Browse entries in the PDBbind-CN Database
HEADER 6KZD_COMPLEX COMPND 6KZD_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 109 THR TYR VAL GLN HIS ILE LYS ARG ARG ASP ILE VAL LEU SEQRES 2 A 109 LYS ARG GLU LEU GLY GLU GLY ALA PHE GLY LYS VAL PHE SEQRES 3 A 109 LEU ALA GLU CYS TYR ASN LEU SER PRO THR LYS ASP LYS SEQRES 4 A 109 MET LEU VAL ALA VAL LYS ALA LEU LYS ASP PRO THR LEU SEQRES 5 A 109 ALA ALA ARG LYS ASP PHE GLN ARG GLU ALA GLU LEU LEU SEQRES 6 A 109 THR ASN LEU GLN HIS GLU HIS ILE VAL LYS PHE TYR GLY SEQRES 7 A 109 VAL CYS GLY ASP GLY ASP PRO LEU ILE MET VAL PHE GLU SEQRES 8 A 109 TYR MET LYS HIS GLY ASP LEU ASN LYS PHE LEU ARG ALA SEQRES 9 A 109 HIS GLY PRO ASP ALA SEQRES 1 A 64 GLY GLU LEU GLY LEU SER GLN MET LEU HIS ILE ALA SER SEQRES 2 A 64 GLN ILE ALA SER GLY MET VAL TYR LEU ALA SER GLN HIS SEQRES 3 A 64 PHE VAL HIS ARG ASP LEU ALA THR ARG ASN CYS LEU VAL SEQRES 4 A 64 GLY ALA ASN LEU LEU VAL LYS ILE GLY ASP PHE GLY MET SEQRES 5 A 64 SER ARG ASP VAL TYR SER THR ASP TYR TYR ARG LEU SEQRES 1 A 109 HIS THR MET LEU PRO ILE ARG TRP MET PRO PRO GLU SER SEQRES 2 A 109 ILE MET TYR ARG LYS PHE THR THR GLU SER ASP VAL TRP SEQRES 3 A 109 SER PHE GLY VAL ILE LEU TRP GLU ILE PHE THR TYR GLY SEQRES 4 A 109 LYS GLN PRO TRP PHE GLN LEU SER ASN THR GLU VAL ILE SEQRES 5 A 109 GLU CYS ILE THR GLN GLY ARG VAL LEU GLU ARG PRO ARG SEQRES 6 A 109 VAL CYS PRO LYS GLU VAL TYR ASP VAL MET LEU GLY CYS SEQRES 7 A 109 TRP GLN ARG GLU PRO GLN GLN ARG LEU ASN ILE LYS GLU SEQRES 8 A 109 ILE TYR LYS ILE LEU HIS ALA LEU GLY LYS ALA THR PRO SEQRES 9 A 109 ILE TYR LEU ASP ILE HET DZ A 6 86 ATOM 1 N THR A 528 -27.294 -18.153 4.067 1.00 24.91 N ATOM 2 CA THR A 528 -26.479 -18.550 2.929 1.00 28.63 C ATOM 3 C THR A 528 -25.954 -19.971 3.086 1.00 18.66 C ATOM 4 O THR A 528 -26.057 -20.573 4.149 1.00 19.28 O ATOM 5 CB THR A 528 -25.272 -17.603 2.733 1.00 37.44 C ATOM 6 OG1 THR A 528 -24.577 -17.440 3.977 1.00 42.60 O ATOM 7 CG2 THR A 528 -25.728 -16.249 2.233 1.00 44.04 C ATOM 8 HG1 THR A 528 -25.192 -17.053 4.649 1.00 0.00 H ATOM 9 HN3 THR A 528 -26.722 -18.199 4.934 1.00 0.00 H ATOM 10 HN2 THR A 528 -28.106 -18.797 4.152 1.00 0.00 H ATOM 11 HN1 THR A 528 -27.634 -17.180 3.926 1.00 0.00 H ATOM 12 N TYR A 529 -25.367 -20.494 2.021 1.00 15.63 N ATOM 13 CA TYR A 529 -24.707 -21.787 2.093 1.00 13.59 C ATOM 14 C TYR A 529 -23.246 -21.637 2.478 1.00 15.23 C ATOM 15 O TYR A 529 -22.532 -20.749 1.984 1.00 13.79 O ATOM 16 CB TYR A 529 -24.806 -22.514 0.761 1.00 9.99 C ATOM 17 CG TYR A 529 -26.207 -22.899 0.377 1.00 7.50 C ATOM 18 CD1 TYR A 529 -27.039 -22.011 -0.310 1.00 10.05 C ATOM 19 CD2 TYR A 529 -26.690 -24.163 0.665 1.00 9.92 C ATOM 20 CE1 TYR A 529 -28.321 -22.390 -0.678 1.00 12.15 C ATOM 21 CE2 TYR A 529 -27.959 -24.546 0.299 1.00 10.22 C ATOM 22 CZ TYR A 529 -28.768 -23.657 -0.372 1.00 12.47 C ATOM 23 OH TYR A 529 -30.037 -24.049 -0.722 1.00 14.27 O ATOM 24 HH TYR A 529 -29.985 -24.838 -1.317 1.00 0.00 H ATOM 25 H TYR A 529 -25.378 -19.973 1.121 1.00 0.00 H ATOM 26 N VAL A 530 -22.796 -22.526 3.350 1.00 12.00 N ATOM 27 CA VAL A 530 -21.416 -22.516 3.815 1.00 9.98 C ATOM 28 C VAL A 530 -20.694 -23.725 3.240 1.00 10.62 C ATOM 29 O VAL A 530 -21.274 -24.805 3.166 1.00 12.50 O ATOM 30 CB VAL A 530 -21.361 -22.539 5.361 1.00 11.04 C ATOM 31 CG1 VAL A 530 -19.934 -22.503 5.846 1.00 14.46 C ATOM 32 CG2 VAL A 530 -22.125 -21.360 5.905 1.00 13.81 C ATOM 33 H VAL A 530 -23.446 -23.252 3.713 1.00 0.00 H ATOM 34 N GLN A 531 -19.444 -23.552 2.823 1.00 9.97 N ATOM 35 CA GLN A 531 -18.673 -24.682 2.320 1.00 9.24 C ATOM 36 C GLN A 531 -18.522 -25.734 3.409 1.00 10.73 C ATOM 37 O GLN A 531 -18.255 -25.408 4.569 1.00 10.04 O ATOM 38 CB GLN A 531 -17.296 -24.243 1.815 1.00 16.42 C ATOM 39 CG GLN A 531 -16.481 -25.396 1.215 1.00 22.98 C ATOM 40 CD GLN A 531 -15.318 -24.936 0.332 1.00 37.78 C ATOM 41 OE1 GLN A 531 -15.222 -23.767 -0.037 1.00 46.95 O ATOM 42 NE2 GLN A 531 -14.430 -25.866 -0.007 1.00 42.36 N ATOM 43 HE22 GLN A 531 -14.548 -26.844 0.327 1.00 0.00 H ATOM 44 HE21 GLN A 531 -13.617 -25.615 -0.606 1.00 0.00 H ATOM 45 H GLN A 531 -19.014 -22.606 2.856 1.00 0.00 H ATOM 46 N HIS A 532 -18.698 -26.989 3.009 1.00 12.75 N ATOM 47 CA HIS A 532 -18.684 -28.139 3.905 1.00 14.10 C ATOM 48 C HIS A 532 -17.333 -28.828 3.835 1.00 13.22 C ATOM 49 O HIS A 532 -16.943 -29.318 2.782 1.00 12.55 O ATOM 50 CB HIS A 532 -19.817 -29.099 3.500 1.00 10.84 C ATOM 51 CG HIS A 532 -19.938 -30.331 4.344 1.00 13.63 C ATOM 52 ND1 HIS A 532 -20.930 -31.270 4.134 1.00 20.22 N ATOM 53 CD2 HIS A 532 -19.214 -30.784 5.394 1.00 18.61 C ATOM 54 CE1 HIS A 532 -20.803 -32.247 5.012 1.00 22.11 C ATOM 55 NE2 HIS A 532 -19.765 -31.979 5.787 1.00 21.88 N ATOM 56 H HIS A 532 -18.855 -27.161 1.995 1.00 0.00 H ATOM 57 N ILE A 533 -16.615 -28.862 4.954 1.00 8.82 N ATOM 58 CA ILE A 533 -15.310 -29.519 5.007 1.00 9.04 C ATOM 59 C ILE A 533 -15.460 -30.839 5.740 1.00 12.35 C ATOM 60 O ILE A 533 -16.163 -30.912 6.746 1.00 11.62 O ATOM 61 CB ILE A 533 -14.284 -28.598 5.684 1.00 13.60 C ATOM 62 CG1 ILE A 533 -14.145 -27.325 4.834 1.00 16.04 C ATOM 63 CG2 ILE A 533 -12.929 -29.293 5.865 1.00 12.35 C ATOM 64 CD1 ILE A 533 -13.289 -26.265 5.430 1.00 25.57 C ATOM 65 H ILE A 533 -16.991 -28.410 5.812 1.00 0.00 H ATOM 66 N LYS A 534 -14.858 -31.900 5.216 1.00 13.86 N ATOM 67 CA LYS A 534 -14.980 -33.198 5.861 1.00 13.74 C ATOM 68 C LYS A 534 -14.021 -33.299 7.038 1.00 12.08 C ATOM 69 O LYS A 534 -12.864 -32.891 6.933 1.00 10.23 O ATOM 70 CB LYS A 534 -14.707 -34.329 4.869 1.00 12.24 C ATOM 71 CG LYS A 534 -15.611 -34.319 3.629 1.00 19.62 C ATOM 72 CD LYS A 534 -17.060 -34.580 3.976 1.00 27.61 C ATOM 73 CE LYS A 534 -17.258 -35.962 4.577 1.00 31.00 C ATOM 74 NZ LYS A 534 -18.658 -36.122 5.065 1.00 30.90 N ATOM 75 HZ1 LYS A 534 -18.854 -35.405 5.792 1.00 0.00 H ATOM 76 HZ2 LYS A 534 -19.317 -36.001 4.270 1.00 0.00 H ATOM 77 HZ3 LYS A 534 -18.775 -37.072 5.472 1.00 0.00 H ATOM 78 H LYS A 534 -14.299 -31.803 4.344 1.00 0.00 H ATOM 79 N ARG A 535 -14.497 -33.857 8.149 1.00 9.83 N ATOM 80 CA ARG A 535 -13.663 -34.025 9.331 1.00 12.33 C ATOM 81 C ARG A 535 -12.411 -34.828 9.042 1.00 11.62 C ATOM 82 O ARG A 535 -11.343 -34.557 9.606 1.00 11.97 O ATOM 83 CB ARG A 535 -14.460 -34.707 10.445 1.00 16.18 C ATOM 84 CG ARG A 535 -15.447 -33.780 11.101 1.00 21.18 C ATOM 85 CD ARG A 535 -16.444 -34.528 11.982 1.00 18.67 C ATOM 86 NE ARG A 535 -17.524 -33.621 12.347 1.00 16.25 N ATOM 87 CZ ARG A 535 -17.495 -32.819 13.404 1.00 14.14 C ATOM 88 NH1 ARG A 535 -16.454 -32.829 14.223 1.00 14.69 N ATOM 89 NH2 ARG A 535 -18.517 -32.011 13.639 1.00 16.52 N ATOM 90 HE ARG A 535 -18.370 -33.601 11.742 1.00 0.00 H ATOM 91 HH12 ARG A 535 -16.437 -32.198 15.050 1.00 0.00 H ATOM 92 HH11 ARG A 535 -15.654 -33.468 14.039 1.00 0.00 H ATOM 93 HH22 ARG A 535 -18.501 -31.380 14.465 1.00 0.00 H ATOM 94 HH21 ARG A 535 -19.335 -32.008 12.997 1.00 0.00 H ATOM 95 H ARG A 535 -15.485 -34.180 8.173 1.00 0.00 H ATOM 96 N ARG A 536 -12.543 -35.804 8.150 1.00 11.13 N ATOM 97 CA ARG A 536 -11.426 -36.690 7.822 1.00 13.86 C ATOM 98 C ARG A 536 -10.294 -35.940 7.154 1.00 16.61 C ATOM 99 O ARG A 536 -9.156 -36.416 7.114 1.00 16.89 O ATOM 100 CB ARG A 536 -11.882 -37.831 6.903 1.00 17.33 C ATOM 101 CG ARG A 536 -12.339 -37.385 5.529 1.00 27.35 C ATOM 102 CD ARG A 536 -12.652 -38.566 4.619 1.00 32.48 C ATOM 103 NE ARG A 536 -13.215 -38.113 3.350 1.00 38.41 N ATOM 104 CZ ARG A 536 -13.751 -38.912 2.436 1.00 49.43 C ATOM 105 NH1 ARG A 536 -14.246 -38.399 1.318 1.00 52.90 N ATOM 106 NH2 ARG A 536 -13.799 -40.221 2.639 1.00 59.67 N ATOM 107 HE ARG A 536 -13.194 -37.093 3.148 1.00 0.00 H ATOM 108 HH12 ARG A 536 -14.666 -39.024 0.601 1.00 0.00 H ATOM 109 HH11 ARG A 536 -14.214 -37.372 1.158 1.00 0.00 H ATOM 110 HH22 ARG A 536 -14.220 -40.844 1.920 1.00 0.00 H ATOM 111 HH21 ARG A 536 -13.416 -40.625 3.517 1.00 0.00 H ATOM 112 H ARG A 536 -13.458 -35.941 7.676 1.00 0.00 H ATOM 113 N ASP A 537 -10.602 -34.770 6.611 1.00 12.52 N ATOM 114 CA ASP A 537 -9.604 -34.024 5.856 1.00 10.52 C ATOM 115 C ASP A 537 -8.769 -33.092 6.718 1.00 15.32 C ATOM 116 O ASP A 537 -7.838 -32.462 6.226 1.00 19.01 O ATOM 117 CB ASP A 537 -10.289 -33.247 4.734 1.00 12.95 C ATOM 118 CG ASP A 537 -10.652 -34.148 3.566 1.00 21.76 C ATOM 119 OD1 ASP A 537 -9.954 -35.168 3.396 1.00 24.20 O ATOM 120 OD2 ASP A 537 -11.618 -33.850 2.835 1.00 22.35 O ATOM 121 H ASP A 537 -11.561 -34.383 6.725 1.00 0.00 H ATOM 122 N ILE A 538 -9.091 -33.024 8.007 1.00 13.05 N ATOM 123 CA ILE A 538 -8.403 -32.116 8.916 1.00 10.80 C ATOM 124 C ILE A 538 -7.498 -32.864 9.875 1.00 16.78 C ATOM 125 O ILE A 538 -7.930 -33.802 10.544 1.00 16.84 O ATOM 126 CB ILE A 538 -9.380 -31.288 9.750 1.00 12.07 C ATOM 127 CG1 ILE A 538 -10.279 -30.452 8.848 1.00 15.22 C ATOM 128 CG2 ILE A 538 -8.601 -30.395 10.722 1.00 12.49 C ATOM 129 CD1 ILE A 538 -11.421 -29.811 9.595 1.00 20.65 C ATOM 130 H ILE A 538 -9.850 -33.632 8.374 1.00 0.00 H ATOM 131 N VAL A 539 -6.241 -32.437 9.927 1.00 11.78 N ATOM 132 CA VAL A 539 -5.262 -32.990 10.852 1.00 15.58 C ATOM 133 C VAL A 539 -4.733 -31.900 11.765 1.00 15.61 C ATOM 134 O VAL A 539 -4.066 -30.988 11.292 1.00 17.86 O ATOM 135 CB VAL A 539 -4.079 -33.623 10.102 1.00 22.14 C ATOM 136 CG1 VAL A 539 -3.129 -34.278 11.076 1.00 23.50 C ATOM 137 CG2 VAL A 539 -4.583 -34.624 9.080 1.00 25.36 C ATOM 138 H VAL A 539 -5.945 -31.678 9.281 1.00 0.00 H ATOM 139 N LEU A 540 -5.023 -31.993 13.060 1.00 13.09 N ATOM 140 CA LEU A 540 -4.559 -30.989 14.019 1.00 13.31 C ATOM 141 C LEU A 540 -3.069 -31.104 14.266 1.00 16.35 C ATOM 142 O LEU A 540 -2.527 -32.207 14.332 1.00 17.43 O ATOM 143 CB LEU A 540 -5.308 -31.117 15.345 1.00 19.08 C ATOM 144 CG LEU A 540 -6.827 -31.014 15.249 1.00 20.46 C ATOM 145 CD1 LEU A 540 -7.425 -31.068 16.642 1.00 26.91 C ATOM 146 CD2 LEU A 540 -7.246 -29.736 14.520 1.00 16.89 C ATOM 147 H LEU A 540 -5.591 -32.796 13.398 1.00 0.00 H ATOM 148 N LYS A 541 -2.402 -29.964 14.410 1.00 16.15 N ATOM 149 CA LYS A 541 -0.955 -29.980 14.592 1.00 23.88 C ATOM 150 C LYS A 541 -0.536 -29.373 15.918 1.00 27.22 C ATOM 151 O LYS A 541 0.324 -29.912 16.615 1.00 26.37 O ATOM 152 CB LYS A 541 -0.266 -29.243 13.447 1.00 22.37 C ATOM 153 CG LYS A 541 -0.438 -29.918 12.105 1.00 29.24 C ATOM 154 CD LYS A 541 0.181 -31.308 12.106 1.00 40.54 C ATOM 155 CE LYS A 541 -0.251 -32.103 10.883 1.00 43.00 C ATOM 156 NZ LYS A 541 0.556 -33.346 10.690 1.00 33.70 N ATOM 157 HZ1 LYS A 541 1.557 -33.092 10.569 1.00 0.00 H ATOM 158 HZ2 LYS A 541 0.451 -33.959 11.523 1.00 0.00 H ATOM 159 HZ3 LYS A 541 0.220 -33.848 9.844 1.00 0.00 H ATOM 160 H LYS A 541 -2.913 -29.058 14.393 1.00 0.00 H ATOM 161 N ARG A 542 -1.146 -28.247 16.264 1.00 20.03 N ATOM 162 CA ARG A 542 -0.757 -27.516 17.446 1.00 23.11 C ATOM 163 C ARG A 542 -1.881 -26.619 17.930 1.00 23.98 C ATOM 164 O ARG A 542 -2.562 -25.984 17.131 1.00 19.55 O ATOM 165 CB ARG A 542 0.498 -26.687 17.150 1.00 29.25 C ATOM 166 CG ARG A 542 1.204 -26.165 18.372 1.00 29.41 C ATOM 167 CD ARG A 542 2.708 -26.118 18.141 1.00 28.25 C ATOM 168 NE ARG A 542 3.061 -25.318 16.974 1.00 35.59 N ATOM 169 CZ ARG A 542 3.848 -25.739 15.990 1.00 34.33 C ATOM 170 NH1 ARG A 542 4.122 -24.940 14.969 1.00 35.01 N ATOM 171 NH2 ARG A 542 4.363 -26.957 16.026 1.00 32.72 N ATOM 172 HE ARG A 542 2.672 -24.356 16.908 1.00 0.00 H ATOM 173 HH12 ARG A 542 4.738 -25.272 14.200 1.00 0.00 H ATOM 174 HH11 ARG A 542 3.721 -23.981 14.937 1.00 0.00 H ATOM 175 HH22 ARG A 542 4.979 -27.284 15.254 1.00 0.00 H ATOM 176 HH21 ARG A 542 4.152 -27.587 16.826 1.00 0.00 H ATOM 177 H ARG A 542 -1.920 -27.884 15.672 1.00 0.00 H ATOM 178 N GLU A 543 -2.071 -26.571 19.242 1.00 19.03 N ATOM 179 CA GLU A 543 -3.062 -25.691 19.843 1.00 18.53 C ATOM 180 C GLU A 543 -2.533 -24.263 19.952 1.00 18.89 C ATOM 181 O GLU A 543 -1.402 -24.054 20.374 1.00 17.78 O ATOM 182 CB GLU A 543 -3.460 -26.207 21.220 1.00 21.28 C ATOM 183 CG GLU A 543 -4.467 -25.318 21.925 1.00 26.25 C ATOM 184 CD GLU A 543 -4.867 -25.862 23.276 1.00 37.67 C ATOM 185 OE1 GLU A 543 -4.480 -27.009 23.593 1.00 44.99 O ATOM 186 OE2 GLU A 543 -5.565 -25.142 24.016 1.00 43.35 O ATOM 187 H GLU A 543 -1.495 -27.179 19.859 1.00 0.00 H ATOM 188 N LEU A 544 -3.354 -23.279 19.589 1.00 17.75 N ATOM 189 CA LEU A 544 -2.914 -21.882 19.626 1.00 18.55 C ATOM 190 C LEU A 544 -3.527 -21.107 20.786 1.00 18.06 C ATOM 191 O LEU A 544 -2.898 -20.204 21.331 1.00 27.33 O ATOM 192 CB LEU A 544 -3.241 -21.188 18.299 1.00 17.55 C ATOM 193 CG LEU A 544 -2.592 -21.801 17.050 1.00 21.55 C ATOM 194 CD1 LEU A 544 -3.050 -21.072 15.790 1.00 30.74 C ATOM 195 CD2 LEU A 544 -1.082 -21.799 17.140 1.00 33.35 C ATOM 196 H LEU A 544 -4.319 -23.505 19.275 1.00 0.00 H ATOM 197 N GLY A 545 -4.754 -21.445 21.165 1.00 18.98 N ATOM 198 CA GLY A 545 -5.400 -20.770 22.273 1.00 22.54 C ATOM 199 C GLY A 545 -6.846 -21.182 22.427 1.00 32.65 C ATOM 200 O GLY A 545 -7.329 -22.051 21.697 1.00 28.40 O ATOM 201 H GLY A 545 -5.257 -22.203 20.661 1.00 0.00 H ATOM 202 N GLU A 546 -7.537 -20.555 23.377 1.00 27.85 N ATOM 203 CA GLU A 546 -8.951 -20.820 23.600 1.00 33.17 C ATOM 204 C GLU A 546 -9.710 -19.535 23.914 1.00 42.22 C ATOM 205 O GLU A 546 -9.302 -18.745 24.772 1.00 37.12 O ATOM 206 CB GLU A 546 -9.137 -21.834 24.731 1.00 40.61 C ATOM 207 H GLU A 546 -7.053 -19.856 23.976 1.00 0.00 H ATOM 208 N GLY A 547 -10.814 -19.326 23.204 1.00 39.49 N ATOM 209 CA GLY A 547 -11.664 -18.177 23.448 1.00 39.64 C ATOM 210 C GLY A 547 -12.989 -18.597 24.053 1.00 41.42 C ATOM 211 O GLY A 547 -13.132 -19.707 24.572 1.00 37.31 O ATOM 212 H GLY A 547 -11.074 -20.001 22.457 1.00 0.00 H ATOM 213 N ALA A 548 -13.969 -17.706 23.989 1.00 46.91 N ATOM 214 CA ALA A 548 -15.301 -18.030 24.474 1.00 51.02 C ATOM 215 C ALA A 548 -15.923 -19.113 23.599 1.00 56.07 C ATOM 216 O ALA A 548 -16.807 -19.849 24.040 1.00 54.87 O ATOM 217 CB ALA A 548 -16.181 -16.785 24.498 1.00 54.56 C ATOM 218 H ALA A 548 -13.783 -16.765 23.587 1.00 0.00 H ATOM 219 N PHE A 549 -15.438 -19.215 22.363 1.00 52.46 N ATOM 220 CA PHE A 549 -16.034 -20.102 21.375 1.00 49.90 C ATOM 221 C PHE A 549 -15.151 -21.306 21.020 1.00 50.20 C ATOM 222 O PHE A 549 -15.175 -21.773 19.886 1.00 53.31 O ATOM 223 CB PHE A 549 -16.366 -19.309 20.107 1.00 44.44 C ATOM 224 H PHE A 549 -14.610 -18.645 22.096 1.00 0.00 H ATOM 225 N GLY A 550 -14.371 -21.798 21.981 1.00 46.51 N ATOM 226 CA GLY A 550 -13.609 -23.025 21.793 1.00 43.86 C ATOM 227 C GLY A 550 -12.145 -22.844 21.428 1.00 36.52 C ATOM 228 O GLY A 550 -11.677 -21.721 21.226 1.00 43.03 O ATOM 229 H GLY A 550 -14.304 -21.294 22.888 1.00 0.00 H ATOM 230 N LYS A 551 -11.425 -23.962 21.337 1.00 22.10 N ATOM 231 CA LYS A 551 -9.992 -23.950 21.057 1.00 18.78 C ATOM 232 C LYS A 551 -9.669 -23.671 19.591 1.00 16.69 C ATOM 233 O LYS A 551 -10.391 -24.083 18.691 1.00 18.20 O ATOM 234 CB LYS A 551 -9.356 -25.289 21.444 1.00 19.96 C ATOM 235 CG LYS A 551 -9.270 -25.592 22.931 1.00 29.08 C ATOM 236 CD LYS A 551 -8.853 -27.058 23.134 1.00 28.35 C ATOM 237 CE LYS A 551 -8.034 -27.260 24.399 1.00 38.36 C ATOM 238 NZ LYS A 551 -8.649 -26.612 25.587 1.00 44.93 N ATOM 239 HZ1 LYS A 551 -8.731 -25.589 25.419 1.00 0.00 H ATOM 240 HZ2 LYS A 551 -9.594 -27.015 25.750 1.00 0.00 H ATOM 241 HZ3 LYS A 551 -8.051 -26.780 26.421 1.00 0.00 H ATOM 242 H LYS A 551 -11.902 -24.877 21.470 1.00 0.00 H ATOM 243 N VAL A 552 -8.550 -23.002 19.364 1.00 15.63 N ATOM 244 CA VAL A 552 -8.072 -22.758 18.013 1.00 14.00 C ATOM 245 C VAL A 552 -6.753 -23.490 17.796 1.00 14.97 C ATOM 246 O VAL A 552 -5.861 -23.433 18.642 1.00 16.53 O ATOM 247 CB VAL A 552 -7.907 -21.256 17.750 1.00 17.07 C ATOM 248 CG1 VAL A 552 -7.249 -21.008 16.399 1.00 18.51 C ATOM 249 CG2 VAL A 552 -9.272 -20.565 17.828 1.00 17.51 C ATOM 250 H VAL A 552 -8.000 -22.643 20.170 1.00 0.00 H ATOM 251 N PHE A 553 -6.651 -24.182 16.663 1.00 12.87 N ATOM 252 CA PHE A 553 -5.500 -25.020 16.320 1.00 13.15 C ATOM 253 C PHE A 553 -4.871 -24.638 14.997 1.00 17.20 C ATOM 254 O PHE A 553 -5.569 -24.259 14.056 1.00 15.57 O ATOM 255 CB PHE A 553 -5.905 -26.496 16.214 1.00 12.44 C ATOM 256 CG PHE A 553 -6.467 -27.072 17.476 1.00 13.52 C ATOM 257 CD1 PHE A 553 -7.817 -26.943 17.770 1.00 17.33 C ATOM 258 CD2 PHE A 553 -5.651 -27.755 18.361 1.00 18.52 C ATOM 259 CE1 PHE A 553 -8.339 -27.476 18.930 1.00 22.39 C ATOM 260 CE2 PHE A 553 -6.167 -28.288 19.518 1.00 17.78 C ATOM 261 CZ PHE A 553 -7.509 -28.152 19.807 1.00 17.88 C ATOM 262 H PHE A 553 -7.435 -24.124 15.982 1.00 0.00 H ATOM 263 N LEU A 554 -3.552 -24.772 14.920 1.00 16.79 N ATOM 264 CA LEU A 554 -2.886 -24.908 13.635 1.00 13.12 C ATOM 265 C LEU A 554 -3.158 -26.322 13.143 1.00 12.81 C ATOM 266 O LEU A 554 -2.988 -27.292 13.890 1.00 15.78 O ATOM 267 CB LEU A 554 -1.376 -24.662 13.753 1.00 13.68 C ATOM 268 CG LEU A 554 -0.525 -24.974 12.518 1.00 18.73 C ATOM 269 CD1 LEU A 554 -0.952 -24.133 11.327 1.00 18.31 C ATOM 270 CD2 LEU A 554 0.965 -24.746 12.830 1.00 20.91 C ATOM 271 H LEU A 554 -2.987 -24.780 15.793 1.00 0.00 H ATOM 272 N ALA A 555 -3.597 -26.447 11.902 1.00 10.79 N ATOM 273 CA ALA A 555 -3.933 -27.752 11.368 1.00 13.71 C ATOM 274 C ALA A 555 -3.520 -27.835 9.918 1.00 12.09 C ATOM 275 O ALA A 555 -3.162 -26.828 9.310 1.00 14.34 O ATOM 276 CB ALA A 555 -5.428 -28.026 11.518 1.00 10.24 C ATOM 277 H ALA A 555 -3.702 -25.602 11.304 1.00 0.00 H ATOM 278 N GLU A 556 -3.562 -29.040 9.366 1.00 12.63 N ATOM 279 CA GLU A 556 -3.468 -29.206 7.927 1.00 14.96 C ATOM 280 C GLU A 556 -4.824 -29.666 7.415 1.00 13.61 C ATOM 281 O GLU A 556 -5.564 -30.353 8.122 1.00 16.51 O ATOM 282 CB GLU A 556 -2.357 -30.198 7.564 1.00 23.88 C ATOM 283 CG GLU A 556 -0.975 -29.639 7.893 1.00 32.59 C ATOM 284 CD GLU A 556 0.161 -30.590 7.581 1.00 48.78 C ATOM 285 OE1 GLU A 556 -0.003 -31.811 7.797 1.00 51.69 O ATOM 286 OE2 GLU A 556 1.221 -30.106 7.121 1.00 52.06 O ATOM 287 H GLU A 556 -3.664 -29.878 9.973 1.00 0.00 H ATOM 288 N CYS A 557 -5.167 -29.253 6.206 1.00 12.78 N ATOM 289 CA CYS A 557 -6.413 -29.678 5.603 1.00 15.87 C ATOM 290 C CYS A 557 -6.176 -30.180 4.188 1.00 20.73 C ATOM 291 O CYS A 557 -5.517 -29.514 3.392 1.00 18.90 O ATOM 292 CB CYS A 557 -7.419 -28.530 5.597 1.00 14.56 C ATOM 293 SG CYS A 557 -9.106 -29.027 5.217 1.00 17.75 S ATOM 294 H CYS A 557 -4.534 -28.615 5.682 1.00 0.00 H ATOM 295 N TYR A 558 -6.710 -31.364 3.893 1.00 16.20 N ATOM 296 CA TYR A 558 -6.654 -31.952 2.554 1.00 19.60 C ATOM 297 C TYR A 558 -7.869 -31.565 1.725 1.00 20.99 C ATOM 298 O TYR A 558 -8.889 -31.131 2.266 1.00 16.63 O ATOM 299 CB TYR A 558 -6.570 -33.485 2.639 1.00 17.17 C ATOM 300 CG TYR A 558 -5.272 -33.983 3.220 1.00 23.05 C ATOM 301 CD1 TYR A 558 -5.067 -34.007 4.593 1.00 25.11 C ATOM 302 CD2 TYR A 558 -4.245 -34.428 2.393 1.00 23.90 C ATOM 303 CE1 TYR A 558 -3.879 -34.454 5.127 1.00 34.71 C ATOM 304 CE2 TYR A 558 -3.054 -34.879 2.916 1.00 32.47 C ATOM 305 CZ TYR A 558 -2.872 -34.891 4.280 1.00 41.65 C ATOM 306 OH TYR A 558 -1.682 -35.342 4.802 1.00 46.58 O ATOM 307 HH TYR A 558 -1.714 -35.285 5.790 1.00 0.00 H ATOM 308 H TYR A 558 -7.189 -31.895 4.649 1.00 0.00 H ATOM 309 N ASN A 559 -7.756 -31.738 0.411 1.00 20.54 N ATOM 310 CA ASN A 559 -8.882 -31.570 -0.505 1.00 29.51 C ATOM 311 C ASN A 559 -9.500 -30.184 -0.437 1.00 24.51 C ATOM 312 O ASN A 559 -10.687 -30.009 -0.708 1.00 27.64 O ATOM 313 CB ASN A 559 -9.957 -32.630 -0.229 1.00 31.97 C ATOM 314 CG ASN A 559 -9.416 -34.044 -0.311 1.00 36.59 C ATOM 315 OD1 ASN A 559 -8.605 -34.363 -1.182 1.00 37.84 O ATOM 316 ND2 ASN A 559 -9.860 -34.898 0.599 1.00 36.09 N ATOM 317 HD22 ASN A 559 -10.545 -34.584 1.316 1.00 0.00 H ATOM 318 HD21 ASN A 559 -9.524 -35.882 0.596 1.00 0.00 H ATOM 319 H ASN A 559 -6.830 -32.003 0.020 1.00 0.00 H ATOM 320 N LEU A 560 -8.684 -29.198 -0.080 1.00 21.35 N ATOM 321 CA LEU A 560 -9.153 -27.828 0.080 1.00 16.90 C ATOM 322 C LEU A 560 -8.548 -26.926 -0.993 1.00 21.88 C ATOM 323 O LEU A 560 -9.254 -26.181 -1.672 1.00 23.01 O ATOM 324 CB LEU A 560 -8.801 -27.314 1.482 1.00 19.35 C ATOM 325 CG LEU A 560 -9.321 -25.942 1.909 1.00 25.87 C ATOM 326 CD1 LEU A 560 -10.829 -25.852 1.733 1.00 28.02 C ATOM 327 CD2 LEU A 560 -8.935 -25.669 3.358 1.00 23.84 C ATOM 328 H LEU A 560 -7.680 -29.411 0.090 1.00 0.00 H ATOM 329 N SER A 561 -7.228 -26.996 -1.127 1.00 23.53 N ATOM 330 CA SER A 561 -6.513 -26.281 -2.177 1.00 29.19 C ATOM 331 C SER A 561 -6.899 -26.850 -3.534 1.00 32.89 C ATOM 332 O SER A 561 -7.360 -27.991 -3.613 1.00 29.76 O ATOM 333 CB SER A 561 -5.002 -26.394 -1.975 1.00 26.38 C ATOM 334 OG SER A 561 -4.582 -27.732 -2.172 1.00 29.21 O ATOM 335 HG SER A 561 -3.603 -27.792 -2.039 1.00 0.00 H ATOM 336 H SER A 561 -6.686 -27.581 -0.460 1.00 0.00 H ATOM 337 N PRO A 562 -6.709 -26.062 -4.607 1.00 39.53 N ATOM 338 CA PRO A 562 -7.016 -26.547 -5.960 1.00 41.10 C ATOM 339 C PRO A 562 -6.278 -27.838 -6.315 1.00 41.51 C ATOM 340 O PRO A 562 -6.790 -28.640 -7.091 1.00 48.74 O ATOM 341 CB PRO A 562 -6.567 -25.389 -6.867 1.00 40.79 C ATOM 342 CG PRO A 562 -5.820 -24.432 -5.982 1.00 42.82 C ATOM 343 CD PRO A 562 -6.360 -24.633 -4.608 1.00 37.21 C ATOM 344 N THR A 563 -5.099 -28.042 -5.739 1.00 36.99 N ATOM 345 CA THR A 563 -4.332 -29.262 -5.968 1.00 35.36 C ATOM 346 C THR A 563 -4.737 -30.383 -5.006 1.00 38.02 C ATOM 347 O THR A 563 -4.260 -31.514 -5.128 1.00 33.34 O ATOM 348 CB THR A 563 -2.818 -28.994 -5.825 1.00 38.13 C ATOM 349 OG1 THR A 563 -2.121 -30.238 -5.713 1.00 51.91 O ATOM 350 CG2 THR A 563 -2.540 -28.165 -4.582 1.00 31.55 C ATOM 351 HG1 THR A 563 -2.447 -30.727 -4.916 1.00 0.00 H ATOM 352 H THR A 563 -4.712 -27.312 -5.107 1.00 0.00 H ATOM 353 N LYS A 564 -5.590 -30.043 -4.034 1.00 33.47 N ATOM 354 CA LYS A 564 -6.107 -30.967 -3.009 1.00 32.30 C ATOM 355 C LYS A 564 -5.013 -31.462 -2.058 1.00 35.51 C ATOM 356 O LYS A 564 -5.293 -32.107 -1.042 1.00 30.21 O ATOM 357 CB LYS A 564 -6.828 -32.150 -3.663 1.00 31.50 C ATOM 358 CG LYS A 564 -7.903 -31.720 -4.649 1.00 41.41 C ATOM 359 CD LYS A 564 -8.601 -32.908 -5.286 1.00 50.81 C ATOM 360 CE LYS A 564 -10.031 -32.554 -5.672 1.00 56.46 C ATOM 361 NZ LYS A 564 -10.469 -31.272 -5.048 1.00 57.01 N ATOM 362 HZ1 LYS A 564 -10.420 -31.357 -4.013 1.00 0.00 H ATOM 363 HZ2 LYS A 564 -9.844 -30.503 -5.364 1.00 0.00 H ATOM 364 HZ3 LYS A 564 -11.447 -31.065 -5.334 1.00 0.00 H ATOM 365 H LYS A 564 -5.912 -29.055 -3.999 1.00 0.00 H ATOM 366 N ASP A 565 -3.770 -31.136 -2.398 1.00 38.46 N ATOM 367 CA ASP A 565 -2.614 -31.343 -1.540 1.00 34.72 C ATOM 368 C ASP A 565 -2.848 -30.649 -0.196 1.00 26.94 C ATOM 369 O ASP A 565 -3.590 -29.672 -0.128 1.00 29.05 O ATOM 370 CB ASP A 565 -1.360 -30.788 -2.225 1.00 44.88 C ATOM 371 CG ASP A 565 -0.094 -31.489 -1.789 1.00 61.93 C ATOM 372 OD1 ASP A 565 0.233 -32.540 -2.379 1.00 67.88 O ATOM 373 OD2 ASP A 565 0.582 -30.989 -0.864 1.00 70.52 O ATOM 374 H ASP A 565 -3.615 -30.708 -3.333 1.00 0.00 H ATOM 375 N LYS A 566 -2.216 -31.135 0.866 1.00 22.17 N ATOM 376 CA LYS A 566 -2.464 -30.569 2.186 1.00 27.39 C ATOM 377 C LYS A 566 -1.967 -29.126 2.283 1.00 24.80 C ATOM 378 O LYS A 566 -0.984 -28.743 1.650 1.00 21.49 O ATOM 379 CB LYS A 566 -1.824 -31.433 3.276 1.00 32.20 C ATOM 380 CG LYS A 566 -0.312 -31.358 3.366 1.00 34.21 C ATOM 381 CD LYS A 566 0.176 -32.123 4.590 1.00 37.95 C ATOM 382 CE LYS A 566 1.691 -32.255 4.600 1.00 47.58 C ATOM 383 NZ LYS A 566 2.189 -32.930 5.831 1.00 50.70 N ATOM 384 HZ1 LYS A 566 1.907 -32.378 6.666 1.00 0.00 H ATOM 385 HZ2 LYS A 566 1.781 -33.885 5.891 1.00 0.00 H ATOM 386 HZ3 LYS A 566 3.226 -32.997 5.793 1.00 0.00 H ATOM 387 H LYS A 566 -1.543 -31.920 0.756 1.00 0.00 H ATOM 388 N MET A 567 -2.682 -28.320 3.059 1.00 17.60 N ATOM 389 CA MET A 567 -2.326 -26.920 3.255 1.00 17.92 C ATOM 390 C MET A 567 -2.611 -26.550 4.695 1.00 15.83 C ATOM 391 O MET A 567 -3.499 -27.122 5.322 1.00 16.35 O ATOM 392 CB MET A 567 -3.107 -26.009 2.305 1.00 22.52 C ATOM 393 CG MET A 567 -4.604 -26.025 2.534 1.00 25.67 C ATOM 394 SD MET A 567 -5.516 -24.879 1.479 1.00 30.10 S ATOM 395 CE MET A 567 -4.830 -23.313 2.008 1.00 32.71 C ATOM 396 H MET A 567 -3.522 -28.699 3.542 1.00 0.00 H ATOM 397 N LEU A 568 -1.850 -25.600 5.223 1.00 15.33 N ATOM 398 CA LEU A 568 -2.042 -25.164 6.593 1.00 13.61 C ATOM 399 C LEU A 568 -3.312 -24.341 6.712 1.00 14.32 C ATOM 400 O LEU A 568 -3.648 -23.553 5.825 1.00 14.71 O ATOM 401 CB LEU A 568 -0.847 -24.349 7.079 1.00 16.13 C ATOM 402 CG LEU A 568 0.493 -25.086 7.193 1.00 19.68 C ATOM 403 CD1 LEU A 568 1.556 -24.096 7.651 1.00 21.84 C ATOM 404 CD2 LEU A 568 0.395 -26.238 8.170 1.00 23.10 C ATOM 405 H LEU A 568 -1.104 -25.161 4.646 1.00 0.00 H ATOM 406 N VAL A 569 -4.016 -24.546 7.814 1.00 12.91 N ATOM 407 CA VAL A 569 -5.221 -23.791 8.116 1.00 14.91 C ATOM 408 C VAL A 569 -5.260 -23.572 9.598 1.00 13.75 C ATOM 409 O VAL A 569 -4.487 -24.175 10.345 1.00 12.59 O ATOM 410 CB VAL A 569 -6.526 -24.515 7.697 1.00 8.40 C ATOM 411 CG1 VAL A 569 -6.640 -24.664 6.171 1.00 8.75 C ATOM 412 CG2 VAL A 569 -6.653 -25.869 8.406 1.00 10.12 C ATOM 413 H VAL A 569 -3.696 -25.272 8.487 1.00 0.00 H ATOM 414 N ALA A 570 -6.168 -22.715 10.035 1.00 8.41 N ATOM 415 CA ALA A 570 -6.488 -22.643 11.446 1.00 11.69 C ATOM 416 C ALA A 570 -7.874 -23.203 11.651 1.00 13.73 C ATOM 417 O ALA A 570 -8.783 -22.947 10.866 1.00 15.15 O ATOM 418 CB ALA A 570 -6.406 -21.222 11.962 1.00 12.83 C ATOM 419 H ALA A 570 -6.655 -22.089 9.362 1.00 0.00 H ATOM 420 N VAL A 571 -8.024 -23.989 12.706 1.00 8.02 N ATOM 421 CA VAL A 571 -9.294 -24.605 13.022 1.00 10.33 C ATOM 422 C VAL A 571 -9.807 -24.154 14.377 1.00 13.58 C ATOM 423 O VAL A 571 -9.075 -24.197 15.359 1.00 16.11 O ATOM 424 CB VAL A 571 -9.150 -26.139 13.000 1.00 16.48 C ATOM 425 CG1 VAL A 571 -10.311 -26.813 13.709 1.00 20.34 C ATOM 426 CG2 VAL A 571 -9.019 -26.611 11.553 1.00 16.49 C ATOM 427 H VAL A 571 -7.207 -24.168 13.324 1.00 0.00 H ATOM 428 N LYS A 572 -11.057 -23.713 14.437 1.00 9.74 N ATOM 429 CA LYS A 572 -11.687 -23.478 15.733 1.00 12.65 C ATOM 430 C LYS A 572 -12.625 -24.632 16.047 1.00 14.77 C ATOM 431 O LYS A 572 -13.452 -25.006 15.215 1.00 11.75 O ATOM 432 CB LYS A 572 -12.438 -22.146 15.749 1.00 11.42 C ATOM 433 CG LYS A 572 -13.022 -21.809 17.108 1.00 14.81 C ATOM 434 CD LYS A 572 -13.463 -20.358 17.181 1.00 24.37 C ATOM 435 CE LYS A 572 -14.685 -20.114 16.337 1.00 26.31 C ATOM 436 NZ LYS A 572 -15.257 -18.771 16.632 1.00 28.38 N ATOM 437 HZ1 LYS A 572 -15.522 -18.721 17.636 1.00 0.00 H ATOM 438 HZ2 LYS A 572 -14.548 -18.040 16.423 1.00 0.00 H ATOM 439 HZ3 LYS A 572 -16.100 -18.617 16.042 1.00 0.00 H ATOM 440 H LYS A 572 -11.588 -23.535 13.561 1.00 0.00 H ATOM 441 N ALA A 573 -12.492 -25.202 17.243 1.00 11.56 N ATOM 442 CA ALA A 573 -13.273 -26.364 17.631 1.00 16.16 C ATOM 443 C ALA A 573 -14.069 -26.088 18.897 1.00 20.62 C ATOM 444 O ALA A 573 -13.490 -25.760 19.934 1.00 19.88 O ATOM 445 CB ALA A 573 -12.368 -27.568 17.835 1.00 15.95 C ATOM 446 H ALA A 573 -11.809 -24.804 17.919 1.00 0.00 H ATOM 447 N LEU A 574 -15.388 -26.229 18.802 1.00 13.65 N ATOM 448 CA LEU A 574 -16.288 -26.043 19.940 1.00 17.31 C ATOM 449 C LEU A 574 -16.772 -27.378 20.463 1.00 16.29 C ATOM 450 O LEU A 574 -17.579 -28.033 19.817 1.00 15.88 O ATOM 451 CB LEU A 574 -17.512 -25.211 19.559 1.00 21.83 C ATOM 452 CG LEU A 574 -17.465 -23.743 19.171 1.00 31.00 C ATOM 453 CD1 LEU A 574 -16.772 -23.533 17.838 1.00 43.03 C ATOM 454 CD2 LEU A 574 -18.900 -23.235 19.106 1.00 28.11 C ATOM 455 H LEU A 574 -15.797 -26.482 17.880 1.00 0.00 H ATOM 456 N LYS A 575 -16.304 -27.771 21.640 1.00 17.51 N ATOM 457 CA LYS A 575 -16.728 -29.034 22.233 1.00 20.79 C ATOM 458 C LYS A 575 -18.039 -28.860 22.999 1.00 23.23 C ATOM 459 O LYS A 575 -18.229 -27.851 23.690 1.00 22.64 O ATOM 460 CB LYS A 575 -15.644 -29.582 23.166 1.00 22.48 C ATOM 461 H LYS A 575 -15.624 -27.169 22.148 1.00 0.00 H ATOM 462 N ASP A 576 -18.932 -29.836 22.855 1.00 18.41 N ATOM 463 CA ASP A 576 -20.207 -29.882 23.586 1.00 21.92 C ATOM 464 C ASP A 576 -20.894 -28.519 23.659 1.00 22.63 C ATOM 465 O ASP A 576 -21.161 -28.007 24.745 1.00 20.62 O ATOM 466 CB ASP A 576 -19.976 -30.425 24.997 1.00 29.44 C ATOM 467 CG ASP A 576 -21.264 -30.823 25.686 1.00 45.09 C ATOM 468 OD1 ASP A 576 -22.255 -31.093 24.973 1.00 50.65 O ATOM 469 OD2 ASP A 576 -21.280 -30.871 26.936 1.00 49.43 O ATOM 470 H ASP A 576 -18.717 -30.607 22.191 1.00 0.00 H ATOM 471 N PRO A 577 -21.164 -27.916 22.495 1.00 21.21 N ATOM 472 CA PRO A 577 -21.639 -26.531 22.511 1.00 14.85 C ATOM 473 C PRO A 577 -23.042 -26.405 23.101 1.00 14.77 C ATOM 474 O PRO A 577 -23.919 -27.210 22.803 1.00 19.32 O ATOM 475 CB PRO A 577 -21.637 -26.143 21.030 1.00 17.91 C ATOM 476 CG PRO A 577 -21.877 -27.445 20.313 1.00 22.89 C ATOM 477 CD PRO A 577 -21.203 -28.511 21.145 1.00 22.92 C ATOM 478 N THR A 578 -23.235 -25.385 23.925 1.00 16.11 N ATOM 479 CA THR A 578 -24.566 -25.005 24.360 1.00 17.83 C ATOM 480 C THR A 578 -25.368 -24.522 23.166 1.00 15.04 C ATOM 481 O THR A 578 -24.822 -24.304 22.089 1.00 16.55 O ATOM 482 CB THR A 578 -24.526 -23.888 25.390 1.00 16.09 C ATOM 483 OG1 THR A 578 -23.963 -22.722 24.780 1.00 18.98 O ATOM 484 CG2 THR A 578 -23.679 -24.288 26.587 1.00 19.61 C ATOM 485 HG1 THR A 578 -23.932 -21.987 25.442 1.00 0.00 H ATOM 486 H THR A 578 -22.415 -24.845 24.267 1.00 0.00 H ATOM 487 N LEU A 579 -26.665 -24.332 23.361 1.00 14.20 N ATOM 488 CA LEU A 579 -27.491 -23.773 22.305 1.00 12.94 C ATOM 489 C LEU A 579 -26.986 -22.392 21.896 1.00 15.35 C ATOM 490 O LEU A 579 -26.907 -22.075 20.707 1.00 15.41 O ATOM 491 CB LEU A 579 -28.950 -23.691 22.750 1.00 15.45 C ATOM 492 CG LEU A 579 -29.877 -23.056 21.712 1.00 24.15 C ATOM 493 CD1 LEU A 579 -29.754 -23.784 20.366 1.00 25.19 C ATOM 494 CD2 LEU A 579 -31.308 -23.052 22.199 1.00 21.09 C ATOM 495 H LEU A 579 -27.093 -24.584 24.274 1.00 0.00 H ATOM 496 N ALA A 580 -26.645 -21.567 22.883 1.00 12.60 N ATOM 497 CA ALA A 580 -26.154 -20.223 22.602 1.00 15.68 C ATOM 498 C ALA A 580 -24.860 -20.271 21.788 1.00 15.12 C ATOM 499 O ALA A 580 -24.658 -19.475 20.862 1.00 14.93 O ATOM 500 CB ALA A 580 -25.940 -19.459 23.895 1.00 18.04 C ATOM 501 H ALA A 580 -26.730 -21.886 23.869 1.00 0.00 H ATOM 502 N ALA A 581 -23.992 -21.214 22.128 1.00 15.26 N ATOM 503 CA ALA A 581 -22.736 -21.374 21.399 1.00 15.65 C ATOM 504 C ALA A 581 -22.980 -21.855 19.975 1.00 11.62 C ATOM 505 O ALA A 581 -22.287 -21.421 19.046 1.00 12.55 O ATOM 506 CB ALA A 581 -21.822 -22.329 22.124 1.00 19.13 C ATOM 507 H ALA A 581 -24.208 -21.848 22.924 1.00 0.00 H ATOM 508 N ARG A 582 -23.957 -22.742 19.797 1.00 11.70 N ATOM 509 CA ARG A 582 -24.293 -23.239 18.461 1.00 13.57 C ATOM 510 C ARG A 582 -24.817 -22.101 17.613 1.00 13.01 C ATOM 511 O ARG A 582 -24.480 -21.973 16.437 1.00 13.80 O ATOM 512 CB ARG A 582 -25.338 -24.357 18.506 1.00 17.14 C ATOM 513 CG ARG A 582 -24.860 -25.668 19.094 1.00 32.61 C ATOM 514 CD ARG A 582 -25.900 -26.775 18.885 1.00 36.34 C ATOM 515 NE ARG A 582 -25.260 -28.036 18.509 1.00 45.59 N ATOM 516 CZ ARG A 582 -25.173 -28.496 17.262 1.00 49.53 C ATOM 517 NH1 ARG A 582 -25.699 -27.811 16.255 1.00 44.34 N ATOM 518 NH2 ARG A 582 -24.563 -29.650 17.021 1.00 55.81 N ATOM 519 HE ARG A 582 -24.844 -28.613 19.268 1.00 0.00 H ATOM 520 HH12 ARG A 582 -25.627 -28.176 15.284 1.00 0.00 H ATOM 521 HH11 ARG A 582 -26.183 -26.909 16.437 1.00 0.00 H ATOM 522 HH22 ARG A 582 -24.495 -30.009 16.047 1.00 0.00 H ATOM 523 HH21 ARG A 582 -24.153 -30.195 17.806 1.00 0.00 H ATOM 524 H ARG A 582 -24.490 -23.088 20.620 1.00 0.00 H ATOM 525 N LYS A 583 -25.662 -21.276 18.212 1.00 14.11 N ATOM 526 CA LYS A 583 -26.201 -20.125 17.507 1.00 15.56 C ATOM 527 C LYS A 583 -25.106 -19.138 17.126 1.00 13.65 C ATOM 528 O LYS A 583 -25.101 -18.595 16.022 1.00 17.33 O ATOM 529 CB LYS A 583 -27.274 -19.439 18.358 1.00 17.38 C ATOM 530 CG LYS A 583 -28.580 -20.218 18.381 1.00 24.17 C ATOM 531 CD LYS A 583 -29.649 -19.495 19.180 1.00 36.56 C ATOM 532 CE LYS A 583 -31.012 -20.140 18.962 1.00 44.81 C ATOM 533 NZ LYS A 583 -32.097 -19.453 19.719 1.00 51.75 N ATOM 534 HZ1 LYS A 583 -31.884 -19.489 20.736 1.00 0.00 H ATOM 535 HZ2 LYS A 583 -32.159 -18.462 19.411 1.00 0.00 H ATOM 536 HZ3 LYS A 583 -33.002 -19.931 19.536 1.00 0.00 H ATOM 537 H LYS A 583 -25.943 -21.454 19.197 1.00 0.00 H ATOM 538 N ASP A 584 -24.172 -18.900 18.033 1.00 15.06 N ATOM 539 CA ASP A 584 -23.084 -17.981 17.721 1.00 15.42 C ATOM 540 C ASP A 584 -22.179 -18.550 16.628 1.00 15.55 C ATOM 541 O ASP A 584 -21.684 -17.818 15.780 1.00 12.15 O ATOM 542 CB ASP A 584 -22.278 -17.655 18.978 1.00 19.21 C ATOM 543 CG ASP A 584 -23.017 -16.687 19.902 1.00 37.53 C ATOM 544 OD1 ASP A 584 -23.961 -16.010 19.428 1.00 42.13 O ATOM 545 OD2 ASP A 584 -22.651 -16.596 21.093 1.00 41.27 O ATOM 546 H ASP A 584 -24.214 -19.365 18.962 1.00 0.00 H ATOM 547 N PHE A 585 -21.969 -19.861 16.652 1.00 10.68 N ATOM 548 CA PHE A 585 -21.204 -20.533 15.603 1.00 11.42 C ATOM 549 C PHE A 585 -21.857 -20.325 14.241 1.00 11.64 C ATOM 550 O PHE A 585 -21.192 -20.019 13.244 1.00 11.47 O ATOM 551 CB PHE A 585 -21.102 -22.022 15.938 1.00 11.63 C ATOM 552 CG PHE A 585 -20.304 -22.827 14.957 1.00 13.22 C ATOM 553 CD1 PHE A 585 -20.898 -23.343 13.817 1.00 15.71 C ATOM 554 CD2 PHE A 585 -18.971 -23.112 15.207 1.00 13.27 C ATOM 555 CE1 PHE A 585 -20.170 -24.113 12.928 1.00 14.34 C ATOM 556 CE2 PHE A 585 -18.239 -23.889 14.323 1.00 14.22 C ATOM 557 CZ PHE A 585 -18.837 -24.375 13.181 1.00 14.49 C ATOM 558 