6.322 1.00 42.90 O HETATM 2819 O HOH 241 30.958 28.458 4.298 1.00 41.23 O HETATM 2820 O HOH 242 38.874 3.417 10.662 1.00 39.08 O HETATM 2821 O HOH 243 16.972 -3.109 -3.493 1.00 33.77 O HETATM 2822 O HOH 244 46.548 1.118 5.642 1.00 33.96 O HETATM 2823 O HOH 245 49.044 31.534 13.133 1.00 34.75 O HETATM 2824 O HOH 246 54.336 17.037 21.840 1.00 33.24 O HETATM 2825 O HOH 247 55.764 14.883 22.325 1.00 29.85 O HETATM 2826 O HOH 248 10.148 -9.445 2.646 1.00 33.08 O HETATM 2827 O HOH 249 32.227 3.382 -5.525 1.00 29.33 O HETATM 2828 O HOH 250 40.858 31.106 -7.011 1.00 31.85 O HETATM 2829 O HOH 251 39.095 1.376 18.575 1.00 44.23 O HETATM 2830 O HOH 252 19.953 -7.089 -0.510 1.00 39.75 O HETATM 2831 O HOH 253 27.777 16.589 -1.319 1.00 40.44 O HETATM 2832 O HOH 254 31.137 4.695 -9.687 1.00 43.84 O HETATM 2833 O HOH 255 31.379 27.648 9.034 1.00 34.50 O HETATM 2834 O HOH 256 44.524 32.211 14.884 1.00 32.81 O HETATM 2835 O HOH 257 46.344 31.014 13.295 1.00 34.21 O HETATM 2836 O HOH 258 7.727 -2.314 -4.257 1.00 33.54 O HETATM 2837 O HOH 259 61.091 20.437 16.883 1.00 30.16 O HETATM 2838 O HOH 260 22.881 23.068 12.466 1.00 40.22 O HETATM 2839 O HOH 261 39.904 29.133 -2.353 1.00 39.72 O HETATM 2840 O HOH 262 24.783 15.987 6.128 1.00 35.41 O HETATM 2841 C11 UNN A 263 28.804 12.218 9.105 1.00 -0.03 C HETATM 2842 C12 UNN A 263 29.462 13.451 9.184 1.00 -0.04 C HETATM 2843 C13 UNN A 263 29.010 14.514 8.400 1.00 -0.05 C HETATM 2844 C14 UNN A 263 27.910 14.339 7.559 1.00 -0.04 C HETATM 2845 C15 UNN A 263 27.248 13.107 7.486 1.00 -0.03 C HETATM 2846 C5 UNN A 263 27.697 12.037 8.261 1.00 0.05 C HETATM 2847 C2 UNN A 263 27.071 10.777 8.247 1.00 0.15 C HETATM 2848 N1 UNN A 263 26.562 10.115 9.299 1.00 -0.18 N HETATM 2849 C24 UNN A 263 26.552 10.681 10.663 1.00 0.05 C HETATM 2850 H6 UNN A 263 27.065 11.654 10.660 1.00 0.05 H HETATM 2851 H7 UNN A 263 27.071 9.995 11.349 1.00 0.05 H HETATM 2852 H8 UNN A 263 25.512 10.816 10.996 1.00 0.05 H HETATM 2853 N2 UNN A 263 26.057 9.018 8.975 1.00 -0.04 N HETATM 2854 C4 UNN A 263 25.515 8.119 9.827 1.00 0.18 C HETATM 2855 C6 UNN A 263 24.169 7.759 9.817 1.00 0.00 C HETATM 2856 C7 UNN A 263 23.693 6.806 10.729 1.00 -0.05 C HETATM 2857 C8 UNN A 263 24.561 6.197 11.641 1.00 -0.05 C HETATM 2858 C9 UNN A 263 25.914 6.545 11.656 1.00 -0.05 C HETATM 2859 C10 UNN A 263 26.381 7.497 10.740 1.00 0.00 C HETATM 2860 H13 UNN A 263 27.433 7.759 10.736 1.00 0.07 H HETATM 2861 H12 UNN A 263 26.592 6.085 12.366 1.00 0.06 H HETATM 2862 H11 UNN A 263 24.184 5.455 12.336 1.00 0.07 H HETATM 2863 H10 UNN A 263 22.642 6.539 10.727 1.00 0.06 H HETATM 2864 H9 UNN A 263 23.491 8.215 9.105 1.00 0.07 H HETATM 2865 C3 UNN A 263 26.222 8.814 7.666 1.00 0.36 C HETATM 2866 O1 UNN A 263 25.846 7.807 7.058 1.00 -0.32 O HETATM 2867 C1 UNN A 263 26.862 9.947 7.145 1.00 0.22 C HETATM 2868 C16 UNN A 263 27.306 10.250 5.706 1.00 0.17 C HETATM 2869 O2 UNN A 263 28.265 11.011 5.546 1.00 -0.38 