H PHE A 585 -22.358 -20.423 17.436 1.00 0.00 H ATOM 559 N GLN A 586 -23.173 -20.504 14.190 1.00 13.42 N ATOM 560 CA GLN A 586 -23.890 -20.345 12.931 1.00 14.37 C ATOM 561 C GLN A 586 -23.855 -18.903 12.447 1.00 12.90 C ATOM 562 O GLN A 586 -23.679 -18.649 11.254 1.00 12.63 O ATOM 563 CB GLN A 586 -25.333 -20.817 13.082 1.00 15.75 C ATOM 564 CG GLN A 586 -25.418 -22.308 13.319 1.00 19.19 C ATOM 565 CD GLN A 586 -26.842 -22.776 13.443 1.00 33.71 C ATOM 566 OE1 GLN A 586 -27.726 -21.990 13.768 1.00 37.26 O ATOM 567 NE2 GLN A 586 -27.078 -24.059 13.169 1.00 39.88 N ATOM 568 HE22 GLN A 586 -26.294 -24.686 12.898 1.00 0.00 H ATOM 569 HE21 GLN A 586 -28.047 -24.433 13.226 1.00 0.00 H ATOM 570 H GLN A 586 -23.694 -20.759 15.053 1.00 0.00 H ATOM 571 N ARG A 587 -24.011 -17.965 13.378 1.00 12.60 N ATOM 572 CA ARG A 587 -23.967 -16.546 13.044 1.00 16.90 C ATOM 573 C ARG A 587 -22.597 -16.166 12.481 1.00 16.39 C ATOM 574 O ARG A 587 -22.493 -15.418 11.506 1.00 15.55 O ATOM 575 CB ARG A 587 -24.295 -15.694 14.276 1.00 16.26 C ATOM 576 H ARG A 587 -24.168 -18.250 14.366 1.00 0.00 H ATOM 577 N GLU A 588 -21.541 -16.697 13.085 1.00 11.92 N ATOM 578 CA GLU A 588 -20.192 -16.413 12.616 1.00 11.87 C ATOM 579 C GLU A 588 -19.959 -16.988 11.216 1.00 13.38 C ATOM 580 O GLU A 588 -19.392 -16.332 10.348 1.00 13.33 O ATOM 581 CB GLU A 588 -19.173 -16.986 13.589 1.00 17.05 C ATOM 582 CG GLU A 588 -17.721 -16.769 13.198 1.00 21.40 C ATOM 583 CD GLU A 588 -16.779 -17.232 14.294 1.00 26.38 C ATOM 584 OE1 GLU A 588 -17.242 -17.948 15.208 1.00 28.20 O ATOM 585 OE2 GLU A 588 -15.581 -16.890 14.246 1.00 24.32 O ATOM 586 H GLU A 588 -21.679 -17.324 13.903 1.00 0.00 H ATOM 587 N ALA A 589 -20.383 -18.229 11.007 1.00 10.70 N ATOM 588 CA ALA A 589 -20.196 -18.881 9.716 1.00 10.47 C ATOM 589 C ALA A 589 -20.920 -18.130 8.605 1.00 10.54 C ATOM 590 O ALA A 589 -20.384 -17.932 7.513 1.00 12.30 O ATOM 591 CB ALA A 589 -20.677 -20.326 9.780 1.00 12.39 C ATOM 592 H ALA A 589 -20.856 -18.744 11.777 1.00 0.00 H ATOM 593 N GLU A 590 -22.140 -17.699 8.881 1.00 12.25 N ATOM 594 CA GLU A 590 -22.904 -16.993 7.864 1.00 13.86 C ATOM 595 C GLU A 590 -22.287 -15.628 7.574 1.00 16.12 C ATOM 596 O GLU A 590 -22.131 -15.236 6.416 1.00 16.77 O ATOM 597 CB GLU A 590 -24.355 -16.845 8.288 1.00 16.52 C ATOM 598 CG GLU A 590 -25.203 -16.214 7.197 1.00 31.00 C ATOM 599 CD GLU A 590 -26.685 -16.260 7.504 1.00 47.51 C ATOM 600 OE1 GLU A 590 -27.054 -16.810 8.561 1.00 49.27 O ATOM 601 OE2 GLU A 590 -27.484 -15.756 6.684 1.00 52.45 O ATOM 602 H GLU A 590 -22.551 -17.864 9.822 1.00 0.00 H ATOM 603 N LEU A 591 -21.903 -14.924 8.629 1.00 11.13 N ATOM 604 CA LEU A 591 -21.261 -13.624 8.482 1.00 11.53 C ATOM 605 C LEU A 591 -19.977 -13.710 7.649 1.00 15.88 C ATOM 606 O LEU A 591 -19.782 -12.927 6.716 1.00 14.42 O ATOM 607 CB LEU A 591 -20.962 -13.038 9.861 1.00 14.33 C ATOM 608 CG LEU A 591 -20.940 -11.538 10.104 1.00 29.08 C ATOM 609 CD1 LEU A 591 -22.287 -10.908 9.758 1.00 24.00 C ATOM 610 CD2 LEU A 591 -20.600 -11.306 11.571 1.00 30.34 C ATOM 611 H LEU A 591 -22.063 -15.307 9.582 1.00 0.00 H ATOM 612 N LEU A 592 -19.111 -14.668 7.963 1.00 10.35 N ATOM 613 CA LEU A 592 -17.828 -14.764 7.266 1.00 10.22 C ATOM 614 C LEU A 592 -17.967 -15.314 5.859 1.00 11.85 C ATOM 615 O LEU A 592 -17.054 -15.184 5.041 1.00 13.92 O ATOM 616 CB LEU A 592 -16.850 -15.622 8.061 1.00 14.67 C ATOM 617 CG LEU A 592 -16.301 -14.910 9.295 1.00 19.73 C ATOM 618 CD1 LEU A 592 -15.356 -15.811 10.024 1.00 15.36 C ATOM 619 CD2 LEU A 592 -15.604 -13.606 8.895 1.00 21.13 C ATOM 620 H LEU A 592 -19.347 -15.354 8.709 1.00 0.00 H ATOM 621 N THR A 593 -19.109 -15.920 5.568 1.00 11.81 N ATOM 622 CA THR A 593 -19.381 -16.356 4.207 1.00 12.59 C ATOM 623 C THR A 593 -19.755 -15.131 3.381 1.00 15.20 C ATOM 624 O THR A 593 -19.390 -15.010 2.205 1.00 16.96 O ATOM 625 CB THR A 593 -20.498 -17.402 4.164 1.00 12.69 C ATOM 626 OG1 THR A 593 -20.061 -18.585 4.844 1.00 14.49 O ATOM 627 CG2 THR A 593 -20.833 -17.759 2.718 1.00 19.58 C ATOM 628 HG1 THR A 593 -19.848 -18.364 5.785 1.00 0.00 H ATOM 629 H THR A 593 -19.813 -16.084 6.315 1.00 0.00 H ATOM 630 N ASN A 594 -20.448 -14.197 4.022 1.00 12.98 N ATOM 631 CA ASN A 594 -20.928 -12.997 3.347 1.00 15.44 C ATOM 632 C ASN A 594 -19.917 -11.862 3.267 1.00 17.70 C ATOM 633 O ASN A 594 -19.912 -11.103 2.302 1.00 21.11 O ATOM 634 CB ASN A 594 -22.185 -12.491 4.043 1.00 19.56 C ATOM 635 CG ASN A 594 -23.340 -13.467 3.918 1.00 28.21 C ATOM 636 OD1 ASN A 594 -23.358 -14.304 3.017 1.00 31.97 O ATOM 637 ND2 ASN A 594 -24.312 -13.356 4.814 1.00 22.09 N ATOM 638 HD22 ASN A 594 -24.253 -12.632 5.558 1.00 0.00 H ATOM 639 HD21 ASN A 594 -25.133 -13.993 4.772 1.00 0.00 H ATOM 640 H ASN A 594 -20.654 -14.325 5.033 1.00 0.00 H ATOM 641 N LEU A 595 -19.077 -11.740 4.289 1.00 10.82 N ATOM 642 CA LEU A 595 -18.107 -10.653 4.367 1.00 10.12 C ATOM 643 C LEU A 595 -16.783 -11.174 3.882 1.00 19.95 C ATOM 644 O LEU A 595 -16.063 -11.839 4.626 1.00 24.36 O ATOM 645 CB LEU A 595 -17.975 -10.120 5.799 1.00 12.28 C ATOM 646 CG LEU A 595 -19.185 -9.412 6.402 1.00 18.33 C ATOM 647 CD1 LEU A 595 -18.986 -9.148 7.896 1.00 19.72 C ATOM 648 CD2 LEU A 595 -19.459 -8.106 5.676 1.00 16.10 C ATOM 649 H LEU A 595 -19.112 -12.441 5.057 1.00 0.00 H ATOM 650 N GLN A 596 -16.476 -10.882 2.625 1.00 14.65 N ATOM 651 CA GLN A 596 -15.246 -11.348 2.005 1.00 18.62 C ATOM 652 C GLN A 596 -14.506 -10.168 1.421 1.00 11.13 C ATOM 653 O GLN A 596 -15.067 -9.400 0.641 1.00 11.85 O ATOM 654 CB GLN A 596 -15.534 -12.371 0.902 1.00 23.36 C ATOM 655 CG GLN A 596 -16.182 -13.660 1.389 1.00 32.40 C ATOM 656 CD GLN A 596 -16.290 -14.694 0.288 1.00 46.31 C ATOM 657 OE1 GLN A 596 -15.328 -14.952 -0.436 1.00 52.52 O ATOM 658 NE2 GLN A 596 -17.467 -15.291 0.153 1.00 52.81 N ATOM 659 HE22 GLN A 596 -18.252 -15.042 0.787 1.00 0.00 H ATOM 660 HE21 GLN A 596 -17.604 -16.008 -0.587 1.00 0.00 H ATOM 661 H GLN A 596 -17.135 -10.303 2.066 1.00 0.00 H ATOM 662 N HIS A 597 -13.239 -10.044 1.787 1.00 10.49 N ATOM 663 CA HIS A 597 -12.427 -8.912 1.361 1.00 9.14 C ATOM 664 C HIS A 597 -10.979 -9.235 1.650 1.00 6.98 C ATOM 665 O HIS A 597 -10.680 -10.043 2.544 1.00 9.38 O ATOM 666 CB HIS A 597 -12.864 -7.641 2.092 1.00 6.28 C ATOM 667 CG HIS A 597 -12.150 -6.395 1.655 1.00 7.77 C ATOM 668 ND1 HIS A 597 -11.037 -5.910 2.307 1.00 5.96 N ATOM 669 CD2 HIS A 597 -12.428 -5.508 0.667 1.00 8.77 C ATOM 670 CE1 HIS A 597 -10.640 -4.790 1.724 1.00 9.72 C ATOM 671 NE2 HIS A 597 -11.473 -4.519 0.733 1.00 11.41 N ATOM 672 H HIS A 597 -12.813 -10.773 2.394 1.00 0.00 H ATOM 673 N GLU A 598 -10.079 -8.617 0.889 1.00 6.55 N ATOM 674 CA GLU A 598 -8.643 -8.778 1.094 1.00 9.16 C ATOM 675 C GLU A 598 -8.173 -8.556 2.538 1.00 8.09 C ATOM 676 O GLU A 598 -7.204 -9.168 2.983 1.00 9.91 O ATOM 677 CB GLU A 598 -7.880 -7.825 0.167 1.00 14.84 C ATOM 678 CG GLU A 598 -6.377 -7.750 0.426 1.00 24.76 C ATOM 679 CD GLU A 598 -5.619 -9.016 0.036 1.00 43.92 C ATOM 680 OE1 GLU A 598 -5.778 -10.070 0.705 1.00 41.55 O ATOM 681 OE2 GLU A 598 -4.839 -8.944 -0.938 1.00 53.42 O ATOM 682 H GLU A 598 -10.410 -7.998 0.122 1.00 0.00 H ATOM 683 N HIS A 599 -8.855 -7.691 3.275 1.00 5.34 N ATOM 684 CA HIS A 599 -8.401 -7.358 4.619 1.00 5.86 C ATOM 685 C HIS A 599 -9.380 -7.764 5.700 1.00 6.93 C ATOM 686 O HIS A 599 -9.342 -7.242 6.807 1.00 5.85 O ATOM 687 CB HIS A 599 -8.073 -5.862 4.676 1.00 7.31 C ATOM 688 CG HIS A 599 -6.871 -5.534 3.840 1.00 6.62 C ATOM 689 ND1 HIS A 599 -5.638 -6.065 4.115 1.00 4.70 N ATOM 690 CD2 HIS A 599 -6.735 -4.809 2.700 1.00 5.90 C ATOM 691 CE1 HIS A 599 -4.772 -5.661 3.193 1.00 6.66 C ATOM 692 NE2 HIS A 599 -5.411 -4.892 2.333 1.00 5.48 N ATOM 693 H HIS A 599 -9.716 -7.249 2.893 1.00 0.00 H ATOM 694 N ILE A 600 -10.246 -8.712 5.364 1.00 5.54 N ATOM 695 CA ILE A 600 -11.057 -9.400 6.367 1.00 7.32 C ATOM 696 C ILE A 600 -10.568 -10.844 6.424 1.00 9.45 C ATOM 697 O ILE A 600 -10.313 -11.450 5.383 1.00 7.73 O ATOM 698 CB ILE A 600 -12.569 -9.346 6.033 1.00 8.29 C ATOM 699 CG1 ILE A 600 -13.041 -7.892 5.891 1.00 9.83 C ATOM 700 CG2 ILE A 600 -13.383 -10.108 7.071 1.00 9.15 C ATOM 701 CD1 ILE A 600 -12.791 -7.012 7.123 1.00 11.14 C ATOM 702 H ILE A 600 -10.350 -8.972 4.362 1.00 0.00 H ATOM 703 N VAL A 601 -10.425 -11.397 7.630 1.00 7.47 N ATOM 704 CA VAL A 601 -9.920 -12.759 7.780 1.00 9.96 C ATOM 705 C VAL A 601 -10.681 -13.744 6.888 1.00 11.01 C ATOM 706 O VAL A 601 -11.906 -13.694 6.776 1.00 10.85 O ATOM 707 CB VAL A 601 -10.000 -13.221 9.249 1.00 10.54 C ATOM 708 CG1 VAL A 601 -8.967 -12.462 10.091 1.00 13.41 C ATOM 709 CG2 VAL A 601 -11.427 -13.028 9.805 1.00 10.60 C ATOM 710 H VAL A 601 -10.677 -10.849 8.477 1.00 0.00 H ATOM 711 N LYS A 602 -9.934 -14.611 6.223 1.00 8.34 N ATOM 712 CA LYS A 602 -10.532 -15.515 5.242 1.00 9.76 C ATOM 713 C LYS A 602 -11.016 -16.791 5.919 1.00 12.04 C ATOM 714 O LYS A 602 -10.354 -17.356 6.771 1.00 8.65 O ATOM 715 CB LYS A 602 -9.536 -15.822 4.127 1.00 14.76 C ATOM 716 CG LYS A 602 -9.943 -16.950 3.201 1.00 18.98 C ATOM 717 CD LYS A 602 -9.344 -16.764 1.818 1.00 34.66 C ATOM 718 CE LYS A 602 -7.896 -16.300 1.895 1.00 44.88 C ATOM 719 NZ LYS A 602 -7.372 -15.879 0.564 1.00 51.05 N ATOM 720 HZ1 LYS A 602 -7.422 -16.681 -0.096 1.00 0.00 H ATOM 721 HZ2 LYS A 602 -7.946 -15.092 0.200 1.00 0.00 H ATOM 722 HZ3 LYS A 602 -6.384 -15.571 0.664 1.00 0.00 H ATOM 723 H LYS A 602 -8.910 -14.650 6.400 1.00 0.00 H ATOM 724 N PHE A 603 -12.204 -17.208 5.514 1.00 11.17 N ATOM 725 CA PHE A 603 -12.945 -18.299 6.104 1.00 13.67 C ATOM 726 C PHE A 603 -13.136 -19.373 5.028 1.00 13.26 C ATOM 727 O PHE A 603 -13.550 -19.050 3.915 1.00 10.64 O ATOM 728 CB PHE A 603 -14.276 -17.733 6.621 1.00 11.98 C ATOM 729 CG PHE A 603 -15.315 -18.749 6.926 1.00 11.78 C ATOM 730 CD1 PHE A 603 -15.198 -19.576 8.026 1.00 20.79 C ATOM 731 CD2 PHE A 603 -16.453 -18.828 6.155 1.00 18.86 C ATOM 732 CE1 PHE A 603 -16.184 -20.488 8.322 1.00 21.20 C ATOM 733 CE2 PHE A 603 -17.440 -19.742 6.452 1.00 23.69 C ATOM 734 CZ PHE A 603 -17.303 -20.571 7.536 1.00 20.55 C ATOM 735 H PHE A 603 -12.638 -16.713 4.709 1.00 0.00 H ATOM 736 N TYR A 604 -12.829 -20.633 5.341 1.00 8.75 N ATOM 737 CA TYR A 604 -12.924 -21.700 4.340 1.00 9.24 C ATOM 738 C TYR A 604 -14.202 -22.519 4.447 1.00 12.44 C ATOM 739 O TYR A 604 -14.681 -23.040 3.450 1.00 15.69 O ATOM 740 CB TYR A 604 -11.744 -22.659 4.441 1.00 9.20 C ATOM 741 CG TYR A 604 -10.427 -22.066 4.047 1.00 12.68 C ATOM 742 CD1 TYR A 604 -10.300 -21.297 2.902 1.00 19.43 C ATOM 743 CD2 TYR A 604 -9.303 -22.277 4.833 1.00 17.30 C ATOM 744 CE1 TYR A 604 -9.072 -20.751 2.549 1.00 19.21 C ATOM 745 CE2 TYR A 604 -8.087 -21.752 4.486 1.00 17.23 C ATOM 746 CZ TYR A 604 -7.973 -20.987 3.351 1.00 20.26 C ATOM 747 OH TYR A 604 -6.736 -20.468 3.032 1.00 28.97 O ATOM 748 HH TYR A 604 -6.805 -19.943 2.196 1.00 0.00 H ATOM 749 H TYR A 604 -12.518 -20.861 6.307 1.00 0.00 H ATOM 750 N GLY A 605 -14.726 -22.687 5.653 1.00 8.82 N ATOM 751 CA GLY A 605 -15.953 -23.460 5.806 1.00 9.47 C ATOM 752 C GLY A 605 -16.088 -24.117 7.165 1.00 9.54 C ATOM 753 O GLY A 605 -15.337 -23.811 8.090 1.00 9.14 O ATOM 754 H GLY A 605 -14.264 -22.269 6.486 1.00 0.00 H ATOM 755 N VAL A 606 -17.063 -25.013 7.287 1.00 5.66 N ATOM 756 CA VAL A 606 -17.336 -25.679 8.555 1.00 6.30 C ATOM 757 C VAL A 606 -17.477 -27.172 8.321 1.00 9.05 C ATOM 758 O VAL A 606 -17.757 -27.613 7.197 1.00 10.31 O ATOM 759 CB VAL A 606 -18.629 -25.136 9.231 1.00 7.38 C ATOM 760 CG1 VAL A 606 -18.480 -23.653 9.577 1.00 7.89 C ATOM 761 CG2 VAL A 606 -19.845 -25.374 8.324 1.00 7.72 C ATOM 762 H VAL A 606 -17.645 -25.245 6.457 1.00 0.00 H ATOM 763 N CYS A 607 -17.271 -27.970 9.362 1.00 10.21 N ATOM 764 CA CYS A 607 -17.603 -29.382 9.256 1.00 11.03 C ATOM 765 C CYS A 607 -19.102 -29.530 9.462 1.00 14.23 C ATOM 766 O CYS A 607 -19.794 -28.558 9.803 1.00 14.30 O ATOM 767 CB CYS A 607 -16.816 -30.221 10.267 1.00 10.36 C ATOM 768 SG CYS A 607 -15.016 -30.137 9.944 1.00 15.25 S ATOM 769 H CYS A 607 -16.876 -27.589 10.245 1.00 0.00 H ATOM 770 N GLY A 608 -19.610 -30.734 9.230 1.00 14.92 N ATOM 771 CA GLY A 608 -21.018 -31.006 9.451 1.00 15.30 C ATOM 772 C GLY A 608 -21.360 -30.963 10.927 1.00 20.25 C ATOM 773 O GLY A 608 -20.493 -30.740 11.784 1.00 19.45 O ATOM 774 H GLY A 608 -18.990 -31.494 8.885 1.00 0.00 H ATOM 775 N ASP A 609 -22.639 -31.171 11.220 1.00 21.13 N ATOM 776 CA ASP A 609 -23.112 -31.243 12.590 1.00 24.51 C ATOM 777 C ASP A 609 -22.391 -32.371 13.307 1.00 24.30 C ATOM 778 O ASP A 609 -22.080 -33.405 12.711 1.00 26.72 O ATOM 779 CB ASP A 609 -24.625 -31.465 12.631 1.00 32.04 C ATOM 780 CG ASP A 609 -25.253 -30.936 13.901 1.00 38.58 C ATOM 781 OD1 ASP A 609 -24.494 -30.548 14.817 1.00 40.66 O ATOM 782 OD2 ASP A 609 -26.500 -30.911 13.986 1.00 40.25 O ATOM 783 H ASP A 609 -23.322 -31.286 10.444 1.00 0.00 H ATOM 784 N GLY A 610 -22.102 -32.156 14.579 1.00 23.12 N ATOM 785 CA GLY A 610 -21.421 -33.151 15.379 1.00 27.48 C ATOM 786 C GLY A 610 -20.709 -32.477 16.527 1.00 27.15 C ATOM 787 O GLY A 610 -20.976 -31.320 16.841 1.00 33.99 O ATOM 788 H GLY A 610 -22.370 -31.251 15.015 1.00 0.00 H ATOM 789 N ASP A 611 -19.783 -33.201 17.139 1.00 20.40 N ATOM 790 CA ASP A 611 -19.070 -32.716 18.302 1.00 19.37 C ATOM 791 C ASP A 611 -17.610 -33.127 18.172 1.00 21.37 C ATOM 792 O ASP A 611 -17.309 -34.318 18.142 1.00 29.77 O ATOM 793 CB ASP A 611 -19.709 -33.283 19.578 1.00 32.61 C ATOM 794 CG ASP A 611 -19.114 -32.703 20.852 1.00 39.76 C ATOM 795 OD1 ASP A 611 -18.544 -31.596 20.807 1.00 31.93 O ATOM 796 OD2 ASP A 611 -19.227 -33.358 21.912 1.00 56.03 O ATOM 797 H ASP A 611 -19.561 -34.148 16.772 1.00 0.00 H ATOM 798 N PRO A 612 -16.695 -32.147 18.095 1.00 20.22 N ATOM 799 CA PRO A 612 -16.968 -30.710 18.220 1.00 16.25 C ATOM 800 C PRO A 612 -17.505 -30.063 16.948 1.00 16.26 C ATOM 801 O PRO A 612 -17.405 -30.644 15.871 1.00 16.23 O ATOM 802 CB PRO A 612 -15.593 -30.137 18.555 1.00 17.82 C ATOM 803 CG PRO A 612 -14.653 -31.042 17.834 1.00 22.51 C ATOM 804 CD PRO A 612 -15.251 -32.412 17.950 1.00 18.45 C ATOM 805 N LEU A 613 -18.069 -28.866 17.076 1.00 14.95 N ATOM 806 CA LEU A 613 -18.317 -28.041 15.901 1.00 14.60 C ATOM 807 C LEU A 613 -16.984 -27.487 15.445 1.00 13.44 C ATOM 808 O LEU A 613 -16.170 -27.072 16.264 1.00 15.21 O ATOM 809 CB LEU A 613 -19.289 -26.903 16.204 1.00 12.39 C ATOM 810 CG LEU A 613 -20.716 -27.327 16.545 1.00 17.53 C ATOM 811 CD1 LEU A 613 -21.593 -26.087 16.693 1.00 17.90 C ATOM 812 CD2 LEU A 613 -21.270 -28.264 15.485 1.00 30.02 C ATOM 813 H LEU A 613 -18.334 -28.517 18.019 1.00 0.00 H ATOM 814 N ILE A 614 -16.756 -27.477 14.137 1.00 8.48 N ATOM 815 CA ILE A 614 -15.455 -27.081 13.614 1.00 6.72 C ATOM 816 C ILE A 614 -15.604 -26.047 12.514 1.00 9.32 C ATOM 817 O ILE A 614 -16.395 -26.226 11.584 1.00 9.47 O ATOM 818 CB ILE A 614 -14.688 -28.290 13.066 1.00 11.52 C ATOM 819 CG1 ILE A 614 -14.317 -29.236 14.205 1.00 15.15 C ATOM 820 CG2 ILE A 614 -13.436 -27.840 12.349 1.00 16.05 C ATOM 821 CD1 ILE A 614 -13.913 -30.609 13.729 1.00 22.25 C ATOM 822 H ILE A 614 -17.513 -27.754 13.480 1.00 0.00 H ATOM 823 N MET A 615 -14.848 -24.964 12.646 1.00 7.28 N ATOM 824 CA MET A 615 -14.787 -23.904 11.660 1.00 7.76 C ATOM 825 C MET A 615 -13.343 -23.788 11.174 1.00 12.51 C ATOM 826 O MET A 615 -12.404 -23.911 11.969 1.00 11.69 O ATOM 827 CB MET A 615 -15.268 -22.594 12.290 1.00 14.12 C ATOM 828 CG MET A 615 -15.363 -21.423 11.384 1.00 26.10 C ATOM 829 SD MET A 615 -16.244 -20.108 12.253 1.00 21.99 S ATOM 830 CE MET A 615 -17.910 -20.775 12.309 1.00 21.86 C ATOM 831 H MET A 615 -14.268 -24.871 13.504 1.00 0.00 H ATOM 832 N VAL A 616 -13.158 -23.553 9.881 1.00 7.05 N ATOM 833 CA VAL A 616 -11.819 -23.585 9.293 1.00 6.32 C ATOM 834 C VAL A 616 -11.490 -22.248 8.656 1.00 9.15 C ATOM 835 O VAL A 616 -12.272 -21.717 7.864 1.00 7.51 O ATOM 836 CB VAL A 616 -11.701 -24.713 8.251 1.00 7.09 C ATOM 837 CG1 VAL A 616 -10.271 -24.796 7.683 1.00 9.47 C ATOM 838 CG2 VAL A 616 -12.113 -26.037 8.872 1.00 12.86 C ATOM 839 H VAL A 616 -13.978 -23.343 9.276 1.00 0.00 H ATOM 840 N PHE A 617 -10.331 -21.704 9.033 1.00 5.42 N ATOM 841 CA PHE A 617 -9.867 -20.382 8.606 1.00 8.91 C ATOM 842 C PHE A 617 -8.540 -20.441 7.885 1.00 7.11 C ATOM 843 O PHE A 617 -7.761 -21.380 8.056 1.00 8.18 O ATOM 844 CB PHE A 617 -9.671 -19.444 9.807 1.00 11.72 C ATOM 845 CG PHE A 617 -10.898 -19.222 10.631 1.00 8.60 C ATOM 846 CD1 PHE A 617 -11.757 -18.172 10.340 1.00 16.29 C ATOM 847 CD2 PHE A 617 -11.172 -20.040 11.710 1.00 16.33 C ATOM 848 CE1 PHE A 617 -12.888 -17.957 11.109 1.00 12.93 C ATOM 849 CE2 PHE A 617 -12.298 -19.826 12.482 1.00 21.79 C ATOM 850 CZ PHE A 617 -13.151 -18.781 12.175 1.00 11.77 C ATOM 851 H PHE A 617 -9.719 -22.253 9.670 1.00 0.00 H ATOM 852 N GLU A 618 -8.259 -19.400 7.113 1.00 6.51 N ATOM 853 CA GLU A 618 -6.930 -19.234 6.558 1.00 8.55 C ATOM 854 C GLU A 618 -5.925 -19.073 7.699 1.00 10.54 C ATOM 855 O GLU A 618 -6.203 -18.381 8.675 1.00 10.28 O ATOM 856 CB GLU A 618 -6.911 -18.024 5.629 1.00 11.19 C ATOM 857 CG GLU A 618 -5.544 -17.556 5.257 1.00 17.01 C ATOM 858 CD GLU A 618 -5.596 -16.251 4.499 1.00 17.89 C ATOM 859 OE1 GLU A 618 -6.282 -15.317 4.966 1.00 16.58 O ATOM 860 OE2 GLU A 618 -4.963 -16.182 3.428 1.00 28.62 O ATOM 861 H GLU A 618 -8.997 -18.698 6.904 1.00 0.00 H ATOM 862 N TYR A 619 -4.773 -19.728 7.588 1.00 7.38 N ATOM 863 CA TYR A 619 -3.720 -19.597 8.590 1.00 7.69 C ATOM 864 C TYR A 619 -2.875 -18.343 8.348 1.00 8.63 C ATOM 865 O TYR A 619 -2.393 -18.097 7.239 1.00 10.00 O ATOM 866 CB TYR A 619 -2.833 -20.839 8.594 1.00 9.67 C ATOM 867 CG TYR A 619 -1.661 -20.749 9.548 1.00 12.07 C ATOM 868 CD1 TYR A 619 -1.869 -20.545 10.907 1.00 12.56 C ATOM 869 CD2 TYR A 619 -0.355 -20.889 9.090 1.00 12.12 C ATOM 870 CE1 TYR A 619 -0.809 -20.463 11.788 1.00 16.50 C ATOM 871 CE2 TYR A 619 0.714 -20.817 9.970 1.00 11.85 C ATOM 872 CZ TYR A 619 0.473 -20.601 11.315 1.00 16.94 C ATOM 873 OH TYR A 619 1.519 -20.528 12.207 1.00 21.37 O ATOM 874 HH TYR A 619 2.025 -21.379 12.191 1.00 0.00 H ATOM 875 H TYR A 619 -4.619 -20.348 6.768 1.00 0.00 H ATOM 876 N MET A 620 -2.735 -17.539 9.395 1.00 7.19 N ATOM 877 CA MET A 620 -1.980 -16.298 9.339 1.00 7.14 C ATOM 878 C MET A 620 -0.765 -16.456 10.235 1.00 8.45 C ATOM 879 O MET A 620 -0.875 -16.411 11.462 1.00 9.15 O ATOM 880 CB MET A 620 -2.851 -15.121 9.775 1.00 7.36 C ATOM 881 CG MET A 620 -4.055 -14.898 8.857 1.00 8.79 C ATOM 882 SD MET A 620 -3.548 -14.268 7.245 1.00 15.94 S ATOM 883 CE MET A 620 -3.373 -12.521 7.634 1.00 13.22 C ATOM 884 H MET A 620 -3.184 -17.808 10.293 1.00 0.00 H ATOM 885 N LYS A 621 0.394 -16.653 9.618 1.00 9.15 N ATOM 886 CA LYS A 621 1.512 -17.270 10.323 1.00 7.49 C ATOM 887 C LYS A 621 2.173 -16.393 11.375 1.00 12.84 C ATOM 888 O LYS A 621 2.928 -16.897 12.200 1.00 16.50 O ATOM 889 CB LYS A 621 2.564 -17.734 9.312 1.00 13.43 C ATOM 890 CG LYS A 621 3.223 -16.615 8.526 1.00 16.00 C ATOM 891 CD LYS A 621 4.331 -17.198 7.652 1.00 20.16 C ATOM 892 CE LYS A 621 4.964 -16.146 6.776 1.00 32.46 C ATOM 893 NZ LYS A 621 6.102 -16.728 6.004 1.00 34.25 N ATOM 894 HZ1 LYS A 621 6.817 -17.094 6.665 1.00 0.00 H ATOM 895 HZ2 LYS A 621 5.753 -17.503 5.405 1.00 0.00 H ATOM 896 HZ3 LYS A 621 6.527 -15.991 5.406 1.00 0.00 H ATOM 897 H LYS A 621 0.506 -16.365 8.625 1.00 0.00 H ATOM 898 N HIS A 622 1.911 -15.086 11.361 1.00 9.71 N ATOM 899 CA HIS A 622 2.519 -14.228 12.370 1.00 9.32 C ATOM 900 C HIS A 622 1.573 -13.890 13.509 1.00 10.87 C ATOM 901 O HIS A 622 1.931 -13.124 14.396 1.00 16.58 O ATOM 902 CB HIS A 622 3.064 -12.950 11.731 1.00 11.38 C ATOM 903 CG HIS A 622 4.263 -13.201 10.870 1.00 15.72 C ATOM 904 ND1 HIS A 622 5.457 -13.658 11.380 1.00 21.40 N ATOM 905 CD2 HIS A 622 4.437 -13.107 9.532 1.00 23.56 C ATOM 906 CE1 HIS A 622 6.325 -13.809 10.396 1.00 24.35 C ATOM 907 NE2 HIS A 622 5.731 -13.485 9.264 1.00 22.79 N ATOM 908 H HIS A 622 1.280 -14.683 10.639 1.00 0.00 H ATOM 909 N GLY A 623 0.380 -14.484 13.506 1.00 9.14 N ATOM 910 CA GLY A 623 -0.497 -14.395 14.664 1.00 8.99 C ATOM 911 C GLY A 623 -1.126 -13.027 14.821 1.00 11.42 C ATOM 912 O GLY A 623 -1.267 -12.295 13.841 1.00 10.84 O ATOM 913 H GLY A 623 0.073 -15.017 12.667 1.00 0.00 H ATOM 914 N ASP A 624 -1.504 -12.663 16.040 1.00 6.52 N ATOM 915 CA ASP A 624 -2.261 -11.427 16.207 1.00 6.83 C ATOM 916 C ASP A 624 -1.342 -10.223 16.169 1.00 7.20 C ATOM 917 O ASP A 624 -0.162 -10.288 16.532 1.00 7.74 O ATOM 918 CB ASP A 624 -3.089 -11.440 17.497 1.00 9.96 C ATOM 919 CG ASP A 624 -2.273 -11.153 18.731 1.00 18.20 C ATOM 920 OD1 ASP A 624 -2.083 -9.960 19.061 1.00 14.08 O ATOM 921 OD2 ASP A 624 -1.837 -12.122 19.394 1.00 28.11 O ATOM 922 H ASP A 624 -1.264 -13.250 16.864 1.00 0.00 H ATOM 923 N LEU A 625 -1.906 -9.117 15.698 1.00 5.50 N ATOM 924 CA LEU A 625 -1.136 -7.915 15.446 1.00 6.85 C ATOM 925 C LEU A 625 -0.616 -7.279 16.732 1.00 6.02 C ATOM 926 O LEU A 625 0.448 -6.657 16.729 1.00 7.11 O ATOM 927 CB LEU A 625 -1.987 -6.920 14.650 1.00 5.37 C ATOM 928 CG LEU A 625 -1.360 -5.559 14.376 1.00 5.05 C ATOM 929 CD1 LEU A 625 -0.065 -5.712 13.579 1.00 7.71 C ATOM 930 CD2 LEU A 625 -2.376 -4.704 13.637 1.00 4.43 C ATOM 931 H LEU A 625 -2.928 -9.113 15.505 1.00 0.00 H ATOM 932 N ASN A 626 -1.329 -7.435 17.845 1.00 6.39 N ATOM 933 CA ASN A 626 -0.821 -6.811 19.055 1.00 8.04 C ATOM 934 C ASN A 626 0.497 -7.443 19.503 1.00 9.06 C ATOM 935 O ASN A 626 1.461 -6.738 19.794 1.00 9.52 O ATOM 936 CB ASN A 626 -1.828 -6.875 20.195 1.00 5.48 C ATOM 937 CG ASN A 626 -1.331 -6.116 21.423 1.00 9.15 C ATOM 938 OD1 ASN A 626 -0.808 -6.706 22.362 1.00 10.60 O ATOM 939 ND2 ASN A 626 -1.443 -4.796 21.383 1.00 11.19 N ATOM 940 HD22 ASN A 626 -1.894 -4.337 20.566 1.00 0.00 H ATOM 941 HD21 ASN A 626 -1.080 -4.219 22.168 1.00 0.00 H ATOM 942 H ASN A 626 -2.214 -7.981 17.849 1.00 0.00 H ATOM 943 N LYS A 627 0.544 -8.770 19.550 1.00 10.68 N ATOM 944 CA LYS A 627 1.778 -9.467 19.875 1.00 10.14 C ATOM 945 C LYS A 627 2.859 -9.195 18.839 1.00 9.63 C ATOM 946 O LYS A 627 4.037 -9.074 19.182 1.00 10.68 O ATOM 947 CB LYS A 627 1.534 -10.972 19.994 1.00 13.40 C ATOM 948 CG LYS A 627 0.860 -11.349 21.304 1.00 28.68 C ATOM 949 CD LYS A 627 0.960 -12.836 21.591 1.00 39.01 C ATOM 950 CE LYS A 627 0.436 -13.144 22.989 1.00 48.89 C ATOM 951 NZ LYS A 627 -0.068 -14.541 23.114 1.00 57.96 N ATOM 952 HZ1 LYS A 627 -0.846 -14.689 22.440 1.00 0.00 H ATOM 953 HZ2 LYS A 627 0.704 -15.207 22.907 1.00 0.00 H ATOM 954 HZ3 LYS A 627 -0.412 -14.699 24.083 1.00 0.00 H ATOM 955 H LYS A 627 -0.316 -9.319 19.351 1.00 0.00 H ATOM 956 N PHE A 628 2.457 -9.096 17.574 1.00 7.62 N ATOM 957 CA PHE A 628 3.407 -8.770 16.507 1.00 6.83 C ATOM 958 C PHE A 628 4.050 -7.407 16.757 1.00 8.98 C ATOM 959 O PHE A 628 5.277 -7.261 16.676 1.00 10.90 O ATOM 960 CB PHE A 628 2.700 -8.785 15.149 1.00 7.97 C ATOM 961 CG PHE A 628 3.615 -8.571 13.977 1.00 8.85 C ATOM 962 CD1 PHE A 628 4.298 -9.641 13.412 1.00 11.65 C ATOM 963 CD2 PHE A 628 3.758 -7.312 13.416 1.00 10.95 C ATOM 964 CE1 PHE A 628 5.115 -9.447 12.309 1.00 19.80 C ATOM 965 CE2 PHE A 628 4.578 -7.106 12.320 1.00 14.05 C ATOM 966 CZ PHE A 628 5.256 -8.172 11.766 1.00 16.22 C ATOM 967 H PHE A 628 1.456 -9.252 17.340 1.00 0.00 H ATOM 968 N LEU A 629 3.222 -6.406 17.051 1.00 7.31 N ATOM 969 CA LEU A 629 3.737 -5.067 17.314 1.00 8.20 C ATOM 970 C LEU A 629 4.694 -5.080 18.503 1.00 12.22 C ATOM 971 O LEU A 629 5.777 -4.489 18.460 1.00 9.48 O ATOM 972 CB LEU A 629 2.584 -4.093 17.573 1.00 7.38 C ATOM 973 CG LEU A 629 1.742 -3.695 16.364 1.00 6.92 C ATOM 974 CD1 LEU A 629 0.480 -2.945 16.812 1.00 5.86 C ATOM 975 CD2 LEU A 629 2.562 -2.841 15.403 1.00 10.91 C ATOM 976 H LEU A 629 2.198 -6.581 17.093 1.00 0.00 H ATOM 977 N ARG A 630 4.296 -5.761 19.572 1.00 10.17 N ATOM 978 CA ARG A 630 5.129 -5.809 20.770 1.00 9.77 C ATOM 979 C ARG A 630 6.474 -6.474 20.526 1.00 13.75 C ATOM 980 O ARG A 630 7.493 -6.050 21.088 1.00 15.76 O ATOM 981 CB ARG A 630 4.390 -6.526 21.897 1.00 8.37 C ATOM 982 CG ARG A 630 3.256 -5.688 22.503 1.00 11.54 C ATOM 983 CD ARG A 630 2.454 -6.517 23.504 1.00 15.91 C ATOM 984 NE ARG A 630 1.360 -5.770 24.128 1.00 16.50 N ATOM 985 CZ ARG A 630 1.487 -4.995 25.200 1.00 21.13 C ATOM 986 NH1 ARG A 630 2.672 -4.837 25.778 1.00 24.09 N ATOM 987 NH2 ARG A 630 0.426 -4.374 25.694 1.00 18.65 N ATOM 988 HE ARG A 630 0.415 -5.852 23.701 1.00 0.00 H ATOM 989 HH12 ARG A 630 2.765 -4.229 26.617 1.00 0.00 H ATOM 990 HH11 ARG A 630 3.508 -5.321 25.392 1.00 0.00 H ATOM 991 HH22 ARG A 630 0.523 -3.767 26.533 1.00 0.00 H ATOM 992 HH21 ARG A 630 -0.503 -4.494 25.243 1.00 0.00 H ATOM 993 H ARG A 630 3.385 -6.263 19.555 1.00 0.00 H ATOM 994 N ALA A 631 6.475 -7.501 19.684 1.00 13.05 N ATOM 995 CA ALA A 631 7.693 -8.228 19.347 1.00 16.59 C ATOM 996 C ALA A 631 8.679 -7.342 18.608 1.00 15.37 C ATOM 997 O ALA A 631 9.870 -7.625 18.586 1.00 18.22 O ATOM 998 CB ALA A 631 7.371 -9.448 18.512 1.00 13.53 C ATOM 999 H ALA A 631 5.577 -7.797 19.251 1.00 0.00 H ATOM 1000 N HIS A 632 8.181 -6.279 17.987 1.00 14.63 N ATOM 1001 CA HIS A 632 9.042 -5.359 17.248 1.00 15.19 C ATOM 1002 C HIS A 632 9.343 -4.089 18.026 1.00 14.61 C ATOM 1003 O HIS A 632 9.992 -3.193 17.519 1.00 25.21 O ATOM 1004 CB HIS A 632 8.403 -5.000 15.905 1.00 16.39 C ATOM 1005 CG HIS A 632 8.401 -6.125 14.923 1.00 20.51 C ATOM 1006 ND1 HIS A 632 7.597 -7.234 15.065 1.00 22.41 N ATOM 1007 CD2 HIS A 632 9.109 -6.317 13.785 1.00 25.21 C ATOM 1008 CE1 HIS A 632 7.808 -8.062 14.058 1.00 27.71 C ATOM 1009 NE2 HIS A 632 8.721 -7.530 13.267 1.00 29.83 N ATOM 1010 H HIS A 632 7.158 -6.098 18.028 1.00 0.00 H ATOM 1011 N GLY A 633 8.889 -4.017 19.268 1.00 14.60 N ATOM 1012 CA GLY A 633 8.998 -2.785 20.030 1.00 15.26 C ATOM 1013 C GLY A 633 10.245 -2.701 20.893 1.00 22.18 C ATOM 1014 O GLY A 633 10.982 -3.674 21.017 1.00 21.19 O ATOM 1015 H GLY A 633 8.449 -4.853 19.703 1.00 0.00 H ATOM 1016 N PRO A 634 10.483 -1.526 21.491 1.00 27.90 N ATOM 1017 CA PRO A 634 11.650 -1.262 22.344 1.00 29.33 C ATOM 1018 C PRO A 634 11.711 -2.172 23.575 1.00 27.72 C ATOM 1019 O PRO A 634 12.808 -2.496 24.035 1.00 30.47 O ATOM 1020 CB PRO A 634 11.456 0.203 22.762 1.00 33.28 C ATOM 1021 CG PRO A 634 10.545 0.784 21.730 1.00 35.35 C ATOM 1022 CD PRO A 634 9.630 -0.333 21.338 1.00 27.49 C ATOM 1023 N ASP A 635 10.553 -2.586 24.088 1.00 30.60 N ATOM 1024 CA ASP A 635 10.503 -3.423 25.286 1.00 35.31 C ATOM 1025 C ASP A 635 10.840 -4.872 24.960 1.00 43.58 C ATOM 1026 O ASP A 635 10.885 -5.724 25.847 1.00 46.42 O ATOM 1027 CB ASP A 635 9.129 -3.339 25.958 1.00 37.14 C ATOM 1028 CG ASP A 635 8.830 -1.951 26.506 1.00 48.73 C ATOM 1029 OD1 ASP A 635 9.786 -1.196 26.798 1.00 47.19 O ATOM 1030 OD2 ASP A 635 7.636 -1.613 26.646 1.00 55.24 O ATOM 1031 H ASP A 635 9.664 -2.307 23.626 1.00 0.00 H ATOM 1032 N ALA A 636 11.085 -5.145 23.684 1.00 37.46 N ATOM 1033 CA ALA A 636 11.522 -6.466 23.260 1.00 35.23 C ATOM 1034 C ALA A 636 13.048 -6.522 23.181 1.00 32.88 C ATOM 1035 O ALA A 636 13.628 -7.593 23.000 1.00 41.32 O ATOM 1036 CB ALA A 636 10.901 -6.828 21.917 1.00 23.68 C ATOM 1037 H ALA A 636 10.962 -4.397 22.972 1.00 0.00 H TER 1038 ALA A 636 ATOM 1039 N GLY A 649 14.094 -6.232 13.312 1.00 58.27 N ATOM 1040 CA GLY A 649 14.359 -5.152 14.247 1.00 60.24 C ATOM 1041 C GLY A 649 13.099 -4.422 14.682 1.00 58.09 C ATOM 1042 O GLY A 649 12.233 -4.992 15.346 1.00 58.21 O ATOM 1043 HN3 GLY A 649 13.640 -5.847 12.459 1.00 0.00 H ATOM 1044 HN2 GLY A 649 13.463 -6.928 13.758 1.00 0.00 H ATOM 1045 HN1 GLY A 649 14.990 -6.692 13.052 1.00 0.00 H ATOM 1046 N GLU A 650 13.003 -3.150 14.314 1.00 54.41 N ATOM 1047 CA GLU A 650 11.812 -2.362 14.618 1.00 47.96 C ATOM 1048 C GLU A 650 11.029 -2.040 13.348 1.00 39.72 C ATOM 1049 O GLU A 650 11.461 -2.363 12.244 1.00 36.12 O ATOM 1050 CB GLU A 650 12.192 -1.081 15.374 1.00 53.07 C ATOM 1051 CG GLU A 650 11.393 -0.907 16.652 1.00 59.49 C ATOM 1052 CD GLU A 650 12.054 -0.049 17.714 1.00 66.20 C ATOM 1053 OE1 GLU A 650 13.232 -0.293 18.047 1.00 63.66 O ATOM 1054 OE2 GLU A 650 11.374 0.852 18.249 1.00 70.77 O ATOM 1055 H GLU A 650 13.791 -2.707 13.800 1.00 0.00 H ATOM 1056 N LEU A 651 9.863 -1.426 13.507 1.00 27.52 N ATOM 1057 CA LEU A 651 9.019 -1.114 12.363 1.00 20.19 C ATOM 1058 C LEU A 651 9.224 0.328 11.950 1.00 23.41 C ATOM 1059 O LEU A 651 9.269 1.225 12.791 1.00 31.31 O ATOM 1060 CB LEU A 651 7.541 -1.371 12.688 1.00 21.21 C ATOM 1061 CG LEU A 651 7.146 -2.838 12.852 1.00 23.37 C ATOM 1062 CD1 LEU A 651 5.792 -2.927 13.537 1.00 24.32 C ATOM 1063 CD2 LEU A 651 7.098 -3.532 11.502 1.00 23.58 C ATOM 1064 H LEU A 651 9.548 -1.164 14.463 1.00 0.00 H ATOM 1065 N GLY A 652 9.361 0.552 10.652 1.00 16.86 N ATOM 1066 CA GLY A 652 9.556 1.897 10.151 1.00 19.83 C ATOM 1067 C GLY A 652 8.223 2.581 9.957 1.00 20.63 C ATOM 1068 O GLY A 652 7.169 1.949 10.077 1.00 13.16 O ATOM 1069 H GLY A 652 9.328 -0.246 9.986 1.00 0.00 H ATOM 1070 N LEU A 653 8.272 3.873 9.654 1.00 17.34 N ATOM 1071 CA LEU A 653 7.064 4.647 9.419 1.00 17.39 C ATOM 1072 C LEU A 653 6.271 4.058 8.257 1.00 15.57 C ATOM 1073 O LEU A 653 5.059 3.925 8.344 1.00 13.06 O ATOM 1074 CB LEU A 653 7.408 6.115 9.148 1.00 13.06 C ATOM 1075 CG LEU A 653 6.244 7.043 8.795 1.00 16.41 C ATOM 1076 CD1 LEU A 653 5.172 7.010 9.890 1.00 13.15 C ATOM 1077 CD2 LEU A 653 6.750 8.463 8.580 1.00 19.75 C ATOM 1078 H LEU A 653 9.197 4.343 9.583 1.00 0.00 H ATOM 1079 N SER A 654 6.957 3.681 7.181 1.00 11.63 N ATOM 1080 CA SER A 654 6.283 3.086 6.028 1.00 12.75 C ATOM 1081 C SER A 654 5.530 1.812 6.422 1.00 11.48 C ATOM 1082 O SER A 654 4.389 1.584 5.988 1.00 11.49 O ATOM 1083 CB SER A 654 7.294 2.775 4.924 1.00 23.17 C ATOM 1084 OG SER A 654 6.640 2.230 3.789 1.00 33.46 O ATOM 1085 HG SER A 654 7.309 2.035 3.086 1.00 0.00 H ATOM 1086 H SER A 654 7.989 3.812 7.160 1.00 0.00 H ATOM 1087 N GLN A 655 6.168 0.991 7.247 1.00 9.22 N ATOM 1088 CA GLN A 655 5.566 -0.267 7.678 1.00 8.50 C ATOM 1089 C GLN A 655 4.374 -0.011 8.582 1.00 9.54 C ATOM 1090 O GLN A 655 3.337 -0.657 8.437 1.00 8.21 O ATOM 1091 CB GLN A 655 6.595 -1.136 8.379 1.00 12.06 C ATOM 1092 CG GLN A 655 7.623 -1.681 7.400 1.00 15.14 C ATOM 1093 CD GLN A 655 8.842 -2.216 8.094 1.00 28.14 C ATOM 1094 OE1 GLN A 655 9.378 -1.581 8.998 1.00 30.07 O ATOM 1095 NE2 GLN A 655 9.288 -3.400 7.685 1.00 36.10 N ATOM 1096 HE22 GLN A 655 8.801 -3.901 6.915 1.00 0.00 H ATOM 1097 HE21 GLN A 655 10.124 -3.825 8.135 1.00 0.00 H ATOM 1098 H GLN A 655 7.114 1.249 7.593 1.00 0.00 H ATOM 1099 N MET A 656 4.513 0.945 9.490 1.00 8.87 N ATOM 1100 CA MET A 656 3.405 1.291 10.377 1.00 9.74 C ATOM 1101 C MET A 656 2.221 1.827 9.591 1.00 9.56 C ATOM 1102 O MET A 656 1.077 1.487 9.874 1.00 8.09 O ATOM 1103 CB MET A 656 3.843 2.312 11.419 1.00 12.15 C ATOM 1104 CG MET A 656 4.767 1.734 12.455 1.00 11.86 C ATOM 1105 SD MET A 656 4.999 2.904 13.803 1.00 14.59 S ATOM 1106 CE MET A 656 5.955 1.887 14.909 1.00 17.31 C ATOM 1107 H MET A 656 5.417 1.452 9.571 1.00 0.00 H ATOM 1108 N LEU A 657 2.492 2.669 8.598 1.00 7.73 N ATOM 1109 CA LEU A 657 1.421 3.225 7.786 1.00 6.31 C ATOM 1110 C LEU A 657 0.769 2.140 6.925 1.00 6.41 C ATOM 1111 O LEU A 657 -0.423 2.178 6.672 1.00 8.92 O ATOM 1112 CB LEU A 657 1.958 4.367 6.906 1.00 9.67 C ATOM 1113 CG LEU A 657 2.266 5.676 7.640 1.00 12.92 C ATOM 1114 CD1 LEU A 657 2.851 6.714 6.675 1.00 17.23 C ATOM 1115 CD2 LEU A 657 1.018 6.241 8.318 1.00 12.15 C ATOM 1116 H LEU A 657 3.479 2.932 8.400 1.00 0.00 H ATOM 1117 N HIS A 658 1.556 1.173 6.470 1.00 6.83 N ATOM 1118 CA HIS A 658 1.003 0.093 5.671 1.00 7.83 C ATOM 1119 C HIS A 658 0.066 -0.769 6.520 1.00 7.14 C ATOM 1120 O HIS A 658 -0.991 -1.175 6.062 1.00 5.59 O ATOM 1121 CB HIS A 658 2.118 -0.760 5.079 1.00 8.99 C ATOM 1122 CG HIS A 658 1.621 -1.879 4.219 1.00 5.56 C ATOM 1123 ND1 HIS A 658 0.649 -1.699 3.259 1.00 7.42 N ATOM 1124 CD2 HIS A 658 1.972 -3.185 4.162 1.00 6.22 C ATOM 1125 CE1 HIS A 658 0.418 -2.850 2.651 1.00 9.75 C ATOM 1126 NE2 HIS A 658 1.209 -3.768 3.179 1.00 8.67 N ATOM 1127 H HIS A 658 2.573 1.188 6.686 1.00 0.00 H ATOM 1128 N ILE A 659 0.465 -1.057 7.758 1.00 5.68 N ATOM 1129 CA ILE A 659 -0.399 -1.800 8.680 1.00 5.31 C ATOM 1130 C ILE A 659 -1.706 -1.033 8.878 1.00 5.51 C ATOM 1131 O ILE A 659 -2.793 -1.596 8.758 1.00 5.49 O ATOM 1132 CB ILE A 659 0.294 -2.032 10.034 1.00 6.29 C ATOM 1133 CG1 ILE A 659 1.465 -3.000 9.847 1.00 7.77 C ATOM 1134 CG2 ILE A 659 -0.693 -2.577 11.060 1.00 6.46 C ATOM 1135 CD1 ILE A 659 2.409 -3.063 11.047 1.00 9.04 C ATOM 1136 H ILE A 659 1.406 -0.749 8.076 1.00 0.00 H ATOM 1137 N ALA A 660 -1.584 0.260 9.154 1.00 6.96 N ATOM 1138 CA ALA A 660 -2.743 1.110 9.396 1.00 7.90 C ATOM 1139 C ALA A 660 -3.654 1.171 8.176 1.00 4.83 C ATOM 1140 O ALA A 660 -4.872 1.081 8.300 1.00 5.35 O ATOM 1141 CB ALA A 660 -2.290 2.515 9.786 1.00 6.73 C ATOM 1142 H ALA A 660 -0.633 0.679 9.199 1.00 0.00 H ATOM 1143 N SER A 661 -3.060 1.324 6.998 1.00 5.41 N ATOM 1144 CA SER A 661 -3.834 1.445 5.763 1.00 6.70 C ATOM 1145 C SER A 661 -4.610 0.180 5.459 1.00 5.96 C ATOM 1146 O SER A 661 -5.740 0.228 4.983 1.00 6.85 O ATOM 1147 CB SER A 661 -2.916 1.771 4.587 1.00 8.73 C ATOM 1148 OG SER A 661 -2.457 3.107 4.693 1.00 12.91 O ATOM 1149 HG SER A 661 -1.956 3.216 5.540 1.00 0.00 H ATOM 1150 H SER A 661 -2.022 1.359 6.953 1.00 0.00 H ATOM 1151 N GLN A 662 -3.991 -0.960 5.719 1.00 4.47 N ATOM 1152 CA GLN A 662 -4.665 -2.227 5.479 1.00 