O HETATM 2870 C17 UNN A 263 26.640 9.584 4.477 1.00 0.05 C HETATM 2871 C22 UNN A 263 27.389 9.369 3.302 1.00 0.06 C HETATM 2872 N3 UNN A 263 28.670 9.747 3.248 1.00 -0.33 N HETATM 2873 H15 UNN A 263 29.111 10.191 4.066 1.00 0.18 H HETATM 2874 H16 UNN A 263 29.216 9.594 2.388 1.00 0.18 H HETATM 2875 C21 UNN A 263 26.795 8.765 2.184 1.00 0.01 C HETATM 2876 C20 UNN A 263 25.441 8.385 2.260 1.00 -0.04 C HETATM 2877 C19 UNN A 263 24.698 8.601 3.426 1.00 -0.07 C HETATM 2878 C18 UNN A 263 25.289 9.208 4.534 1.00 -0.06 C HETATM 2879 H17 UNN A 263 24.709 9.388 5.432 1.00 0.06 H HETATM 2880 H18 UNN A 263 23.659 8.295 3.468 1.00 0.05 H HETATM 2881 C33 UNN A 263 24.712 7.734 1.067 1.00 -0.03 C HETATM 2882 H19 UNN A 263 23.669 7.521 1.346 1.00 0.04 H HETATM 2883 H20 UNN A 263 25.218 6.795 0.796 1.00 0.04 H HETATM 2884 H21 UNN A 263 24.729 8.421 0.208 1.00 0.04 H HETATM 2885 C23 UNN A 263 27.495 8.482 0.997 1.00 0.01 C HETATM 2886 C29 UNN A 263 28.100 7.210 0.837 1.00 -0.05 C HETATM 2887 C28 UNN A 263 28.768 6.878 -0.339 1.00 -0.05 C HETATM 2888 C27 UNN A 263 28.845 7.793 -1.387 1.00 0.04 C HETATM 2889 N5 UNN A 263 29.499 7.490 -2.545 1.00 -0.27 N HETATM 2890 C31 UNN A 263 29.545 8.409 -3.543 1.00 0.19 C HETATM 2891 N6 UNN A 263 30.162 8.218 -4.727 1.00 -0.29 N HETATM 2892 C32 UNN A 263 30.966 7.022 -5.057 1.00 0.02 C HETATM 2893 H25 UNN A 263 31.357 7.114 -6.081 1.00 0.05 H HETATM 2894 H26 UNN A 263 30.334 6.124 -4.985 1.00 0.05 H HETATM 2895 H27 UNN A 263 31.805 6.938 -4.350 1.00 0.05 H HETATM 2896 H24 UNN A 263 30.067 8.950 -5.445 1.00 0.19 H HETATM 2897 N4 UNN A 263 28.948 9.600 -3.370 1.00 -0.24 N HETATM 2898 C30 UNN A 263 28.312 9.942 -2.257 1.00 0.03 C HETATM 2899 C26 UNN A 263 28.237 9.038 -1.222 1.00 0.06 C HETATM 2900 C25 UNN A 263 27.564 9.382 -0.041 1.00 0.16 C HETATM 2901 F1 UNN A 263 26.987 10.583 0.114 1.00 -0.18 F HETATM 2902 H28 UNN A 263 27.857 10.921 -2.164 1.00 0.10 H HETATM 2903 H23 UNN A 263 29.230 5.903 -0.440 1.00 0.06 H HETATM 2904 H22 UNN A 263 28.042 6.486 1.641 1.00 0.07 H HETATM 2905 H14 UNN A 263 25.900 10.422 6.904 1.00 0.11 H HETATM 2906 H5 UNN A 263 26.392 12.985 6.832 1.00 0.08 H HETATM 2907 H4 UNN A 263 27.563 15.169 6.954 1.00 0.07 H HETATM 2908 H3 UNN A 263 29.512 15.473 8.444 1.00 0.07 H HETATM 2909 H2 UNN A 263 30.311 13.579 9.845 1.00 0.07 H HETATM 2910 H1 UNN A 263 29.156 11.388 9.707 1.00 0.08 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 800 801 805 806 807 CONECT 805 800 CONECT 806 800 CONECT 807 800 CONECT 1591 1592 1599 1600 1601 CONECT 1599 1591 CONECT 1600 1591 CONECT 1601 1591 CONECT 2841 2842 2846 2910 CONECT 2842 2841 2843 2909 CONECT 2843 2842 2844 2908 CONECT 2844 2843 2845 2907 CONECT 2845 2844 2846 2906 CONECT 2846 2841 2845 2847 CONECT 2847 2846 2848 2867 CONECT 2848 2847 2849 2853 CONECT 2849 2848 2850 2851 2852 CONECT 2850 2849 CONECT 2851 2849 CONECT 2852 2849 CONECT 2853 2848 2854 2865 CONECT 2854 2853 