4.69 C ATOM 1153 C GLN A 662 -5.873 -2.401 6.379 1.00 5.19 C ATOM 1154 O GLN A 662 -6.920 -2.869 5.942 1.00 5.90 O ATOM 1155 CB GLN A 662 -3.701 -3.386 5.687 1.00 5.87 C ATOM 1156 CG GLN A 662 -2.634 -3.475 4.614 1.00 3.83 C ATOM 1157 CD GLN A 662 -1.690 -4.597 4.917 1.00 5.70 C ATOM 1158 OE1 GLN A 662 -1.889 -5.722 4.465 1.00 9.89 O ATOM 1159 NE2 GLN A 662 -0.670 -4.314 5.723 1.00 5.34 N ATOM 1160 HE22 GLN A 662 -0.543 -3.346 6.081 1.00 0.00 H ATOM 1161 HE21 GLN A 662 0.000 -5.061 5.996 1.00 0.00 H ATOM 1162 H GLN A 662 -3.022 -0.951 6.095 1.00 0.00 H ATOM 1163 N ILE A 663 -5.723 -2.054 7.648 1.00 4.41 N ATOM 1164 CA ILE A 663 -6.864 -2.111 8.565 1.00 4.06 C ATOM 1165 C ILE A 663 -7.957 -1.148 8.097 1.00 4.34 C ATOM 1166 O ILE A 663 -9.137 -1.490 8.083 1.00 5.37 O ATOM 1167 CB ILE A 663 -6.420 -1.801 10.012 1.00 4.39 C ATOM 1168 CG1 ILE A 663 -5.499 -2.919 10.512 1.00 4.83 C ATOM 1169 CG2 ILE A 663 -7.636 -1.685 10.961 1.00 5.68 C ATOM 1170 CD1 ILE A 663 -4.759 -2.570 11.808 1.00 5.01 C ATOM 1171 H ILE A 663 -4.794 -1.741 7.994 1.00 0.00 H ATOM 1172 N ALA A 664 -7.556 0.050 7.682 1.00 4.52 N ATOM 1173 CA ALA A 664 -8.518 1.040 7.208 1.00 4.19 C ATOM 1174 C ALA A 664 -9.258 0.512 5.977 1.00 5.88 C ATOM 1175 O ALA A 664 -10.463 0.696 5.847 1.00 6.19 O ATOM 1176 CB ALA A 664 -7.808 2.368 6.901 1.00 5.41 C ATOM 1177 H ALA A 664 -6.543 0.285 7.695 1.00 0.00 H ATOM 1178 N SER A 665 -8.535 -0.172 5.096 1.00 6.73 N ATOM 1179 CA SER A 665 -9.144 -0.769 3.910 1.00 5.43 C ATOM 1180 C SER A 665 -10.219 -1.797 4.286 1.00 6.22 C ATOM 1181 O SER A 665 -11.320 -1.807 3.727 1.00 6.27 O ATOM 1182 CB SER A 665 -8.080 -1.429 3.042 1.00 8.06 C ATOM 1183 OG SER A 665 -8.693 -2.101 1.961 1.00 8.71 O ATOM 1184 HG SER A 665 -9.203 -1.451 1.416 1.00 0.00 H ATOM 1185 H SER A 665 -7.513 -0.285 5.255 1.00 0.00 H ATOM 1186 N GLY A 666 -9.891 -2.667 5.234 1.00 6.66 N ATOM 1187 CA GLY A 666 -10.864 -3.622 5.747 1.00 4.77 C ATOM 1188 C GLY A 666 -12.068 -2.921 6.340 1.00 5.85 C ATOM 1189 O GLY A 666 -13.205 -3.363 6.182 1.00 6.24 O ATOM 1190 H GLY A 666 -8.924 -2.667 5.616 1.00 0.00 H ATOM 1191 N MET A 667 -11.830 -1.812 7.030 1.00 6.05 N ATOM 1192 CA MET A 667 -12.936 -1.078 7.628 1.00 4.25 C ATOM 1193 C MET A 667 -13.790 -0.355 6.593 1.00 4.76 C ATOM 1194 O MET A 667 -14.988 -0.213 6.801 1.00 7.26 O ATOM 1195 CB MET A 667 -12.420 -0.081 8.648 1.00 4.32 C ATOM 1196 CG MET A 667 -11.846 -0.740 9.890 1.00 4.35 C ATOM 1197 SD MET A 667 -11.300 0.527 11.033 1.00 9.34 S ATOM 1198 CE MET A 667 -12.850 1.404 11.313 1.00 7.83 C ATOM 1199 H MET A 667 -10.855 -1.468 7.143 1.00 0.00 H ATOM 1200 N VAL A 668 -13.179 0.118 5.502 1.00 4.62 N ATOM 1201 CA VAL A 668 -13.968 0.695 4.404 1.00 5.03 C ATOM 1202 C VAL A 668 -14.933 -0.359 3.882 1.00 6.31 C ATOM 1203 O VAL A 668 -16.117 -0.084 3.645 1.00 9.27 O ATOM 1204 CB VAL A 668 -13.080 1.213 3.246 1.00 5.46 C ATOM 1205 CG1 VAL A 668 -13.926 1.552 2.028 1.00 9.52 C ATOM 1206 CG2 VAL A 668 -12.299 2.437 3.688 1.00 5.18 C ATOM 1207 H VAL A 668 -12.142 0.078 5.430 1.00 0.00 H ATOM 1208 N TYR A 669 -14.427 -1.575 3.714 1.00 6.54 N ATOM 1209 CA TYR A 669 -15.267 -2.667 3.269 1.00 9.46 C ATOM 1210 C TYR A 669 -16.382 -2.958 4.275 1.00 8.09 C ATOM 1211 O TYR A 669 -17.538 -3.094 3.886 1.00 10.25 O ATOM 1212 CB TYR A 669 -14.444 -3.933 3.023 1.00 7.65 C ATOM 1213 CG TYR A 669 -15.336 -5.103 2.712 1.00 7.35 C ATOM 1214 CD1 TYR A 669 -15.952 -5.213 1.475 1.00 9.85 C ATOM 1215 CD2 TYR A 669 -15.612 -6.062 3.673 1.00 7.08 C ATOM 1216 CE1 TYR A 669 -16.810 -6.277 1.197 1.00 9.48 C ATOM 1217 CE2 TYR A 669 -16.453 -7.119 3.399 1.00 10.78 C ATOM 1218 CZ TYR A 669 -17.047 -7.220 2.162 1.00 11.82 C ATOM 1219 OH TYR A 669 -17.890 -8.274 1.893 1.00 13.28 O ATOM 1220 HH TYR A 669 -18.229 -8.196 0.966 1.00 0.00 H ATOM 1221 H TYR A 669 -13.419 -1.745 3.904 1.00 0.00 H ATOM 1222 N LEU A 670 -16.051 -3.060 5.564 1.00 5.10 N ATOM 1223 CA LEU A 670 -17.093 -3.325 6.555 1.00 6.23 C ATOM 1224 C LEU A 670 -18.154 -2.231 6.545 1.00 10.03 C ATOM 1225 O LEU A 670 -19.347 -2.514 6.601 1.00 7.78 O ATOM 1226 CB LEU A 670 -16.499 -3.457 7.958 1.00 7.03 C ATOM 1227 CG LEU A 670 -15.565 -4.656 8.131 1.00 6.98 C ATOM 1228 CD1 LEU A 670 -15.010 -4.675 9.560 1.00 8.86 C ATOM 1229 CD2 LEU A 670 -16.261 -5.973 7.762 1.00 7.32 C ATOM 1230 H LEU A 670 -15.060 -2.952 5.861 1.00 0.00 H ATOM 1231 N ALA A 671 -17.719 -0.980 6.468 1.00 8.12 N ATOM 1232 CA ALA A 671 -18.667 0.130 6.468 1.00 10.29 C ATOM 1233 C ALA A 671 -19.571 0.051 5.226 1.00 11.53 C ATOM 1234 O ALA A 671 -20.768 0.339 5.296 1.00 13.30 O ATOM 1235 CB ALA A 671 -17.928 1.451 6.531 1.00 12.94 C ATOM 1236 H ALA A 671 -16.698 -0.789 6.407 1.00 0.00 H ATOM 1237 N SER A 672 -19.008 -0.391 4.107 1.00 9.83 N ATOM 1238 CA SER A 672 -19.785 -0.519 2.866 1.00 13.12 C ATOM 1239 C SER A 672 -20.854 -1.600 2.962 1.00 20.97 C ATOM 1240 O SER A 672 -21.834 -1.573 2.212 1.00 15.46 O ATOM 1241 CB SER A 672 -18.861 -0.807 1.678 1.00 11.81 C ATOM 1242 OG SER A 672 -18.519 -2.183 1.581 1.00 13.41 O ATOM 1243 HG SER A 672 -18.053 -2.465 2.408 1.00 0.00 H ATOM 1244 H SER A 672 -18.001 -0.651 4.109 1.00 0.00 H ATOM 1245 N GLN A 673 -20.666 -2.545 3.882 1.00 13.78 N ATOM 1246 CA GLN A 673 -21.627 -3.626 4.112 1.00 9.32 C ATOM 1247 C GLN A 673 -22.513 -3.319 5.311 1.00 11.52 C ATOM 1248 O GLN A 673 -23.286 -4.171 5.758 1.00 15.03 O ATOM 1249 CB GLN A 673 -20.905 -4.960 4.337 1.00 10.29 C ATOM 1250 CG GLN A 673 -19.972 -5.348 3.207 1.00 13.12 C ATOM 1251 CD GLN A 673 -20.716 -5.505 1.898 1.00 18.37 C ATOM 1252 OE1 GLN A 673 -21.587 -6.365 1.770 1.00 23.21 O ATOM 1253 NE2 GLN A 673 -20.388 -4.663 0.924 1.00 21.50 N ATOM 1254 HE22 GLN A 673 -19.645 -3.952 1.079 1.00 0.00 H ATOM 1255 HE21 GLN A 673 -20.875 -4.715 0.006 1.00 0.00 H ATOM 1256 H GLN A 673 -19.802 -2.514 4.460 1.00 0.00 H ATOM 1257 N HIS A 674 -22.363 -2.109 5.842 1.00 11.34 N ATOM 1258 CA HIS A 674 -23.096 -1.655 7.017 1.00 13.77 C ATOM 1259 C HIS A 674 -22.894 -2.591 8.201 1.00 14.63 C ATOM 1260 O HIS A 674 -23.816 -2.871 8.973 1.00 15.18 O ATOM 1261 CB HIS A 674 -24.578 -1.501 6.677 1.00 23.95 C ATOM 1262 CG HIS A 674 -24.813 -0.602 5.506 1.00 22.43 C ATOM 1263 ND1 HIS A 674 -24.673 0.767 5.582 1.00 28.91 N ATOM 1264 CD2 HIS A 674 -25.134 -0.879 4.221 1.00 24.82 C ATOM 1265 CE1 HIS A 674 -24.916 1.298 4.397 1.00 30.31 C ATOM 1266 NE2 HIS A 674 -25.197 0.322 3.554 1.00 25.88 N ATOM 1267 H HIS A 674 -21.689 -1.454 5.397 1.00 0.00 H ATOM 1268 N PHE A 675 -21.663 -3.067 8.335 1.00 9.37 N ATOM 1269 CA PHE A 675 -21.299 -3.928 9.442 1.00 6.35 C ATOM 1270 C PHE A 675 -20.549 -3.125 10.480 1.00 10.06 C ATOM 1271 O PHE A 675 -19.523 -2.514 10.172 1.00 10.98 O ATOM 1272 CB PHE A 675 -20.436 -5.102 8.962 1.00 8.68 C ATOM 1273 CG PHE A 675 -19.996 -6.016 10.070 1.00 11.20 C ATOM 1274 CD1 PHE A 675 -20.842 -7.010 10.546 1.00 15.20 C ATOM 1275 CD2 PHE A 675 -18.744 -5.875 10.647 1.00 11.50 C ATOM 1276 CE1 PHE A 675 -20.440 -7.849 11.576 1.00 17.04 C ATOM 1277 CE2 PHE A 675 -18.332 -6.707 11.670 1.00 10.17 C ATOM 1278 CZ PHE A 675 -19.177 -7.701 12.137 1.00 12.40 C ATOM 1279 H PHE A 675 -20.942 -2.816 7.629 1.00 0.00 H ATOM 1280 N VAL A 676 -21.049 -3.138 11.710 1.00 6.12 N ATOM 1281 CA VAL A 676 -20.382 -2.464 12.813 1.00 6.18 C ATOM 1282 C VAL A 676 -19.683 -3.518 13.657 1.00 9.88 C ATOM 1283 O VAL A 676 -20.310 -4.459 14.150 1.00 9.22 O ATOM 1284 CB VAL A 676 -21.381 -1.640 13.663 1.00 11.52 C ATOM 1285 CG1 VAL A 676 -20.692 -1.013 14.863 1.00 11.59 C ATOM 1286 CG2 VAL A 676 -22.015 -0.555 12.805 1.00 12.77 C ATOM 1287 H VAL A 676 -21.940 -3.643 11.889 1.00 0.00 H ATOM 1288 N HIS A 677 -18.378 -3.360 13.811 1.00 6.20 N ATOM 1289 CA HIS A 677 -17.539 -4.396 14.394 1.00 7.84 C ATOM 1290 C HIS A 677 -17.605 -4.432 15.928 1.00 10.11 C ATOM 1291 O HIS A 677 -17.761 -5.505 16.521 1.00 9.38 O ATOM 1292 CB HIS A 677 -16.105 -4.174 13.911 1.00 6.48 C ATOM 1293 CG HIS A 677 -15.148 -5.242 14.328 1.00 9.66 C ATOM 1294 ND1 HIS A 677 -14.785 -5.444 15.639 1.00 6.78 N ATOM 1295 CD2 HIS A 677 -14.462 -6.156 13.601 1.00 11.70 C ATOM 1296 CE1 HIS A 677 -13.917 -6.438 15.709 1.00 9.96 C ATOM 1297 NE2 HIS A 677 -13.704 -6.885 14.485 1.00 9.34 N ATOM 1298 H HIS A 677 -17.939 -2.468 13.506 1.00 0.00 H ATOM 1299 N ARG A 678 -17.469 -3.256 16.544 1.00 5.99 N ATOM 1300 CA ARG A 678 -17.574 -3.016 17.992 1.00 6.87 C ATOM 1301 C ARG A 678 -16.367 -3.422 18.838 1.00 11.03 C ATOM 1302 O ARG A 678 -16.331 -3.102 20.025 1.00 9.50 O ATOM 1303 CB ARG A 678 -18.821 -3.708 18.583 1.00 10.99 C ATOM 1304 CG ARG A 678 -20.118 -3.283 17.928 1.00 11.49 C ATOM 1305 CD ARG A 678 -21.335 -3.751 18.737 1.00 22.61 C ATOM 1306 NE ARG A 678 -21.179 -5.125 19.209 1.00 41.72 N ATOM 1307 CZ ARG A 678 -21.512 -6.206 18.508 1.00 48.63 C ATOM 1308 NH1 ARG A 678 -22.019 -6.081 17.289 1.00 52.00 N ATOM 1309 NH2 ARG A 678 -21.332 -7.416 19.023 1.00 47.42 N ATOM 1310 HE ARG A 678 -20.780 -5.268 20.159 1.00 0.00 H ATOM 1311 HH12 ARG A 678 -22.278 -6.928 16.744 1.00 0.00 H ATOM 1312 HH11 ARG A 678 -22.158 -5.136 16.878 1.00 0.00 H ATOM 1313 HH22 ARG A 678 -21.593 -8.259 18.473 1.00 0.00 H ATOM 1314 HH21 ARG A 678 -20.930 -7.521 19.976 1.00 0.00 H ATOM 1315 H ARG A 678 -17.270 -2.431 15.943 1.00 0.00 H ATOM 1316 N ASP A 679 -15.389 -4.117 18.260 1.00 6.53 N ATOM 1317 CA ASP A 679 -14.217 -4.515 19.032 1.00 7.19 C ATOM 1318 C ASP A 679 -12.965 -4.439 18.166 1.00 9.60 C ATOM 1319 O ASP A 679 -12.138 -5.346 18.156 1.00 10.04 O ATOM 1320 CB ASP A 679 -14.407 -5.925 19.604 1.00 8.57 C ATOM 1321 CG ASP A 679 -13.392 -6.273 20.679 1.00 15.10 C ATOM 1322 OD1 ASP A 679 -12.682 -5.368 21.183 1.00 9.86 O ATOM 1323 OD2 ASP A 679 -13.306 -7.475 21.017 1.00 11.99 O ATOM 1324 H ASP A 679 -15.461 -4.377 17.256 1.00 0.00 H ATOM 1325 N LEU A 680 -12.830 -3.341 17.432 1.00 4.98 N ATOM 1326 CA LEU A 680 -11.621 -3.139 16.654 1.00 4.59 C ATOM 1327 C LEU A 680 -10.454 -2.807 17.564 1.00 8.09 C ATOM 1328 O LEU A 680 -10.524 -1.875 18.368 1.00 7.22 O ATOM 1329 CB LEU A 680 -11.827 -2.033 15.626 1.00 6.15 C ATOM 1330 CG LEU A 680 -12.872 -2.406 14.581 1.00 9.70 C ATOM 1331 CD1 LEU A 680 -13.283 -1.162 13.826 1.00 9.35 C ATOM 1332 CD2 LEU A 680 -12.274 -3.425 13.635 1.00 12.95 C ATOM 1333 H LEU A 680 -13.587 -2.628 17.414 1.00 0.00 H ATOM 1334 N ALA A 681 -9.382 -3.577 17.423 1.00 4.98 N ATOM 1335 CA ALA A 681 -8.183 -3.433 18.244 1.00 4.57 C ATOM 1336 C ALA A 681 -7.124 -4.281 17.580 1.00 6.90 C ATOM 1337 O ALA A 681 -7.480 -5.213 16.865 1.00 7.65 O ATOM 1338 CB ALA A 681 -8.427 -3.900 19.671 1.00 4.79 C ATOM 1339 H ALA A 681 -9.397 -4.318 16.693 1.00 0.00 H ATOM 1340 N THR A 682 -5.841 -4.007 17.812 1.00 4.66 N ATOM 1341 CA THR A 682 -4.832 -4.805 17.108 1.00 4.38 C ATOM 1342 C THR A 682 -4.855 -6.276 17.558 1.00 5.94 C ATOM 1343 O THR A 682 -4.498 -7.159 16.777 1.00 6.47 O ATOM 1344 CB THR A 682 -3.400 -4.232 17.275 1.00 6.30 C ATOM 1345 OG1 THR A 682 -3.026 -4.258 18.652 1.00 6.28 O ATOM 1346 CG2 THR A 682 -3.326 -2.788 16.770 1.00 8.60 C ATOM 1347 HG1 THR A 682 -3.662 -3.709 19.176 1.00 0.00 H ATOM 1348 H THR A 682 -5.564 -3.252 18.471 1.00 0.00 H ATOM 1349 N ARG A 683 -5.308 -6.558 18.779 1.00 6.29 N ATOM 1350 CA ARG A 683 -5.424 -7.955 19.219 1.00 4.76 C ATOM 1351 C ARG A 683 -6.406 -8.754 18.347 1.00 6.12 C ATOM 1352 O ARG A 683 -6.339 -9.992 18.293 1.00 7.68 O ATOM 1353 CB ARG A 683 -5.862 -8.029 20.680 1.00 5.47 C ATOM 1354 CG ARG A 683 -7.293 -7.527 20.904 1.00 5.93 C ATOM 1355 CD ARG A 683 -7.792 -7.689 22.348 1.00 7.39 C ATOM 1356 NE ARG A 683 -9.058 -6.966 22.456 1.00 10.35 N ATOM 1357 CZ ARG A 683 -9.126 -5.663 22.694 1.00 9.17 C ATOM 1358 NH1 ARG A 683 -8.010 -4.984 22.908 1.00 10.06 N ATOM 1359 NH2 ARG A 683 -10.294 -5.044 22.742 1.00 9.87 N ATOM 1360 HE ARG A 683 -9.945 -7.497 22.341 1.00 0.00 H ATOM 1361 HH12 ARG A 683 -8.051 -3.962 23.096 1.00 0.00 H ATOM 1362 HH11 ARG A 683 -7.092 -5.473 22.888 1.00 0.00 H ATOM 1363 HH22 ARG A 683 -10.333 -4.022 22.930 1.00 0.00 H ATOM 1364 HH21 ARG A 683 -11.173 -5.580 22.592 1.00 0.00 H ATOM 1365 H ARG A 683 -5.580 -5.787 19.422 1.00 0.00 H ATOM 1366 N ASN A 684 -7.302 -8.054 17.659 1.00 5.83 N ATOM 1367 CA ASN A 684 -8.272 -8.720 16.785 1.00 5.15 C ATOM 1368 C ASN A 684 -7.910 -8.678 15.310 1.00 10.00 C ATOM 1369 O ASN A 684 -8.748 -8.956 14.459 1.00 9.80 O ATOM 1370 CB ASN A 684 -9.655 -8.116 16.981 1.00 4.78 C ATOM 1371 CG ASN A 684 -10.323 -8.637 18.228 1.00 11.11 C ATOM 1372 OD1 ASN A 684 -10.141 -9.799 18.591 1.00 9.86 O ATOM 1373 ND2 ASN A 684 -11.096 -7.781 18.902 1.00 9.86 N ATOM 1374 HD22 ASN A 684 -11.219 -6.808 18.556 1.00 0.00 H ATOM 1375 HD21 ASN A 684 -11.574 -8.087 19.773 1.00 0.00 H ATOM 1376 H ASN A 684 -7.315 -7.017 17.742 1.00 0.00 H ATOM 1377 N CYS A 685 -6.662 -8.334 15.008 1.00 5.83 N ATOM 1378 CA CYS A 685 -6.164 -8.374 13.634 1.00 4.10 C ATOM 1379 C CYS A 685 -5.130 -9.468 13.525 1.00 6.36 C ATOM 1380 O CYS A 685 -4.435 -9.740 14.498 1.00 8.72 O ATOM 1381 CB CYS A 685 -5.535 -7.045 13.229 1.00 6.05 C ATOM 1382 SG CYS A 685 -6.699 -5.699 13.210 1.00 9.75 S ATOM 1383 H CYS A 685 -6.023 -8.028 15.769 1.00 0.00 H ATOM 1384 N LEU A 686 -5.026 -10.088 12.349 1.00 6.52 N ATOM 1385 CA LEU A 686 -4.025 -11.128 12.103 1.00 7.17 C ATOM 1386 C LEU A 686 -2.974 -10.672 11.107 1.00 8.72 C ATOM 1387 O LEU A 686 -3.253 -9.858 10.226 1.00 7.00 O ATOM 1388 CB LEU A 686 -4.685 -12.401 11.584 1.00 8.40 C ATOM 1389 CG LEU A 686 -5.559 -13.176 12.558 1.00 10.76 C ATOM 1390 CD1 LEU A 686 -6.224 -14.348 11.835 1.00 12.31 C ATOM 1391 CD2 LEU A 686 -4.723 -13.651 13.742 1.00 10.89 C ATOM 1392 H LEU A 686 -5.677 -9.824 11.582 1.00 0.00 H ATOM 1393 N VAL A 687 -1.763 -11.199 11.251 1.00 6.22 N ATOM 1394 CA VAL A 687 -0.669 -10.827 10.372 1.00 9.17 C ATOM 1395 C VAL A 687 -0.154 -12.042 9.622 1.00 9.95 C ATOM 1396 O VAL A 687 0.145 -13.063 10.230 1.00 7.97 O ATOM 1397 CB VAL A 687 0.499 -10.181 11.148 1.00 8.45 C ATOM 1398 CG1 VAL A 687 1.560 -9.669 10.173 1.00 7.60 C ATOM 1399 CG2 VAL A 687 -0.015 -9.037 12.024 1.00 9.83 C ATOM 1400 H VAL A 687 -1.595 -11.892 12.008 1.00 0.00 H ATOM 1401 N GLY A 688 -0.049 -11.924 8.301 1.00 9.15 N ATOM 1402 CA GLY A 688 0.454 -13.012 7.470 1.00 8.87 C ATOM 1403 C GLY A 688 1.774 -12.629 6.821 1.00 10.69 C ATOM 1404 O GLY A 688 2.429 -11.685 7.256 1.00 12.86 O ATOM 1405 H GLY A 688 -0.333 -11.032 7.849 1.00 0.00 H ATOM 1406 N ALA A 689 2.156 -13.350 5.767 1.00 11.04 N ATOM 1407 CA ALA A 689 3.379 -13.052 5.024 1.00 13.97 C ATOM 1408 C ALA A 689 3.327 -11.675 4.378 1.00 14.11 C ATOM 1409 O ALA A 689 2.243 -11.193 4.057 1.00 13.96 O ATOM 1410 CB ALA A 689 3.609 -14.110 3.960 1.00 17.13 C ATOM 1411 H ALA A 689 1.565 -14.150 5.464 1.00 0.00 H ATOM 1412 N ASN A 690 4.493 -11.054 4.200 1.00 14.18 N ATOM 1413 CA ASN A 690 4.608 -9.776 3.493 1.00 15.00 C ATOM 1414 C ASN A 690 3.860 -8.653 4.227 1.00 17.44 C ATOM 1415 O ASN A 690 3.351 -7.733 3.590 1.00 16.53 O ATOM 1416 CB ASN A 690 4.077 -9.930 2.055 1.00 19.46 C ATOM 1417 CG ASN A 690 4.608 -8.868 1.101 1.00 29.66 C ATOM 1418 OD1 ASN A 690 5.772 -8.475 1.175 1.00 30.53 O ATOM 1419 ND2 ASN A 690 3.746 -8.401 0.190 1.00 26.55 N ATOM 1420 HD22 ASN A 690 2.771 -8.762 0.164 1.00 0.00 H ATOM 1421 HD21 ASN A 690 4.051 -7.677 -0.492 1.00 0.00 H ATOM 1422 H ASN A 690 5.356 -11.494 4.578 1.00 0.00 H ATOM 1423 N LEU A 691 3.794 -8.750 5.558 1.00 12.25 N ATOM 1424 CA LEU A 691 3.085 -7.777 6.420 1.00 10.93 C ATOM 1425 C LEU A 691 1.622 -7.626 6.051 1.00 12.61 C ATOM 1426 O LEU A 691 1.042 -6.555 6.216 1.00 10.95 O ATOM 1427 CB LEU A 691 3.741 -6.395 6.368 1.00 12.34 C ATOM 1428 CG LEU A 691 4.486 -5.827 7.570 1.00 28.49 C ATOM 1429 CD1 LEU A 691 4.686 -4.313 7.403 1.00 24.71 C ATOM 1430 CD2 LEU A 691 3.772 -6.139 8.861 1.00 25.60 C ATOM 1431 H LEU A 691 4.268 -9.555 6.015 1.00 0.00 H ATOM 1432 N LEU A 692 1.023 -8.695 5.552 1.00 8.40 N ATOM 1433 CA LEU A 692 -0.391 -8.665 5.225 1.00 8.62 C ATOM 1434 C LEU A 692 -1.224 -8.697 6.501 1.00 12.93 C ATOM 1435 O LEU A 692 -1.059 -9.592 7.327 1.00 15.72 O ATOM 1436 CB LEU A 692 -0.740 -9.851 4.335 1.00 10.30 C ATOM 1437 CG LEU A 692 -2.191 -9.957 3.905 1.00 9.65 C ATOM 1438 CD1 LEU A 692 -2.554 -8.769 3.038 1.00 13.10 C ATOM 1439 CD2 LEU A 692 -2.384 -11.270 3.160 1.00 16.49 C ATOM 1440 H LEU A 692 1.570 -9.565 5.393 1.00 0.00 H ATOM 1441 N VAL A 693 -2.103 -7.715 6.665 1.00 6.22 N ATOM 1442 CA VAL A 693 -2.907 -7.598 7.877 1.00 4.28 C ATOM 1443 C VAL A 693 -4.386 -7.733 7.536 1.00 7.49 C ATOM 1444 O VAL A 693 -4.856 -7.152 6.557 1.00 8.03 O ATOM 1445 CB VAL A 693 -2.639 -6.257 8.579 1.00 6.06 C ATOM 1446 CG1 VAL A 693 -3.549 -6.087 9.825 1.00 7.38 C ATOM 1447 CG2 VAL A 693 -1.165 -6.169 8.964 1.00 8.46 C ATOM 1448 H VAL A 693 -2.221 -7.010 5.909 1.00 0.00 H ATOM 1449 N LYS A 694 -5.106 -8.534 8.320 1.00 3.81 N ATOM 1450 CA LYS A 694 -6.535 -8.712 8.116 1.00 3.82 C ATOM 1451 C LYS A 694 -7.276 -8.550 9.431 1.00 7.16 C ATOM 1452 O LYS A 694 -6.786 -8.927 10.483 1.00 7.86 O ATOM 1453 CB LYS A 694 -6.840 -10.090 7.513 1.00 6.00 C ATOM 1454 CG LYS A 694 -6.135 -10.326 6.178 1.00 4.35 C ATOM 1455 CD LYS A 694 -6.584 -11.620 5.517 1.00 8.22 C ATOM 1456 CE LYS A 694 -5.687 -11.921 4.334 1.00 10.23 C ATOM 1457 NZ LYS A 694 -6.319 -12.923 3.437 1.00 13.00 N ATOM 1458 HZ1 LYS A 694 -6.486 -13.803 3.965 1.00 0.00 H ATOM 1459 HZ2 LYS A 694 -7.225 -12.550 3.087 1.00 0.00 H ATOM 1460 HZ3 LYS A 694 -5.687 -13.114 2.633 1.00 0.00 H ATOM 1461 H LYS A 694 -4.636 -9.043 9.095 1.00 0.00 H ATOM 1462 N ILE A 695 -8.477 -7.997 9.356 1.00 5.18 N ATOM 1463 CA ILE A 695 -9.322 -7.838 10.533 1.00 4.02 C ATOM 1464 C ILE A 695 -10.123 -9.094 10.863 1.00 12.04 C ATOM 1465 O ILE A 695 -10.792 -9.659 9.997 1.00 9.70 O ATOM 1466 CB ILE A 695 -10.307 -6.704 10.332 1.00 4.50 C ATOM 1467 CG1 ILE A 695 -9.565 -5.405 9.992 1.00 4.83 C ATOM 1468 CG2 ILE A 695 -11.227 -6.560 11.559 1.00 8.14 C ATOM 1469 CD1 ILE A 695 -10.509 -4.267 9.604 1.00 9.25 C ATOM 1470 H ILE A 695 -8.826 -7.668 8.433 1.00 0.00 H ATOM 1471 N GLY A 696 -10.061 -9.519 12.121 1.00 7.61 N ATOM 1472 CA GLY A 696 -11.002 -10.516 12.608 1.00 11.18 C ATOM 1473 C GLY A 696 -11.710 -10.102 13.899 1.00 11.98 C ATOM 1474 O GLY A 696 -11.796 -8.928 14.244 1.00 7.93 O ATOM 1475 H GLY A 696 -9.336 -9.137 12.761 1.00 0.00 H ATOM 1476 N ASP A 697 -12.228 -11.088 14.620 1.00 11.42 N ATOM 1477 CA ASP A 697 -12.864 -10.842 15.904 1.00 6.82 C ATOM 1478 C ASP A 697 -12.796 -12.116 16.735 1.00 11.94 C ATOM 1479 O ASP A 697 -13.561 -13.045 16.499 1.00 14.96 O ATOM 1480 CB ASP A 697 -14.310 -10.409 15.689 1.00 10.52 C ATOM 1481 CG ASP A 697 -15.004 -9.996 16.972 1.00 19.87 C ATOM 1482 OD1 ASP A 697 -14.461 -10.222 18.073 1.00 21.88 O ATOM 1483 OD2 ASP A 697 -16.115 -9.450 16.870 1.00 25.33 O ATOM 1484 H ASP A 697 -12.178 -12.061 14.257 1.00 0.00 H ATOM 1485 N PHE A 698 -11.895 -12.145 17.711 1.00 10.85 N ATOM 1486 CA PHE A 698 -11.612 -13.358 18.481 1.00 14.39 C ATOM 1487 C PHE A 698 -12.293 -13.326 19.838 1.00 25.57 C ATOM 1488 O PHE A 698 -12.518 -14.370 20.463 1.00 25.94 O ATOM 1489 CB PHE A 698 -10.104 -13.526 18.673 1.00 14.14 C ATOM 1490 CG PHE A 698 -9.315 -13.298 17.418 1.00 20.14 C ATOM 1491 CD1 PHE A 698 -9.769 -13.791 16.201 1.00 25.08 C ATOM 1492 CD2 PHE A 698 -8.142 -12.567 17.444 1.00 19.05 C ATOM 1493 CE1 PHE A 698 -9.057 -13.569 15.040 1.00 24.32 C ATOM 1494 CE2 PHE A 698 -7.415 -12.338 16.279 1.00 18.05 C ATOM 1495 CZ PHE A 698 -7.879 -12.843 15.075 1.00 24.46 C ATOM 1496 H PHE A 698 -11.372 -11.275 17.936 1.00 0.00 H ATOM 1497 N GLY A 699 -12.602 -12.118 20.294 1.00 24.21 N ATOM 1498 CA GLY A 699 -13.208 -11.926 21.595 1.00 29.50 C ATOM 1499 C GLY A 699 -12.181 -12.029 22.706 1.00 32.79 C ATOM 1500 O GLY A 699 -10.971 -12.008 22.468 1.00 29.33 O ATOM 1501 H GLY A 699 -12.403 -11.287 19.701 1.00 0.00 H ATOM 1502 N MET A 700 -12.671 -12.148 23.932 1.00 28.49 N ATOM 1503 CA MET A 700 -11.800 -12.232 25.090 1.00 22.25 C ATOM 1504 C MET A 700 -11.233 -13.640 25.268 1.00 28.30 C ATOM 1505 O MET A 700 -11.901 -14.637 24.977 1.00 31.67 O ATOM 1506 CB MET A 700 -12.568 -11.804 26.340 1.00 22.34 C ATOM 1507 CG MET A 700 -11.791 -11.931 27.644 1.00 28.59 C ATOM 1508 SD MET A 700 -12.794 -11.341 29.023 1.00 44.45 S ATOM 1509 CE MET A 700 -14.411 -11.377 28.254 1.00 43.13 C ATOM 1510 H MET A 700 -13.702 -12.182 24.067 1.00 0.00 H ATOM 1511 N SER A 701 -9.995 -13.715 25.746 1.00 28.86 N ATOM 1512 CA SER A 701 -9.337 -14.996 25.971 1.00 28.79 C ATOM 1513 C SER A 701 -10.015 -15.795 27.075 1.00 30.75 C ATOM 1514 O SER A 701 -10.436 -15.238 28.094 1.00 30.64 O ATOM 1515 CB SER A 701 -7.860 -14.793 26.316 1.00 29.37 C ATOM 1516 OG SER A 701 -7.215 -16.044 26.494 1.00 36.01 O ATOM 1517 HG SER A 701 -7.281 -16.570 25.658 1.00 0.00 H ATOM 1518 H SER A 701 -9.483 -12.837 25.965 1.00 0.00 H ATOM 1519 N ARG A 702 -10.108 -17.103 26.859 1.00 34.27 N ATOM 1520 CA ARG A 702 -10.695 -18.033 27.817 1.00 40.79 C ATOM 1521 C ARG A 702 -9.656 -18.498 28.836 1.00 45.23 C ATOM 1522 O ARG A 702 -9.975 -18.720 30.005 1.00 47.81 O ATOM 1523 CB ARG A 702 -11.293 -19.247 27.091 1.00 46.03 C ATOM 1524 CG ARG A 702 -11.880 -20.296 28.004 1.00 51.25 C ATOM 1525 CD ARG A 702 -13.229 -19.865 28.526 1.00 60.26 C ATOM 1526 NE ARG A 702 -13.502 -20.429 29.842 1.00 73.06 N ATOM 1527 CZ ARG A 702 -14.712 -20.778 30.270 1.00 79.41 C ATOM 1528 NH1 ARG A 702 -14.863 -21.285 31.486 1.00 80.92 N ATOM 1529 NH2 ARG A 702 -15.770 -20.628 29.482 1.00 80.33 N ATOM 1530 HE ARG A 702 -12.699 -20.567 30.488 1.00 0.00 H ATOM 1531 HH12 ARG A 702 -15.809 -21.558 31.822 1.00 0.00 H ATOM 1532 HH11 ARG A 702 -14.036 -21.409 32.104 1.00 0.00 H ATOM 1533 HH22 ARG A 702 -16.714 -20.902 29.821 1.00 0.00 H ATOM 1534 HH21 ARG A 702 -15.655 -20.236 28.526 1.00 0.00 H ATOM 1535 H ARG A 702 -9.744 -17.483 25.962 1.00 0.00 H ATOM 1536 N ASP A 703 -8.407 -18.605 28.394 1.00 42.54 N ATOM 1537 CA ASP A 703 -7.374 -19.238 29.199 1.00 44.61 C ATOM 1538 C ASP A 703 -6.294 -18.273 29.679 1.00 39.30 C ATOM 1539 O ASP A 703 -5.570 -18.591 30.618 1.00 40.24 O ATOM 1540 CB ASP A 703 -6.731 -20.377 28.409 1.00 43.18 C ATOM 1541 H ASP A 703 -8.164 -18.229 27.455 1.00 0.00 H ATOM 1542 N VAL A 704 -6.183 -17.105 29.048 1.00 26.40 N ATOM 1543 CA VAL A 704 -5.156 -16.137 29.435 1.00 29.19 C ATOM 1544 C VAL A 704 -5.771 -14.919 30.118 1.00 28.63 C ATOM 1545 O VAL A 704 -6.788 -14.394 29.658 1.00 25.11 O ATOM 1546 CB VAL A 704 -4.330 -15.679 28.221 1.00 31.35 C ATOM 1547 CG1 VAL A 704 -3.292 -14.656 28.641 1.00 29.37 C ATOM 1548 CG2 VAL A 704 -3.656 -16.878 27.562 1.00 32.73 C ATOM 1549 H VAL A 704 -6.835 -16.878 28.270 1.00 0.00 H ATOM 1550 N TYR A 705 -5.169 -14.487 31.226 1.00 20.89 N ATOM 1551 CA TYR A 705 -5.611 -13.267 31.897 1.00 23.19 C ATOM 1552 C TYR A 705 -5.574 -12.093 30.920 1.00 27.15 C ATOM 1553 O TYR A 705 -4.633 -11.958 30.134 1.00 24.62 O ATOM 1554 CB TYR A 705 -4.740 -12.960 33.118 1.00 21.83 C ATOM 1555 CG TYR A 705 -5.199 -11.735 33.879 1.00 29.03 C ATOM 1556 CD1 TYR A 705 -6.261 -11.807 34.775 1.00 32.24 C ATOM 1557 CD2 TYR A 705 -4.582 -10.505 33.694 1.00 33.78 C ATOM 1558 CE1 TYR A 705 -6.692 -10.688 35.467 1.00 32.86 C ATOM 1559 CE2 TYR A 705 -5.006 -9.381 34.384 1.00 35.55 C ATOM 1560 CZ TYR A 705 -6.060 -9.481 35.268 1.00 36.43 C ATOM 1561 OH TYR A 705 -6.482 -8.366 35.955 1.00 39.64 O ATOM 1562 HH TYR A 705 -6.771 -7.672 35.310 1.00 0.00 H ATOM 1563 H TYR A 705 -4.372 -15.027 31.619 1.00 0.00 H ATOM 1564 N SER A 706 -6.602 -11.252 30.962 1.00 25.87 N ATOM 1565 CA SER A 706 -6.634 -10.091 30.083 1.00 31.44 C ATOM 1566 C SER A 706 -7.052 -8.840 30.839 1.00 20.71 C ATOM 1567 O SER A 706 -7.875 -8.884 31.759 1.00 26.90 O ATOM 1568 CB SER A 706 -7.582 -10.326 28.895 1.00 35.87 C ATOM 1569 OG SER A 706 -8.926 -10.047 29.251 1.00 42.80 O ATOM 1570 HG SER A 706 -9.002 -9.102 29.535 1.00 0.00 H ATOM 1571 H SER A 706 -7.386 -11.423 31.624 1.00 0.00 H ATOM 1572 N THR A 707 -6.462 -7.724 30.443 1.00 20.17 N ATOM 1573 CA THR A 707 -6.762 -6.432 31.024 1.00 24.94 C ATOM 1574 C THR A 707 -7.631 -5.578 30.084 1.00 21.77 C ATOM 1575 O THR A 707 -8.011 -4.456 30.426 1.00 20.26 O ATOM 1576 CB THR A 707 -5.455 -5.688 31.361 1.00 33.59 C ATOM 1577 OG1 THR A 707 -5.736 -4.307 31.596 1.00 42.00 O ATOM 1578 CG2 THR A 707 -4.457 -5.826 30.225 1.00 31.43 C ATOM 1579 HG1 THR A 707 -4.895 -3.832 31.812 1.00 0.00 H ATOM 1580 H THR A 707 -5.754 -7.777 29.683 1.00 0.00 H ATOM 1581 N ASP A 708 -7.983 -6.124 28.920 1.00 12.69 N ATOM 1582 CA ASP A 708 -8.531 -5.294 27.845 1.00 9.98 C ATOM 1583 C ASP A 708 -10.045 -5.141 27.869 1.00 15.01 C ATOM 1584 O ASP A 708 -10.610 -4.380 27.084 1.00 11.77 O ATOM 1585 CB ASP A 708 -8.117 -5.859 26.479 1.00 11.53 C ATOM 1586 CG ASP A 708 -6.661 -5.589 26.146 1.00 17.86 C ATOM 1587 OD1 ASP A 708 -5.998 -4.791 26.857 1.00 15.68 O ATOM 1588 OD2 ASP A 708 -6.179 -6.170 25.147 1.00 19.76 O ATOM 1589 H ASP A 708 -7.868 -7.147 28.774 1.00 0.00 H ATOM 1590 N TYR A 709 -10.709 -5.871 28.757 1.00 12.35 N ATOM 1591 CA TYR A 709 -12.163 -5.821 28.818 1.00 9.42 C ATOM 1592 C TYR A 709 -12.610 -5.571 30.245 1.00 13.38 C ATOM 1593 O TYR A 709 -11.985 -6.048 31.188 1.00 15.77 O ATOM 1594 CB TYR A 709 -12.786 -7.116 28.292 1.00 11.92 C ATOM 1595 CG TYR A 709 -12.491 -7.399 26.837 1.00 9.23 C ATOM 1596 CD1 TYR A 709 -11.332 -8.058 26.465 1.00 11.58 C ATOM 1597 CD2 TYR A 709 -13.373 -7.002 25.836 1.00 10.54 C ATOM 1598 CE1 TYR A 709 -11.044 -8.320 25.130 1.00 10.19 C ATOM 1599 CE2 TYR A 709 -13.098 -7.259 24.498 1.00 10.61 C ATOM 1600 CZ TYR A 709 -11.928 -7.917 24.161 1.00 11.34 C ATOM 1601 OH TYR A 709 -11.645 -8.186 22.847 1.00 12.35 O ATOM 1602 HH TYR A 709 -11.596 -7.337 22.341 1.00 0.00 H ATOM 1603 H TYR A 709 -10.186 -6.484 29.415 1.00 0.00 H ATOM 1604 N TYR A 710 -13.699 -4.827 30.390 1.00 13.29 N ATOM 1605 CA TYR A 710 -14.221 -4.472 31.700 1.00 13.85 C ATOM 1606 C TYR A 710 -15.735 -4.568 31.670 1.00 15.47 C ATOM 1607 O TYR A 710 -16.371 -4.156 30.698 1.00 17.16 O ATOM 1608 CB TYR A 710 -13.764 -3.060 32.077 1.00 13.03 C ATOM 1609 CG TYR A 710 -14.221 -2.570 33.431 1.00 15.63 C ATOM 1610 CD1 TYR A 710 -13.762 -3.167 34.598 1.00 25.77 C ATOM 1611 CD2 TYR A 710 -15.086 -1.492 33.541 1.00 23.74 C ATOM 1612 CE1 TYR A 710 -14.172 -2.716 35.843 1.00 30.27 C ATOM 1613 CE2 TYR A 710 -15.497 -1.030 34.779 1.00 29.10 C ATOM 1614 CZ TYR A 710 -15.038 -1.646 35.926 1.00 33.83 C ATOM 1615 OH TYR A 710 -15.448 -1.188 37.162 1.00 38.44 O ATOM 1616 HH TYR A 710 -15.029 -1.737 37.872 1.00 0.00 H ATOM 1617 H TYR A 710 -14.194 -4.487 29.541 1.00 0.00 H ATOM 1618 N ARG A 711 -16.316 -5.120 32.730 1.00 25.17 N ATOM 1619 CA ARG A 711 -17.772 -5.183 32.845 1.00 35.98 C ATOM 1620 C ARG A 711 -18.313 -3.830 33.301 1.00 41.12 C ATOM 1621 O ARG A 711 -18.133 -3.437 34.452 1.00 47.76 O ATOM 1622 CB ARG A 711 -18.187 -6.293 33.815 1.00 41.17 C ATOM 1623 CG ARG A 711 -19.632 -6.224 34.294 1.00 54.98 C ATOM 1624 CD ARG A 711 -20.626 -6.392 33.156 1.00 62.66 C ATOM 1625 NE ARG A 711 -21.990 -6.580 33.651 1.00 65.42 N ATOM 1626 CZ ARG A 711 -22.889 -5.608 33.780 1.00 64.79 C ATOM 1627 NH1 ARG A 711 -24.101 -5.887 34.239 1.00 67.53 N ATOM 1628 NH2 ARG A 711 -22.585 -4.362 33.446 1.00 60.51 N ATOM 1629 HE ARG A 711 -22.277 -7.542 33.921 1.00 0.00 H ATOM 1630 HH12 ARG A 711 -24.806 -5.129 34.341 1.00 0.00 H ATOM 1631 HH11 ARG A 711 -24.347 -6.864 34.497 1.00 0.00 H ATOM 1632 HH22 ARG A 711 -23.294 -3.608 33.550 1.00 0.00 H ATOM 1633 HH21 ARG A 711 -21.638 -4.138 33.080 1.00 0.00 H ATOM 1634 H ARG A 711 -15.725 -5.514 33.490 1.00 0.00 H ATOM 1635 N LEU A 712 -18.965 -3.114 32.392 1.00 44.26 N ATOM 1636 CA LEU A 712 -19.469 -1.779 32.698 1.00 51.77 C ATOM 1637 C LEU A 712 -20.820 -1.842 33.402 1.00 59.05 C ATOM 1638 O LEU A 712 -20.993 -2.586 34.369 1.00 63.01 O ATOM 1639 CB LEU A 712 -19.580 -0.940 31.422 1.00 49.68 C ATOM 1640 H LEU A 712 -19.119 -3.512 31.444 1.00 0.00 H TER 1641 LEU A 712 ATOM 1642 N HIS A 729 -23.687 -8.817 32.901 1.00 59.57 N ATOM 1643 CA HIS A 729 -23.786 -8.574 31.469 1.00 55.58 C ATOM 1644 C HIS A 729 -22.428 -8.696 30.779 1.00 53.19 C ATOM 1645 O HIS A 729 -21.656 -9.614 31.052 1.00 50.19 O ATOM 1646 CB HIS A 729 -24.389 -7.193 31.197 1.00 54.54 C ATOM 1647 HN3 HIS A 729 -23.040 -8.122 33.325 1.00 0.00 H ATOM 1648 HN2 HIS A 729 -23.322 -9.777 33.064 1.00 0.00 H ATOM 1649 HN1 HIS A 729 -24.629 -8.725 33.333 1.00 0.00 H ATOM 1650 N THR A 730 -22.133 -7.753 29.894 1.00 49.61 N ATOM 1651 CA THR A 730 -21.055 -7.950 28.939 1.00 40.35 C ATOM 1652 C THR A 730 -19.742 -7.258 29.295 1.00 28.12 C ATOM 1653 O THR A 730 -19.710 -6.156 29.846 1.00 25.59 O ATOM 1654 CB THR A 730 -21.486 -7.478 27.542 1.00 48.59 C ATOM 1655 OG1 THR A 730 -21.203 -6.083 27.399 1.00 55.80 O ATOM 1656 CG2 THR A 730 -22.977 -7.714 27.345 1.00 45.00 C ATOM 1657 HG1 THR A 730 -20.231 -5.931 27.513 1.00 0.00 H ATOM 1658 H THR A 730 -22.677 -6.867 29.883 1.00 0.00 H ATOM 1659 N MET A 731 -18.657 -7.941 28.965 1.00 23.51 N ATOM 1660 CA MET A 731 -17.324 -7.389 29.058 1.00 17.70 C ATOM 1661 C MET A 731 -17.069 -6.485 27.860 1.00 18.43 C ATOM 1662 O MET A 731 -17.272 -6.890 26.712 1.00 19.74 O ATOM 1663 CB MET A 731 -16.295 -8.509 29.113 1.00 21.99 C ATOM 1664 CG MET A 731 -16.559 -9.513 30.215 1.00 34.77 C ATOM 1665 SD MET A 731 -16.099 -8.837 31.803 1.00 48.53 S ATOM 1666 CE MET A 731 -14.386 -8.418 31.514 1.00 32.71 C ATOM 1667 H MET A 731 -18.768 -8.917 28.624 1.00 0.00 H ATOM 1668 N LEU A 732 -16.625 -5.263 28.131 1.00 16.16 N ATOM 1669 CA LEU A 732 -16.469 -4.270 27.077 1.00 14.44 C ATOM 1670 C LEU A 732 -15.033 -3.805 26.938 1.00 9.55 C ATOM 1671 O LEU A 732 -14.326 -3.621 27.923 1.00 10.97 O ATOM 1672 CB LEU A 732 -17.366 -3.066 27.343 1.00 14.48 C ATOM 1673 CG LEU A 732 -18.859 -3.360 27.280 1.00 21.77 C ATOM 1674 CD1 LEU A 732 -19.612 -2.181 27.852 1.00 21.23 C ATOM 1675 CD2 LEU A 732 -19.277 -3.637 25.848 1.00 19.72 C ATOM 1676 H LEU A 732 -16.385 -5.011 29.111 1.00 0.00 H ATOM 1677 N PRO A 733 -14.601 -3.606 25.689 1.00 8.31 N ATOM 1678 CA PRO A 733 -13.257 -3.077 25.443 1.00 7.41 C ATOM 1679 C PRO A 733 -13.206 -1.570 25.665 1.00 8.48 C ATOM 1680 O PRO A 733 -12.990 -0.813 24.710 1.00 8.22 O ATOM 1681 CB PRO A 733 -13.021 -3.436 23.973 1.00 9.05 C ATOM 1682 CG PRO A 733 -14.391 -3.342 23.366 1.00 8.80 C ATOM 1683 CD PRO A 733 -15.329 -3.881 24.434 1.00 6.43 C ATOM 1684 N ILE A 734 -13.379 -1.128 26.908 1.00 8.79 N ATOM 1685 CA ILE A 734 -13.607 0.296 27.147 1.00 9.45 C ATOM 1686 C ILE A 734 -12.476 1.207 26.659 1.00 8.00 C ATOM 1687 O ILE A 734 -12.738 2.337 26.252 1.00 9.06 O ATOM 1688 CB ILE A 734 -13.857 0.603 28.647 1.00 10.01 C ATOM 1689 CG1 ILE A 734 -12.728 0.064 29.519 1.00 12.25 C ATOM 1690 CG2 ILE A 734 -15.206 0.029 29.091 1.00 13.68 C ATOM 1691 CD1 ILE A 734 -12.767 0.587 30.963 1.00 15.19 C ATOM 1692 H ILE A 734 -13.352 -1.793 27.707 1.00 0.00 H ATOM 1693 N ARG A 735 -11.235 0.734 26.692 1.00 6.94 N ATOM 1694 CA ARG A 735 -10.116 1.590 26.300 1.00 8.41 C ATOM 1695 C ARG A 735 -10.150 1.938 24.819 1.00 10.50 C ATOM 1696 O ARG A 735 -9.527 2.914 24.394 1.00 8.99 O ATOM 1697 CB ARG A 735 -8.783 0.924 26.659 1.00 8.49 C ATOM 1698 CG ARG A 735 -8.569 0.845 28.162 1.00 9.39 C ATOM 1699 CD ARG A 735 -7.486 -0.146 28.591 1.00 13.07 C ATOM 1700 NE ARG A 735 -7.634 -0.408 30.028 1.00 13.39 N ATOM 1701 CZ ARG A 735 -7.016 0.272 30.984 1.00 14.55 C ATOM 1702 NH1 ARG A 735 -6.164 1.237 30.680 1.00 16.53 N ATOM 1703 NH2 ARG A 735 -7.251 -0.019 32.256 1.00 18.09 N ATOM 1704 HE ARG A 735 -8.268 -1.181 30.316 1.00 0.00 H ATOM 1705 HH12 ARG A 735 -5.684 1.765 31.437 1.00 0.00 H ATOM 1706 HH11 ARG A 735 -5.974 1.468 29.684 1.00 0.00 H ATOM 1707 HH22 ARG A 735 -6.768 0.512 33.009 1.00 0.00 H ATOM 1708 HH21 ARG A 735 -7.918 -0.778 32.501 1.00 0.00 H ATOM 1709 H ARG A 735 -11.059 -0.245 26.997 1.00 0.00 H ATOM 1710 N TRP A 736 -10.887 1.148 24.040 1.00 5.68 N ATOM 1711 CA TRP A 736 -11.015 1.382 22.603 1.00 6.44 C ATOM 1712 C TRP A 736 -12.320 2.083 22.220 1.00 6.90 C ATOM 1713 O TRP A 736 -12.580 2.287 21.029 1.00 8.36 O ATOM 1714 CB TRP A 736 -10.914 0.047 21.839 1.00 5.42 C ATOM 1715 CG TRP A 736 -9.504 -0.456 21.753 1.00 5.36 C ATOM 1716 CD1 TRP A 736 -8.655 -0.308 20.703 1.00 7.91 C ATOM 1717 CD2 TRP A 736 -8.767 -1.139 22.776 1.00 5.61 C ATOM 1718 NE1 TRP A 736 -7.432 -0.857 21.002 1.00 5.24 N ATOM 1719 CE2 TRP A 736 -7.479 -1.384 22.267 1.00 6.21 C ATOM 1720 CE3 TRP A 736 -9.080 -1.579 24.072 1.00 6.57 C ATOM 1721 CZ2 TRP A 736 -6.495 -2.040 23.006 1.00 9.38 C ATOM 1722 CZ3 TRP A 736 -8.101 -2.233 24.805 1.00 7.83 C ATOM 1723 CH2 TRP A 736 -6.820 -2.451 24.273 1.00 9.91 C ATOM 1724 HE1 TRP A 736 -6.605 -0.871 20.372 1.00 0.00 H ATOM 1725 H TRP A 736 -11.386 0.341 24.467 1.00 0.00 H ATOM 1726 N MET A 737 -13.147 2.431 23.207 1.00 7.10 N ATOM 1727 CA MET A 737 -14.505 2.914 22.925 1.00 7.81 C ATOM 1728 C MET A 737 -14.665 4.423 23.098 1.00 8.10 C ATOM 1729 O MET A 737 -14.040 5.018 23.974 1.00 9.22 O ATOM 1730 CB MET A 737 -15.518 2.189 23.833 1.00 8.92 C ATOM 1731 CG MET A 737 -15.777 0.743 23.422 1.00 8.60 C ATOM 1732 SD MET A 737 -16.507 -0.253 24.746 1.00 12.22 S ATOM 1733 CE MET A 737 -18.078 0.578 24.947 1.00 17.65 C ATOM 1734 H MET A 737 -12.825 2.359 24.193 1.00 0.00 H ATOM 1735 N PRO A 738 -15.517 5.044 22.270 1.00 6.26 N ATOM 1736 CA PRO A 738 -15.833 6.468 22.417 1.00 4.33 C ATOM 1737 C PRO A 738 -16.835 6.716 23.535 