2855 2859 CONECT 2855 2854 2856 2864 CONECT 2856 2855 2857 2863 CONECT 2857 2856 2858 2862 CONECT 2858 2857 2859 2861 CONECT 2859 2854 2858 2860 CONECT 2860 2859 CONECT 2861 2858 CONECT 2862 2857 CONECT 2863 2856 CONECT 2864 2855 CONECT 2865 2853 2866 2867 CONECT 2866 2865 CONECT 2867 2847 2865 2868 2905 CONECT 2868 2867 2869 2870 CONECT 2869 2868 CONECT 2870 2868 2871 2878 CONECT 2871 2870 2872 2875 CONECT 2872 2871 2873 2874 CONECT 2873 2872 CONECT 2874 2872 CONECT 2875 2871 2876 2885 CONECT 2876 2875 2877 2881 CONECT 2877 2876 2878 2880 CONECT 2878 2870 2877 2879 CONECT 2879 2878 CONECT 2880 2877 CONECT 2881 2876 2882 2883 2884 CONECT 2882 2881 CONECT 2883 2881 CONECT 2884 2881 CONECT 2885 2875 2886 2900 CONECT 2886 2885 2887 2904 CONECT 2887 2886 2888 2903 CONECT 2888 2887 2889 2899 CONECT 2889 2888 2890 CONECT 2890 2889 2891 2897 CONECT 2891 2890 2892 2896 CONECT 2892 2891 2893 2894 2895 CONECT 2893 2892 CONECT 2894 2892 CONECT 2895 2892 CONECT 2896 2891 CONECT 2897 2890 2898 CONECT 2898 2897 2899 2902 CONECT 2899 2888 2898 2900 CONECT 2900 2885 2899 2901 CONECT 2901 2900 CONECT 2902 2898 CONECT 2903 2887 CONECT 2904 2886 CONECT 2905 2867 CONECT 2906 2845 CONECT 2907 2844 CONECT 2908 2843 CONECT 2909 2842 CONECT 2910 2841 MASTER 0 0 0 0 0 0 0 0 2907 3 82 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
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Related entries of code: 4x7k
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4g31
RCSB PDB
PDBbind
299aa, >4G31_1|Chain... at 97%
4g34
RCSB PDB
PDBbind
299aa, >4G34_1|Chain... at 97%
4x7h
RCSB PDB
PDBbind
317aa, >4X7H_1|Chain... *
4x7j
RCSB PDB
PDBbind
317aa, >4X7J_1|Chain... at 100%
4x7l
RCSB PDB
PDBbind
317aa, >4X7L_1|Chain... at 100%
4x7n
RCSB PDB
PDBbind
317aa, >4X7N_1|Chain... at 100%
4x7o
RCSB PDB
PDBbind
317aa, >4X7O_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4x7k
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Eukaryotic translation initiation factor 2-alpha kinase 3
Ligand Name
3Z3
EC.Number
E.C.2.7.11.1
Resolution
1.8(Å)
Affinity (Kd/Ki/IC50)
IC50=4nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 1426-1441
Ligand Properties
Formula
C
3
3
H
2
8
FN
6
O
2
Molecular Weight
559.613
Exact Mass
559.226
No. of atoms
70
No. of bonds
75
Polar Surface Area
113.57
LOGP Value
6.35 (
Computed with XLOGP3
)
5.94 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 6
Canonical SMILES
CNc1ncc2c(n1)ccc(c2F)c1c(C)ccc(c1N)C(=O)[C@@H]1C(=[N](N(C1=O)c1ccccc1)C)c1ccccc1
InChI String
InChI=1S/C33H28FN6O2/c1-19-14-15-23(29(35)26(19)22-16-17-25-24(28(22)34)18-37-33(36-2)38-25)31(41)27-30(20-10-6-4-7-11-20)39(3)40(32(27)42)21-12-8-5-9-13-21/h4-18,27H,35H2,1-3H3,(H,36,37,38)/t27-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9NZJ5
Entrez Gene ID
NCBI Entrez Gene ID:
9451
ASD
Information of known allosteric effects of PDB entries
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