1.00 7.08 C ATOM 1738 O PRO A 738 -17.463 5.760 24.007 1.00 8.62 O ATOM 1739 CB PRO A 738 -16.452 6.824 21.065 1.00 7.58 C ATOM 1740 CG PRO A 738 -17.110 5.562 20.637 1.00 8.23 C ATOM 1741 CD PRO A 738 -16.160 4.469 21.075 1.00 4.90 C ATOM 1742 N PRO A 739 -16.990 7.984 23.948 1.00 11.47 N ATOM 1743 CA PRO A 739 -17.920 8.322 25.036 1.00 12.75 C ATOM 1744 C PRO A 739 -19.339 7.803 24.809 1.00 13.96 C ATOM 1745 O PRO A 739 -19.929 7.279 25.751 1.00 13.73 O ATOM 1746 CB PRO A 739 -17.913 9.850 25.039 1.00 14.13 C ATOM 1747 CG PRO A 739 -16.592 10.226 24.497 1.00 15.18 C ATOM 1748 CD PRO A 739 -16.206 9.157 23.510 1.00 9.78 C ATOM 1749 N GLU A 740 -19.880 7.928 23.597 1.00 10.30 N ATOM 1750 CA GLU A 740 -21.275 7.537 23.390 1.00 11.73 C ATOM 1751 C GLU A 740 -21.468 6.018 23.471 1.00 13.72 C ATOM 1752 O GLU A 740 -22.567 5.548 23.789 1.00 12.14 O ATOM 1753 CB GLU A 740 -21.810 8.082 22.054 1.00 14.03 C ATOM 1754 CG GLU A 740 -21.368 7.314 20.802 1.00 11.13 C ATOM 1755 CD GLU A 740 -20.014 7.767 20.262 1.00 10.37 C ATOM 1756 OE1 GLU A 740 -19.348 8.615 20.896 1.00 14.04 O ATOM 1757 OE2 GLU A 740 -19.641 7.279 19.176 1.00 12.06 O ATOM 1758 H GLU A 740 -19.316 8.300 22.806 1.00 0.00 H ATOM 1759 N SER A 741 -20.411 5.245 23.208 1.00 9.32 N ATOM 1760 CA SER A 741 -20.510 3.791 23.295 1.00 7.82 C ATOM 1761 C SER A 741 -20.477 3.382 24.754 1.00 10.38 C ATOM 1762 O SER A 741 -21.214 2.506 25.183 1.00 13.84 O ATOM 1763 CB SER A 741 -19.378 3.099 22.530 1.00 8.21 C ATOM 1764 OG SER A 741 -19.469 3.401 21.160 1.00 9.87 O ATOM 1765 HG SER A 741 -20.340 3.085 20.811 1.00 0.00 H ATOM 1766 H SER A 741 -19.507 5.684 22.938 1.00 0.00 H ATOM 1767 N ILE A 742 -19.625 4.036 25.521 1.00 9.99 N ATOM 1768 CA ILE A 742 -19.512 3.723 26.935 1.00 12.31 C ATOM 1769 C ILE A 742 -20.761 4.166 27.690 1.00 15.14 C ATOM 1770 O ILE A 742 -21.311 3.401 28.487 1.00 14.48 O ATOM 1771 CB ILE A 742 -18.280 4.379 27.539 1.00 14.18 C ATOM 1772 CG1 ILE A 742 -17.024 3.754 26.923 1.00 16.39 C ATOM 1773 CG2 ILE A 742 -18.274 4.219 29.061 1.00 17.73 C ATOM 1774 CD1 ILE A 742 -15.760 4.401 27.355 1.00 19.24 C ATOM 1775 H ILE A 742 -19.029 4.782 25.109 1.00 0.00 H ATOM 1776 N MET A 743 -21.220 5.385 27.412 1.00 13.06 N ATOM 1777 CA MET A 743 -22.310 5.992 28.192 1.00 12.86 C ATOM 1778 C MET A 743 -23.692 5.514 27.764 1.00 19.66 C ATOM 1779 O MET A 743 -24.572 5.344 28.613 1.00 17.79 O ATOM 1780 CB MET A 743 -22.253 7.521 28.092 1.00 12.29 C ATOM 1781 CG MET A 743 -21.134 8.161 28.894 1.00 22.83 C ATOM 1782 SD MET A 743 -20.863 9.889 28.445 1.00 87.58 S ATOM 1783 CE MET A 743 -22.373 10.649 29.048 1.00 52.82 C ATOM 1784 H MET A 743 -20.798 5.920 26.626 1.00 0.00 H ATOM 1785 N TYR A 744 -23.882 5.295 26.463 1.00 15.16 N ATOM 1786 CA TYR A 744 -25.217 5.049 25.912 1.00 15.02 C ATOM 1787 C TYR A 744 -25.345 3.768 25.093 1.00 13.66 C ATOM 1788 O TYR A 744 -26.396 3.520 24.506 1.00 19.27 O ATOM 1789 CB TYR A 744 -25.653 6.234 25.040 1.00 17.52 C ATOM 1790 CG TYR A 744 -25.602 7.559 25.754 1.00 20.90 C ATOM 1791 CD1 TYR A 744 -26.503 7.858 26.770 1.00 28.56 C ATOM 1792 CD2 TYR A 744 -24.653 8.514 25.416 1.00 26.44 C ATOM 1793 CE1 TYR A 744 -26.459 9.076 27.433 1.00 32.27 C ATOM 1794 CE2 TYR A 744 -24.596 9.729 26.079 1.00 30.25 C ATOM 1795 CZ TYR A 744 -25.502 10.001 27.085 1.00 36.65 C ATOM 1796 OH TYR A 744 -25.456 11.207 27.745 1.00 46.61 O ATOM 1797 HH TYR A 744 -26.171 11.235 28.430 1.00 0.00 H ATOM 1798 H TYR A 744 -23.062 5.299 25.823 1.00 0.00 H ATOM 1799 N ARG A 745 -24.291 2.954 25.061 1.00 14.34 N ATOM 1800 CA ARG A 745 -24.252 1.746 24.228 1.00 16.62 C ATOM 1801 C ARG A 745 -24.587 2.042 22.771 1.00 18.72 C ATOM 1802 O ARG A 745 -25.247 1.245 22.107 1.00 18.03 O ATOM 1803 CB ARG A 745 -25.214 0.669 24.755 1.00 19.26 C ATOM 1804 CG ARG A 745 -24.692 -0.134 25.924 1.00 30.72 C ATOM 1805 CD ARG A 745 -25.581 -1.355 26.170 1.00 31.86 C ATOM 1806 NE ARG A 745 -26.976 -0.973 26.347 1.00 32.04 N ATOM 1807 CZ ARG A 745 -27.625 -0.986 27.510 1.00 29.62 C ATOM 1808 NH1 ARG A 745 -28.890 -0.610 27.552 1.00 26.02 N ATOM 1809 NH2 ARG A 745 -27.021 -1.381 28.625 1.00 24.55 N ATOM 1810 HE ARG A 745 -27.503 -0.668 25.504 1.00 0.00 H ATOM 1811 HH12 ARG A 745 -29.405 -0.617 28.456 1.00 0.00 H ATOM 1812 HH11 ARG A 745 -29.372 -0.307 26.681 1.00 0.00 H ATOM 1813 HH22 ARG A 745 -27.542 -1.385 29.525 1.00 0.00 H ATOM 1814 HH21 ARG A 745 -26.027 -1.686 28.598 1.00 0.00 H ATOM 1815 H ARG A 745 -23.464 3.183 25.649 1.00 0.00 H ATOM 1816 N LYS A 746 -24.146 3.191 22.272 1.00 12.86 N ATOM 1817 CA LYS A 746 -24.360 3.510 20.866 1.00 10.54 C ATOM 1818 C LYS A 746 -23.153 3.029 20.075 1.00 12.50 C ATOM 1819 O LYS A 746 -22.069 3.572 20.243 1.00 14.67 O ATOM 1820 CB LYS A 746 -24.555 5.013 20.656 1.00 15.80 C ATOM 1821 CG LYS A 746 -25.762 5.606 21.381 1.00 29.54 C ATOM 1822 CD LYS A 746 -27.038 4.862 21.026 1.00 41.99 C ATOM 1823 CE LYS A 746 -28.230 5.399 21.811 1.00 51.88 C ATOM 1824 NZ LYS A 746 -29.487 4.649 21.512 1.00 54.70 N ATOM 1825 HZ1 LYS A 746 -29.704 4.729 20.498 1.00 0.00 H ATOM 1826 HZ2 LYS A 746 -29.360 3.648 21.762 1.00 0.00 H ATOM 1827 HZ3 LYS A 746 -30.269 5.050 22.068 1.00 0.00 H ATOM 1828 H LYS A 746 -23.646 3.865 22.886 1.00 0.00 H ATOM 1829 N PHE A 747 -23.344 2.012 19.240 1.00 11.18 N ATOM 1830 CA PHE A 747 -22.264 1.486 18.394 1.00 9.09 C ATOM 1831 C PHE A 747 -22.589 1.706 16.933 1.00 10.88 C ATOM 1832 O PHE A 747 -23.646 1.296 16.460 1.00 15.06 O ATOM 1833 CB PHE A 747 -22.036 -0.004 18.654 1.00 10.76 C ATOM 1834 CG PHE A 747 -21.492 -0.304 20.018 1.00 18.59 C ATOM 1835 CD1 PHE A 747 -20.126 -0.354 20.242 1.00 17.39 C ATOM 1836 CD2 PHE A 747 -22.348 -0.543 21.078 1.00 17.25 C ATOM 1837 CE1 PHE A 747 -19.627 -0.640 21.494 1.00 16.73 C ATOM 1838 CE2 PHE A 747 -21.845 -0.829 22.328 1.00 15.52 C ATOM 1839 CZ PHE A 747 -20.496 -0.877 22.537 1.00 14.28 C ATOM 1840 H PHE A 747 -24.286 1.576 19.184 1.00 0.00 H ATOM 1841 N THR A 748 -21.682 2.364 16.215 1.00 9.21 N ATOM 1842 CA THR A 748 -21.939 2.799 14.847 1.00 7.05 C ATOM 1843 C THR A 748 -20.641 2.705 14.064 1.00 9.57 C ATOM 1844 O THR A 748 -19.589 2.419 14.640 1.00 9.30 O ATOM 1845 CB THR A 748 -22.423 4.251 14.775 1.00 10.95 C ATOM 1846 OG1 THR A 748 -21.427 5.100 15.363 1.00 11.64 O ATOM 1847 CG2 THR A 748 -23.751 4.450 15.520 1.00 14.18 C ATOM 1848 HG1 THR A 748 -21.288 4.839 16.308 1.00 0.00 H ATOM 1849 H THR A 748 -20.758 2.575 16.644 1.00 0.00 H ATOM 1850 N THR A 749 -20.692 2.991 12.769 1.00 9.51 N ATOM 1851 CA THR A 749 -19.445 3.109 12.020 1.00 8.15 C ATOM 1852 C THR A 749 -18.555 4.211 12.605 1.00 8.18 C ATOM 1853 O THR A 749 -17.338 4.160 12.482 1.00 8.25 O ATOM 1854 CB THR A 749 -19.700 3.386 10.531 1.00 13.20 C ATOM 1855 OG1 THR A 749 -20.574 4.507 10.397 1.00 21.12 O ATOM 1856 CG2 THR A 749 -20.351 2.166 9.889 1.00 19.03 C ATOM 1857 HG1 THR A 749 -20.156 5.302 10.814 1.00 0.00 H ATOM 1858 H THR A 749 -21.607 3.129 12.295 1.00 0.00 H ATOM 1859 N GLU A 750 -19.163 5.199 13.252 1.00 8.79 N ATOM 1860 CA GLU A 750 -18.421 6.300 13.839 1.00 7.17 C ATOM 1861 C GLU A 750 -17.711 5.900 15.140 1.00 6.66 C ATOM 1862 O GLU A 750 -16.663 6.448 15.457 1.00 7.79 O ATOM 1863 CB GLU A 750 -19.350 7.486 14.117 1.00 8.79 C ATOM 1864 CG GLU A 750 -19.865 8.170 12.874 1.00 14.00 C ATOM 1865 CD GLU A 750 -20.872 7.330 12.113 1.00 27.72 C ATOM 1866 OE1 GLU A 750 -21.857 6.869 12.728 1.00 25.24 O ATOM 1867 OE2 GLU A 750 -20.664 7.111 10.900 1.00 36.47 O ATOM 1868 H GLU A 750 -20.199 5.183 13.340 1.00 0.00 H ATOM 1869 N SER A 751 -18.286 4.976 15.903 1.00 5.70 N ATOM 1870 CA SER A 751 -17.589 4.463 17.078 1.00 6.75 C ATOM 1871 C SER A 751 -16.475 3.513 16.621 1.00 9.00 C ATOM 1872 O SER A 751 -15.438 3.409 17.273 1.00 6.58 O ATOM 1873 CB SER A 751 -18.553 3.765 18.054 1.00 8.21 C ATOM 1874 OG SER A 751 -19.263 2.693 17.467 1.00 10.05 O ATOM 1875 HG SER A 751 -18.622 2.012 17.142 1.00 0.00 H ATOM 1876 H SER A 751 -19.233 4.619 15.663 1.00 0.00 H ATOM 1877 N ASP A 752 -16.674 2.827 15.498 1.00 6.40 N ATOM 1878 CA ASP A 752 -15.575 2.034 14.926 1.00 5.94 C ATOM 1879 C ASP A 752 -14.414 2.945 14.479 1.00 2.59 C ATOM 1880 O ASP A 752 -13.246 2.584 14.602 1.00 4.60 O ATOM 1881 CB ASP A 752 -16.056 1.173 13.747 1.00 6.94 C ATOM 1882 CG ASP A 752 -16.681 -0.173 14.189 1.00 10.60 C ATOM 1883 OD1 ASP A 752 -16.606 -0.561 15.392 1.00 8.74 O ATOM 1884 OD2 ASP A 752 -17.231 -0.865 13.299 1.00 9.30 O ATOM 1885 H ASP A 752 -17.601 2.851 15.028 1.00 0.00 H ATOM 1886 N VAL A 753 -14.726 4.131 13.957 1.00 6.28 N ATOM 1887 CA VAL A 753 -13.661 5.074 13.578 1.00 5.47 C ATOM 1888 C VAL A 753 -12.873 5.529 14.792 1.00 4.04 C ATOM 1889 O VAL A 753 -11.645 5.627 14.746 1.00 6.26 O ATOM 1890 CB VAL A 753 -14.230 6.304 12.838 1.00 6.63 C ATOM 1891 CG1 VAL A 753 -13.263 7.496 12.925 1.00 8.85 C ATOM 1892 CG2 VAL A 753 -14.501 5.942 11.384 1.00 10.58 C ATOM 1893 H VAL A 753 -15.723 4.391 13.817 1.00 0.00 H ATOM 1894 N TRP A 754 -13.570 5.780 15.891 1.00 4.92 N ATOM 1895 CA TRP A 754 -12.886 6.096 17.146 1.00 4.96 C ATOM 1896 C TRP A 754 -11.883 5.000 17.494 1.00 5.30 C ATOM 1897 O TRP A 754 -10.715 5.272 17.809 1.00 4.60 O ATOM 1898 CB TRP A 754 -13.903 6.259 18.285 1.00 5.01 C ATOM 1899 CG TRP A 754 -13.254 6.567 19.602 1.00 3.50 C ATOM 1900 CD1 TRP A 754 -12.525 5.704 20.389 1.00 5.90 C ATOM 1901 CD2 TRP A 754 -13.254 7.826 20.282 1.00 6.37 C ATOM 1902 NE1 TRP A 754 -12.079 6.359 21.509 1.00 8.57 N ATOM 1903 CE2 TRP A 754 -12.512 7.659 21.469 1.00 6.37 C ATOM 1904 CE3 TRP A 754 -13.822 9.075 20.007 1.00 6.15 C ATOM 1905 CZ2 TRP A 754 -12.331 8.694 22.392 1.00 9.12 C ATOM 1906 CZ3 TRP A 754 -13.640 10.105 20.922 1.00 9.90 C ATOM 1907 CH2 TRP A 754 -12.893 9.906 22.098 1.00 11.12 C ATOM 1908 HE1 TRP A 754 -11.505 5.937 22.267 1.00 0.00 H ATOM 1909 H TRP A 754 -14.609 5.752 15.862 1.00 0.00 H ATOM 1910 N SER A 755 -12.344 3.756 17.438 1.00 3.80 N ATOM 1911 CA SER A 755 -11.492 2.618 17.726 1.00 5.90 C ATOM 1912 C SER A 755 -10.311 2.553 16.785 1.00 4.29 C ATOM 1913 O SER A 755 -9.221 2.163 17.190 1.00 4.83 O ATOM 1914 CB SER A 755 -12.294 1.323 17.641 1.00 6.23 C ATOM 1915 OG SER A 755 -13.278 1.310 18.655 1.00 8.46 O ATOM 1916 HG SER A 755 -12.839 1.369 19.540 1.00 0.00 H ATOM 1917 H SER A 755 -13.339 3.594 17.182 1.00 0.00 H ATOM 1918 N PHE A 756 -10.518 2.920 15.525 1.00 4.85 N ATOM 1919 CA PHE A 756 -9.402 2.939 14.591 1.00 3.62 C ATOM 1920 C PHE A 756 -8.347 3.955 15.022 1.00 5.39 C ATOM 1921 O PHE A 756 -7.150 3.712 14.882 1.00 6.11 O ATOM 1922 CB PHE A 756 -9.846 3.245 13.153 1.00 6.26 C ATOM 1923 CG PHE A 756 -8.684 3.274 12.189 1.00 3.46 C ATOM 1924 CD1 PHE A 756 -8.126 2.087 11.743 1.00 7.70 C ATOM 1925 CD2 PHE A 756 -8.100 4.470 11.809 1.00 7.35 C ATOM 1926 CE1 PHE A 756 -7.027 2.088 10.913 1.00 8.83 C ATOM 1927 CE2 PHE A 756 -6.990 4.478 10.967 1.00 7.47 C ATOM 1928 CZ PHE A 756 -6.467 3.289 10.513 1.00 5.07 C ATOM 1929 H PHE A 756 -11.471 3.192 15.208 1.00 0.00 H ATOM 1930 N GLY A 757 -8.781 5.102 15.541 1.00 5.63 N ATOM 1931 CA GLY A 757 -7.824 6.077 16.044 1.00 3.38 C ATOM 1932 C GLY A 757 -6.989 5.444 17.149 1.00 5.48 C ATOM 1933 O GLY A 757 -5.774 5.630 17.215 1.00 4.89 O ATOM 1934 H GLY A 757 -9.801 5.301 15.587 1.00 0.00 H ATOM 1935 N VAL A 758 -7.641 4.667 18.005 1.00 3.03 N ATOM 1936 CA VAL A 758 -6.924 3.967 19.068 1.00 4.89 C ATOM 1937 C VAL A 758 -5.989 2.894 18.481 1.00 5.75 C ATOM 1938 O VAL A 758 -4.877 2.714 18.964 1.00 5.33 O ATOM 1939 CB VAL A 758 -7.907 3.342 20.090 1.00 5.49 C ATOM 1940 CG1 VAL A 758 -7.142 2.630 21.218 1.00 6.25 C ATOM 1941 CG2 VAL A 758 -8.797 4.426 20.674 1.00 4.05 C ATOM 1942 H VAL A 758 -8.671 4.556 17.918 1.00 0.00 H ATOM 1943 N ILE A 759 -6.412 2.203 17.425 1.00 5.28 N ATOM 1944 CA ILE A 759 -5.504 1.286 16.725 1.00 3.80 C ATOM 1945 C ILE A 759 -4.247 2.016 16.216 1.00 4.76 C ATOM 1946 O ILE A 759 -3.132 1.518 16.363 1.00 6.21 O ATOM 1947 CB ILE A 759 -6.227 0.588 15.558 1.00 3.29 C ATOM 1948 CG1 ILE A 759 -7.158 -0.499 16.111 1.00 3.36 C ATOM 1949 CG2 ILE A 759 -5.225 0.008 14.550 1.00 4.61 C ATOM 1950 CD1 ILE A 759 -7.990 -1.215 15.027 1.00 7.44 C ATOM 1951 H ILE A 759 -7.392 2.313 17.094 1.00 0.00 H ATOM 1952 N LEU A 760 -4.419 3.200 15.630 1.00 4.27 N ATOM 1953 CA LEU A 760 -3.262 3.983 15.190 1.00 5.42 C ATOM 1954 C LEU A 760 -2.318 4.242 16.359 1.00 7.53 C ATOM 1955 O LEU A 760 -1.099 4.147 16.234 1.00 8.35 O ATOM 1956 CB LEU A 760 -3.699 5.311 14.592 1.00 8.05 C ATOM 1957 CG LEU A 760 -4.174 5.327 13.152 1.00 16.32 C ATOM 1958 CD1 LEU A 760 -4.614 6.747 12.809 1.00 12.77 C ATOM 1959 CD2 LEU A 760 -3.037 4.891 12.244 1.00 19.51 C ATOM 1960 H LEU A 760 -5.380 3.570 15.484 1.00 0.00 H ATOM 1961 N TRP A 761 -2.896 4.551 17.505 1.00 5.13 N ATOM 1962 CA TRP A 761 -2.098 4.798 18.693 1.00 5.84 C ATOM 1963 C TRP A 761 -1.357 3.527 19.120 1.00 9.14 C ATOM 1964 O TRP A 761 -0.166 3.564 19.443 1.00 8.31 O ATOM 1965 CB TRP A 761 -2.998 5.318 19.810 1.00 5.76 C ATOM 1966 CG TRP A 761 -2.267 5.829 21.020 1.00 6.99 C ATOM 1967 CD1 TRP A 761 -1.888 7.124 21.272 1.00 9.46 C ATOM 1968 CD2 TRP A 761 -1.840 5.056 22.146 1.00 8.73 C ATOM 1969 NE1 TRP A 761 -1.261 7.199 22.497 1.00 9.47 N ATOM 1970 CE2 TRP A 761 -1.215 5.944 23.048 1.00 11.53 C ATOM 1971 CE3 TRP A 761 -1.928 3.695 22.479 1.00 8.80 C ATOM 1972 CZ2 TRP A 761 -0.685 5.514 24.271 1.00 13.02 C ATOM 1973 CZ3 TRP A 761 -1.401 3.269 23.687 1.00 9.15 C ATOM 1974 CH2 TRP A 761 -0.792 4.178 24.574 1.00 8.92 C ATOM 1975 HE1 TRP A 761 -0.884 8.065 22.932 1.00 0.00 H ATOM 1976 H TRP A 761 -3.932 4.618 17.558 1.00 0.00 H ATOM 1977 N GLU A 762 -2.056 2.399 19.114 1.00 6.33 N ATOM 1978 CA GLU A 762 -1.403 1.105 19.346 1.00 5.13 C ATOM 1979 C GLU A 762 -0.236 0.848 18.413 1.00 5.12 C ATOM 1980 O GLU A 762 0.820 0.392 18.846 1.00 6.76 O ATOM 1981 CB GLU A 762 -2.388 -0.045 19.177 1.00 6.04 C ATOM 1982 CG GLU A 762 -3.493 -0.132 20.209 1.00 7.01 C ATOM 1983 CD GLU A 762 -4.254 -1.429 20.020 1.00 7.07 C ATOM 1984 OE1 GLU A 762 -3.785 -2.464 20.547 1.00 8.59 O ATOM 1985 OE2 GLU A 762 -5.268 -1.424 19.284 1.00 6.02 O ATOM 1986 H GLU A 762 -3.081 2.432 18.942 1.00 0.00 H ATOM 1987 N ILE A 763 -0.436 1.095 17.127 1.00 5.27 N ATOM 1988 CA ILE A 763 0.619 0.816 16.153 1.00 5.10 C ATOM 1989 C ILE A 763 1.845 1.659 16.476 1.00 7.85 C ATOM 1990 O ILE A 763 2.956 1.145 16.558 1.00 7.07 O ATOM 1991 CB ILE A 763 0.131 1.077 14.696 1.00 4.40 C ATOM 1992 CG1 ILE A 763 -0.899 0.024 14.296 1.00 4.42 C ATOM 1993 CG2 ILE A 763 1.303 1.056 13.695 1.00 5.38 C ATOM 1994 CD1 ILE A 763 -1.674 0.370 13.022 1.00 6.53 C ATOM 1995 H ILE A 763 -1.345 1.488 16.809 1.00 0.00 H ATOM 1996 N PHE A 764 1.642 2.947 16.715 1.00 7.61 N ATOM 1997 CA PHE A 764 2.785 3.833 16.904 1.00 11.37 C ATOM 1998 C PHE A 764 3.392 3.765 18.312 1.00 9.38 C ATOM 1999 O PHE A 764 4.426 4.386 18.586 1.00 13.73 O ATOM 2000 CB PHE A 764 2.383 5.262 16.525 1.00 10.93 C ATOM 2001 CG PHE A 764 2.405 5.489 15.042 1.00 9.45 C ATOM 2002 CD1 PHE A 764 1.350 5.060 14.251 1.00 8.22 C ATOM 2003 CD2 PHE A 764 3.514 6.058 14.427 1.00 11.18 C ATOM 2004 CE1 PHE A 764 1.379 5.227 12.875 1.00 9.58 C ATOM 2005 CE2 PHE A 764 3.549 6.227 13.052 1.00 12.83 C ATOM 2006 CZ PHE A 764 2.484 5.815 12.274 1.00 9.35 C ATOM 2007 H PHE A 764 0.674 3.323 16.767 1.00 0.00 H ATOM 2008 N THR A 765 2.785 2.974 19.186 1.00 9.16 N ATOM 2009 CA THR A 765 3.391 2.673 20.476 1.00 7.33 C ATOM 2010 C THR A 765 3.842 1.217 20.564 1.00 7.36 C ATOM 2011 O THR A 765 4.114 0.722 21.654 1.00 12.08 O ATOM 2012 CB THR A 765 2.429 2.950 21.639 1.00 8.76 C ATOM 2013 OG1 THR A 765 1.281 2.092 21.529 1.00 12.00 O ATOM 2014 CG2 THR A 765 1.973 4.419 21.651 1.00 6.89 C ATOM 2015 HG1 THR A 765 0.820 2.268 20.671 1.00 0.00 H ATOM 2016 H THR A 765 1.861 2.562 18.947 1.00 0.00 H ATOM 2017 N TYR A 766 3.905 0.531 19.427 1.00 6.73 N ATOM 2018 CA TYR A 766 4.294 -0.880 19.412 1.00 7.28 C ATOM 2019 C TYR A 766 3.416 -1.753 20.311 1.00 12.39 C ATOM 2020 O TYR A 766 3.904 -2.639 21.014 1.00 10.61 O ATOM 2021 CB TYR A 766 5.771 -1.027 19.810 1.00 8.75 C ATOM 2022 CG TYR A 766 6.677 -0.484 18.740 1.00 11.23 C ATOM 2023 CD1 TYR A 766 6.937 -1.230 17.595 1.00 15.13 C ATOM 2024 CD2 TYR A 766 7.245 0.775 18.850 1.00 15.35 C ATOM 2025 CE1 TYR A 766 7.750 -0.746 16.597 1.00 18.06 C ATOM 2026 CE2 TYR A 766 8.074 1.272 17.849 1.00 16.53 C ATOM 2027 CZ TYR A 766 8.313 0.499 16.727 1.00 17.47 C ATOM 2028 OH TYR A 766 9.125 0.953 15.715 1.00 23.77 O ATOM 2029 HH TYR A 766 9.176 0.268 15.002 1.00 0.00 H ATOM 2030 H TYR A 766 3.674 1.006 18.531 1.00 0.00 H ATOM 2031 N GLY A 767 2.111 -1.498 20.282 1.00 7.95 N ATOM 2032 CA GLY A 767 1.171 -2.411 20.900 1.00 8.99 C ATOM 2033 C GLY A 767 0.900 -2.144 22.363 1.00 8.68 C ATOM 2034 O GLY A 767 0.284 -2.964 23.034 1.00 10.92 O ATOM 2035 H GLY A 767 1.763 -0.638 19.813 1.00 0.00 H ATOM 2036 N LYS A 768 1.332 -0.994 22.866 1.00 8.15 N ATOM 2037 CA LYS A 768 1.098 -0.706 24.277 1.00 8.30 C ATOM 2038 C LYS A 768 -0.393 -0.560 24.525 1.00 9.52 C ATOM 2039 O LYS A 768 -1.139 -0.193 23.618 1.00 10.18 O ATOM 2040 CB LYS A 768 1.863 0.548 24.700 1.00 16.01 C ATOM 2041 CG LYS A 768 2.035 0.681 26.205 1.00 30.82 C ATOM 2042 CD LYS A 768 3.271 1.499 26.575 1.00 45.26 C ATOM 2043 CE LYS A 768 3.345 2.807 25.803 1.00 50.75 C ATOM 2044 NZ LYS A 768 2.030 3.502 25.737 1.00 61.59 N ATOM 2045 HZ1 LYS A 768 1.338 2.887 25.263 1.00 0.00 H ATOM 2046 HZ2 LYS A 768 1.703 3.715 26.701 1.00 0.00 H ATOM 2047 HZ3 LYS A 768 2.134 4.387 25.201 1.00 0.00 H ATOM 2048 H LYS A 768 1.830 -0.308 22.263 1.00 0.00 H ATOM 2049 N GLN A 769 -0.842 -0.865 25.740 1.00 7.98 N ATOM 2050 CA GLN A 769 -2.256 -0.715 26.051 1.00 8.68 C ATOM 2051 C GLN A 769 -2.644 0.754 26.157 1.00 10.44 C ATOM 2052 O GLN A 769 -1.994 1.518 26.861 1.00 9.36 O ATOM 2053 CB GLN A 769 -2.602 -1.419 27.353 1.00 9.38 C ATOM 2054 CG GLN A 769 -4.099 -1.468 27.622 1.00 12.38 C ATOM 2055 CD GLN A 769 -4.424 -2.036 28.979 1.00 18.25 C ATOM 2056 OE1 GLN A 769 -3.813 -1.664 29.979 1.00 18.62 O ATOM 2057 NE2 GLN A 769 -5.400 -2.938 29.026 1.00 12.05 N ATOM 2058 HE22 GLN A 769 -5.888 -3.222 28.153 1.00 0.00 H ATOM 2059 HE21 GLN A 769 -5.675 -3.360 29.936 1.00 0.00 H ATOM 2060 H GLN A 769 -0.183 -1.210 26.467 1.00 0.00 H ATOM 2061 N PRO A 770 -3.723 1.156 25.471 1.00 8.70 N ATOM 2062 CA PRO A 770 -4.206 2.529 25.650 1.00 8.98 C ATOM 2063 C PRO A 770 -4.542 2.787 27.106 1.00 8.63 C ATOM 2064 O PRO A 770 -5.135 1.912 27.741 1.00 10.16 O ATOM 2065 CB PRO A 770 -5.479 2.587 24.796 1.00 10.49 C ATOM 2066 CG PRO A 770 -5.421 1.412 23.921 1.00 12.63 C ATOM 2067 CD PRO A 770 -4.611 0.362 24.617 1.00 11.91 C ATOM 2068 N TRP A 771 -4.180 3.965 27.610 1.00 8.33 N ATOM 2069 CA TRP A 771 -4.471 4.349 28.988 1.00 7.67 C ATOM 2070 C TRP A 771 -3.871 3.369 29.980 1.00 9.15 C ATOM 2071 O TRP A 771 -4.443 3.122 31.042 1.00 12.71 O ATOM 2072 CB TRP A 771 -5.983 4.466 29.215 1.00 12.39 C ATOM 2073 CG TRP A 771 -6.636 5.468 28.320 1.00 12.60 C ATOM 2074 CD1 TRP A 771 -7.551 5.223 27.328 1.00 14.65 C ATOM 2075 CD2 TRP A 771 -6.404 6.874 28.318 1.00 13.55 C ATOM 2076 NE1 TRP A 771 -7.910 6.403 26.718 1.00 12.07 N ATOM 2077 CE2 TRP A 771 -7.218 7.432 27.307 1.00 15.68 C ATOM 2078 CE3 TRP A 771 -5.587 7.724 29.079 1.00 14.64 C ATOM 2079 CZ2 TRP A 771 -7.235 8.797 27.036 1.00 19.48 C ATOM 2080 CZ3 TRP A 771 -5.606 9.081 28.807 1.00 20.74 C ATOM 2081 CH2 TRP A 771 -6.420 9.603 27.788 1.00 20.09 C ATOM 2082 HE1 TRP A 771 -8.593 6.499 25.939 1.00 0.00 H ATOM 2083 H TRP A 771 -3.671 4.636 27.000 1.00 0.00 H ATOM 2084 N PHE A 772 -2.711 2.825 29.629 1.00 9.76 N ATOM 2085 CA PHE A 772 -2.023 1.846 30.462 1.00 9.02 C ATOM 2086 C PHE A 772 -1.814 2.358 31.885 1.00 13.54 C ATOM 2087 O PHE A 772 -1.737 1.563 32.811 1.00 13.33 O ATOM 2088 CB PHE A 772 -0.673 1.478 29.846 1.00 11.53 C ATOM 2089 CG PHE A 772 0.253 2.642 29.708 1.00 13.84 C ATOM 2090 CD1 PHE A 772 1.103 3.000 30.750 1.00 15.78 C ATOM 2091 CD2 PHE A 772 0.276 3.395 28.545 1.00 14.39 C ATOM 2092 CE1 PHE A 772 1.958 4.089 30.628 1.00 15.94 C ATOM 2093 CE2 PHE A 772 1.123 4.483 28.421 1.00 17.08 C ATOM 2094 CZ PHE A 772 1.968 4.829 29.464 1.00 20.61 C ATOM 2095 H PHE A 772 -2.278 3.108 28.727 1.00 0.00 H ATOM 2096 N GLN A 773 -1.725 3.675 32.061 1.00 10.74 N ATOM 2097 CA GLN A 773 -1.476 4.232 33.399 1.00 13.65 C ATOM 2098 C GLN A 773 -2.737 4.376 34.244 1.00 16.94 C ATOM 2099 O GLN A 773 -2.674 4.821 35.396 1.00 17.57 O ATOM 2100 CB GLN A 773 -0.773 5.587 33.300 1.00 14.07 C ATOM 2101 CG GLN A 773 -1.581 6.695 32.652 1.00 17.69 C ATOM 2102 CD GLN A 773 -1.363 6.738 31.159 1.00 20.69 C ATOM 2103 OE1 GLN A 773 -1.908 5.923 30.421 1.00 16.45 O ATOM 2104 NE2 GLN A 773 -0.524 7.669 30.706 1.00 29.55 N ATOM 2105 HE22 GLN A 773 -0.085 8.340 31.368 1.00 0.00 H ATOM 2106 HE21 GLN A 773 -0.309 7.725 29.690 1.00 0.00 H ATOM 2107 H GLN A 773 -1.832 4.314 31.247 1.00 0.00 H ATOM 2108 N LEU A 774 -3.880 3.995 33.681 1.00 13.44 N ATOM 2109 CA LEU A 774 -5.166 4.181 34.345 1.00 15.82 C ATOM 2110 C LEU A 774 -5.857 2.868 34.680 1.00 13.74 C ATOM 2111 O LEU A 774 -5.809 1.914 33.906 1.00 15.02 O ATOM 2112 CB LEU A 774 -6.108 5.020 33.465 1.00 13.67 C ATOM 2113 CG LEU A 774 -5.674 6.435 33.117 1.00 13.86 C ATOM 2114 CD1 LEU A 774 -6.808 7.159 32.409 1.00 15.26 C ATOM 2115 CD2 LEU A 774 -5.270 7.170 34.387 1.00 15.63 C ATOM 2116 H LEU A 774 -3.857 3.552 32.740 1.00 0.00 H ATOM 2117 N SER A 775 -6.511 2.832 35.837 1.00 14.98 N ATOM 2118 CA SER A 775 -7.419 1.741 36.179 1.00 19.00 C ATOM 2119 C SER A 775 -8.661 1.821 35.303 1.00 18.22 C ATOM 2120 O SER A 775 -8.905 2.840 34.667 1.00 15.46 O ATOM 2121 CB SER A 775 -7.843 1.819 37.643 1.00 18.47 C ATOM 2122 OG SER A 775 -8.765 2.881 37.803 1.00 18.41 O ATOM 2123 HG SER A 775 -9.043 2.935 38.752 1.00 0.00 H ATOM 2124 H SER A 775 -6.372 3.604 36.519 1.00 0.00 H ATOM 2125 N ASN A 776 -9.470 0.768 35.310 1.00 19.33 N ATOM 2126 CA ASN A 776 -10.672 0.742 34.481 1.00 19.15 C ATOM 2127 C ASN A 776 -11.656 1.856 34.822 1.00 17.49 C ATOM 2128 O ASN A 776 -12.219 2.495 33.935 1.00 15.79 O ATOM 2129 CB ASN A 776 -11.351 -0.617 34.597 1.00 21.02 C ATOM 2130 CG ASN A 776 -10.609 -1.689 33.840 1.00 23.61 C ATOM 2131 OD1 ASN A 776 -10.100 -1.443 32.740 1.00 21.19 O ATOM 2132 ND2 ASN A 776 -10.527 -2.884 34.421 1.00 18.25 N ATOM 2133 HD22 ASN A 776 -10.972 -3.043 35.348 1.00 0.00 H ATOM 2134 HD21 ASN A 776 -10.018 -3.658 33.948 1.00 0.00 H ATOM 2135 H ASN A 776 -9.245 -0.049 35.913 1.00 0.00 H ATOM 2136 N THR A 777 -11.854 2.093 36.114 1.00 19.74 N ATOM 2137 CA THR A 777 -12.698 3.185 36.563 1.00 17.91 C ATOM 2138 C THR A 777 -12.171 4.535 36.072 1.00 17.80 C ATOM 2139 O THR A 777 -12.936 5.385 35.607 1.00 17.35 O ATOM 2140 CB THR A 777 -12.800 3.189 38.096 1.00 26.37 C ATOM 2141 OG1 THR A 777 -13.588 2.067 38.508 1.00 39.81 O ATOM 2142 CG2 THR A 777 -13.450 4.461 38.588 1.00 32.47 C ATOM 2143 HG1 THR A 777 -13.155 1.231 38.202 1.00 0.00 H ATOM 2144 H THR A 777 -11.394 1.483 36.819 1.00 0.00 H ATOM 2145 N GLU A 778 -10.856 4.716 36.146 1.00 14.77 N ATOM 2146 CA GLU A 778 -10.235 5.947 35.683 1.00 14.27 C ATOM 2147 C GLU A 778 -10.360 6.113 34.170 1.00 15.37 C ATOM 2148 O GLU A 778 -10.500 7.227 33.681 1.00 16.10 O ATOM 2149 CB GLU A 778 -8.765 5.989 36.106 1.00 17.58 C ATOM 2150 CG GLU A 778 -8.596 6.037 37.626 1.00 24.64 C ATOM 2151 CD GLU A 778 -7.164 5.831 38.079 1.00 34.57 C ATOM 2152 OE1 GLU A 778 -6.395 5.135 37.379 1.00 29.59 O ATOM 2153 OE2 GLU A 778 -6.808 6.371 39.148 1.00 46.74 O ATOM 2154 H GLU A 778 -10.259 3.962 36.543 1.00 0.00 H ATOM 2155 N VAL A 779 -10.322 5.007 33.434 1.00 14.47 N ATOM 2156 CA VAL A 779 -10.496 5.074 31.983 1.00 15.39 C ATOM 2157 C VAL A 779 -11.879 5.620 31.623 1.00 13.87 C ATOM 2158 O VAL A 779 -12.011 6.510 30.776 1.00 15.56 O ATOM 2159 CB VAL A 779 -10.296 3.693 31.331 1.00 12.65 C ATOM 2160 CG1 VAL A 779 -10.775 3.710 29.886 1.00 12.89 C ATOM 2161 CG2 VAL A 779 -8.836 3.283 31.411 1.00 14.74 C ATOM 2162 H VAL A 779 -10.167 4.087 33.893 1.00 0.00 H ATOM 2163 N ILE A 780 -12.909 5.089 32.274 1.00 16.07 N ATOM 2164 CA ILE A 780 -14.287 5.502 31.994 1.00 17.49 C ATOM 2165 C ILE A 780 -14.461 6.996 32.257 1.00 18.25 C ATOM 2166 O ILE A 780 -15.036 7.727 31.440 1.00 16.29 O ATOM 2167 CB ILE A 780 -15.298 4.689 32.837 1.00 17.52 C ATOM 2168 CG1 ILE A 780 -15.303 3.227 32.390 1.00 21.14 C ATOM 2169 CG2 ILE A 780 -16.705 5.272 32.718 1.00 17.27 C ATOM 2170 CD1 ILE A 780 -16.193 2.340 33.216 1.00 26.29 C ATOM 2171 H ILE A 780 -12.733 4.364 32.999 1.00 0.00 H ATOM 2172 N GLU A 781 -13.936 7.460 33.383 1.00 16.79 N ATOM 2173 CA GLU A 781 -14.025 8.877 33.718 1.00 19.89 C ATOM 2174 C GLU A 781 -13.240 9.714 32.711 1.00 17.89 C ATOM 2175 O GLU A 781 -13.714 10.747 32.235 1.00 23.81 O ATOM 2176 CB GLU A 781 -13.514 9.131 35.142 1.00 27.76 C ATOM 2177 CG GLU A 781 -12.822 10.476 35.307 1.00 44.54 C ATOM 2178 CD GLU A 781 -12.829 10.979 36.735 1.00 65.06 C ATOM 2179 OE1 GLU A 781 -12.139 10.374 37.584 1.00 71.77 O ATOM 2180 OE2 GLU A 781 -13.523 11.982 37.008 1.00 72.45 O ATOM 2181 H GLU A 781 -13.456 6.807 34.034 1.00 0.00 H ATOM 2182 N CYS A 782 -12.045 9.247 32.376 1.00 17.33 N ATOM 2183 CA CYS A 782 -11.184 9.916 31.415 1.00 17.28 C ATOM 2184 C CYS A 782 -11.859 10.110 30.053 1.00 18.59 C ATOM 2185 O CYS A 782 -11.829 11.200 29.483 1.00 16.52 O ATOM 2186 CB CYS A 782 -9.896 9.113 31.256 1.00 25.22 C ATOM 2187 SG CYS A 782 -8.805 9.704 29.992 1.00 48.83 S ATOM 2188 H CYS A 782 -11.711 8.367 32.818 1.00 0.00 H ATOM 2189 N ILE A 783 -12.474 9.048 29.539 1.00 16.55 N ATOM 2190 CA ILE A 783 -13.117 9.108 28.228 1.00 13.66 C ATOM 2191 C ILE A 783 -14.384 9.959 28.283 1.00 15.04 C ATOM 2192 O ILE A 783 -14.646 10.757 27.385 1.00 17.24 O ATOM 2193 CB ILE A 783 -13.440 7.703 27.715 1.00 12.58 C ATOM 2194 CG1 ILE A 783 -12.136 6.944 27.472 1.00 13.08 C ATOM 2195 CG2 ILE A 783 -14.245 7.777 26.420 1.00 16.91 C ATOM 2196 CD1 ILE A 783 -12.341 5.474 27.189 1.00 20.71 C ATOM 2197 H ILE A 783 -12.498 8.160 30.080 1.00 0.00 H ATOM 2198 N THR A 784 -15.146 9.803 29.362 1.00 17.98 N ATOM 2199 CA THR A 784 -16.370 10.572 29.579 1.00 18.39 C ATOM 2200 C THR A 784 -16.080 12.073 29.671 1.00 19.26 C ATOM 2201 O THR A 784 -16.873 12.899 29.209 1.00 25.19 O ATOM 2202 CB THR A 784 -17.093 10.097 30.864 1.00 21.06 C ATOM 2203 OG1 THR A 784 -17.538 8.747 30.676 1.00 33.01 O ATOM 2204 CG2 THR A 784 -18.301 10.973 31.166 1.00 36.15 C ATOM 2205 HG1 THR A 784 -16.757 8.165 30.497 1.00 0.00 H ATOM 2206 H THR A 784 -14.860 9.107 30.079 1.00 0.00 H ATOM 2207 N GLN A 785 -14.933 12.420 30.246 1.00 17.25 N ATOM 2208 CA GLN A 785 -14.576 13.823 30.449 1.00 23.04 C ATOM 2209 C GLN A 785 -13.819 14.416 29.264 1.00 26.17 C ATOM 2210 O GLN A 785 -13.359 15.552 29.326 1.00 28.30 O ATOM 2211 CB GLN A 785 -13.741 13.982 31.721 1.00 29.25 C ATOM 2212 CG GLN A 785 -14.530 13.782 32.995 1.00 41.21 C ATOM 2213 CD GLN A 785 -13.643 13.678 34.210 1.00 55.09 C ATOM 2214 OE1 GLN A 785 -12.419 13.780 34.113 1.00 57.87 O ATOM 2215 NE2 GLN A 785 -14.255 13.466 35.367 1.00 61.95 N ATOM 2216 HE22 GLN A 785 -15.291 13.387 35.400 1.00 0.00 H ATOM 2217 HE21 GLN A 785 -13.699 13.379 36.241 1.00 0.00 H ATOM 2218 H GLN A 785 -14.275 11.677 30.558 1.00 0.00 H ATOM 2219 N GLY A 786 -13.669 13.643 28.194 1.00 17.33 N ATOM 2220 CA GLY A 786 -13.143 14.183 26.955 1.00 15.77 C ATOM 2221 C GLY A 786 -11.638 14.309 26.848 1.00 20.92 C ATOM 2222 O GLY A 786 -11.140 15.058 26.013 1.00 18.16 O ATOM 2223 H GLY A 786 -13.932 12.638 28.245 1.00 0.00 H ATOM 2224 N ARG A 787 -10.900 13.580 27.677 1.00 16.63 N ATOM 2225 CA ARG A 787 -9.449 13.552 27.527 1.00 17.68 C ATOM 2226 C ARG A 787 -9.113 12.567 26.410 1.00 19.08 C ATOM 2227 O ARG A 787 -9.845 11.610 26.202 1.00 18.40 O ATOM 2228 CB ARG A 787 -8.763 13.160 28.837 1.00 20.74 C ATOM 2229 CG ARG A 787 -8.819 14.252 29.909 1.00 32.36 C ATOM 2230 CD ARG A 787 -8.393 13.720 31.271 1.00 45.34 C ATOM 2231 NE ARG A 787 -7.079 13.082 31.221 1.00 55.68 N ATOM 2232 CZ ARG A 787 -6.667 12.142 32.067 1.00 60.31 C ATOM 2233 NH1 ARG A 787 -7.470 11.712 33.034 1.00 61.63 N ATOM 2234 NH2 ARG A 787 -5.452 11.623 31.941 1.00 58.38 N ATOM 2235 HE ARG A 787 -6.422 13.383 30.473 1.00 0.00 H ATOM 2236 HH12 ARG A 787 -7.143 10.977 33.693 1.00 0.00 H ATOM 2237 HH11 ARG A 787 -8.426 12.111 33.132 1.00 0.00 H ATOM 2238 HH22 ARG A 787 -5.129 10.888 32.602 1.00 0.00 H ATOM 2239 HH21 ARG A 787 -4.823 11.951 31.181 1.00 0.00 H ATOM 2240 H ARG A 787 -11.356 13.030 28.432 1.00 0.00 H ATOM 2241 N VAL A 788 -8.036 12.811 25.671 1.00 15.82 N ATOM 2242 CA VAL A 788 -7.640 11.864 24.631 1.00 14.19 C ATOM 2243 C VAL A 788 -6.217 11.381 24.830 1.00 12.65 C ATOM 2244 O VAL A 788 -5.420 12.015 25.527 1.00 13.32 O ATOM 2245 CB VAL A 788 -7.759 12.460 23.218 1.00 17.23 C ATOM 2246 CG1 VAL A 788 -9.221 12.786 22.902 1.00 24.12 C ATOM 2247 CG2 VAL A 788 -6.847 13.678 23.072 1.00 19.36 C ATOM 2248 H VAL A 788 -7.477 13.673 25.832 1.00 0.00 H ATOM 2249 N LEU A 789 -5.911 10.247 24.206 1.00 11.14 N ATOM 2250 CA LEU A 789 -4.589 9.648 24.296 1.00 8.46 C ATOM 2251 C LEU A 789 -3.538 10.633 23.844 1.00 13.04 C ATOM 2252 O LEU A 789 -3.770 11.403 22.916 1.00 12.78 O ATOM 2253 CB LEU A 789 -4.528 8.384 23.450 1.00 8.31 C ATOM 2254 CG LEU A 789 -5.352 7.236 24.028 1.00 11.37 C ATOM 2255 CD1 LEU A 789 -5.679 6.223 22.939 1.00 9.03 C ATOM 2256 CD2 LEU A 789 -4.568 6.574 25.153 1.00 10.48 C ATOM 2257 H LEU A 789 -6.640 9.774 23.636 1.00 0.00 H ATOM 2258 N GLU A 790 -2.389 10.626 24.509 1.00 11.94 N ATOM 2259 CA GLU A 790 -1.339 11.576 24.170 1.00 13.28 C ATOM 2260 C GLU A 790 -0.578 11.116 22.940 1.00 10.56 C ATOM 2261 O GLU A 790 -0.525 9.924 22.639 1.00 12.84 O ATOM 2262 CB GLU A 790 -0.387 11.767 25.351 1.00 21.20 C ATOM 2263 CG GLU A 790 -1.105 12.234 26.611 1.00 31.46 C ATOM 2264 CD GLU A 790 -0.160 12.712 27.695 1.00 44.36 C ATOM 2265 OE1 GLU A 790 0.033 11.979 28.686 1.00 47.74 O ATOM 2266 OE2 GLU A 790 0.377 13.829 27.570 1.00 52.43 O ATOM 2267 H GLU A 790 -2.238 9.939 25.275 1.00 0.00 H ATOM 2268 N ARG A 791 -0.001 12.071 22.219 1.00 9.95 N ATOM 2269 CA ARG A 791 0.765 11.753 21.023 1.00 10.82 C ATOM 2270 C ARG A 791 2.023 10.987 21.390 1.00 15.89 C ATOM 2271 O ARG A 791 2.808 11.447 22.219 1.00 15.22 O ATOM 2272 CB ARG A 791 1.121 13.040 20.273 1.00 13.20 C ATOM 2273 CG ARG A 791 2.057 12.852 19.104 1.00 13.56 C ATOM 2274 CD ARG A 791 2.336 14.219 18.468 1.00 13.25 C ATOM 2275 NE ARG A 791 3.437 14.150 17.517 1.00 16.61 N ATOM 2276 CZ ARG A 791 3.979 15.212 16.924 1.00 20.65 C ATOM 2277 NH1 ARG A 791 3.511 16.427 17.175 1.00 18.46 N ATOM 2278 NH2 ARG A 791 4.987 15.055 16.075 1.00 20.74 N ATOM 2279 HE ARG A 791 3.824 13.213 17.287 1.00 0.00 H ATOM 2280 HH12 ARG A 791 3.936 17.254 16.710 1.00 0.00 H ATOM 2281 HH11 ARG A 791 2.718 16.553 17.837 1.00 0.00 H ATOM 2282 HH22 ARG A 791 5.411 15.884 15.612 1.00 0.00 H ATOM 2283 HH21 ARG A 791 5.353 14.103 15.873 1.00 0.00 H ATOM 2284 H ARG A 791 -0.098 13.063 22.514 1.00 0.00 H ATOM 2285 N PRO A 792 2.214 9.805 20.792 1.00 13.56 N ATOM 2286 CA PRO A 792 3.480 9.094 21.022 1.00 16.42 C ATOM 2287 C PRO A 792 4.648 9.921 20.500 1.00 17.94 C ATOM 2288 O PRO A 792 4.484 10.639 19.514 1.00 19.43 O ATOM 2289 CB PRO A 792 3.309 7.799 20.230 1.00 14.79 C ATOM 2290 CG PRO A 792 1.826 7.617 20.121 1.00 15.31 C ATOM 2291 CD PRO A 792 1.247 8.997 20.032 1.00 11.38 C ATOM 2292 N ARG A 793 5.806 9.843 21.152 1.00 28.51 N ATOM 2293 CA ARG A 793 6.928 10.693 20.762 1.00 30.58 C ATOM 2294 C ARG A 793 7.389 10.409 19.333 1.00 23.46 C ATOM 2295 O ARG A 793 7.766 11.334 18.611 1.00 29.67 O ATOM 2296 CB ARG A 793 8.108 10.535 21.729 1.00 36.22 C ATOM 2297 CG ARG A 793 9.276 11.458 21.386 1.00 46.65 C ATOM 2298 CD ARG A 793 10.416 11.409 22.396 1.00 52.12 C ATOM 2299 NE ARG A 793 11.484 12.324 21.994 1.00 64.47 N ATOM 2300 CZ ARG A 793 12.534 12.649 22.743 1.00 70.86 C ATOM 2301 NH1 ARG A 793 13.446 13.493 22.276 1.00 72.19 N ATOM 2302 NH2 ARG A 793 12.676 12.137 23.958 1.00 67.99 N ATOM 2303 HE ARG A 793 11.417 12.754 21.049 1.00 0.00 H ATOM 2304 HH12 ARG A 793 14.267 13.747 22.861 1.00 0.00 H ATOM 2305 HH11 ARG A 793 13.339 13.900 21.325 1.00 0.00 H ATOM 2306 HH22 ARG A 793 13.499 12.395 24.538 1.00 0.00 H ATOM 2307 HH21 ARG A 793 11.964 11.477 24.331 1.00 0.00 H ATOM 2308 H ARG A 793 5.912 9.175 21.942 1.00 0.00 H ATOM 2309 N VAL A 794 7.324 9.144 18.918 1.00 22.79 N ATOM 2310 CA VAL A 794 7.748 8.761 17.567 1.00 32.03 C ATOM 2311 C VAL A 794 6.628 8.870 16.529 1.00 32.40 C ATOM 2312 O VAL A 794 6.772 8.427 15.385 1.00 34.15 O ATOM 2313 CB VAL A 794 8.296 7.320 17.534 1.00 35.46 C ATOM 2314 CG1 VAL A 794 9.345 7.126 18.616 1.00 36.70 C ATOM 2315 CG2 VAL A 794 7.166 6.309 17.691 1.00 39.38 C ATOM 2316 H VAL A 794 6.965 8.413 19.565 1.00 0.00 H ATOM 2317 N CYS A 795 5.511 9.464 16.925 1.00 20.42 N ATOM 2318 CA CYS A 795 4.389 9.641 16.013 1.00 16.44 C ATOM 2319 C CYS A 795 4.482 10.986 15.302 1.00 17.99 C ATOM 2320 O CYS A 795 4.551 12.020 15.958 1.00 19.05 O ATOM 2321 CB CYS A 795 3.072 9.531 16.785 1.00 18.71 C ATOM 2322 SG CYS A 795 1.606 9.733 15.778 1.00 18.09 S ATOM 2323 H CYS A 795 5.434 9.809 17.903 1.00 0.00 H ATOM 2324 N PRO A 796 4.507 10.979 13.955 1.00 15.13 N ATOM 2325 CA PRO A 796 4.498 12.254 13.227 1.00 16.47 C ATOM 2326 C PRO A 796 3.232 13.062 13.530 1.00 16.38 C ATOM 2327 O PRO A 796 2.175 12.483 13.809 1.00 14.23 O ATOM 2328 CB PRO A 796 4.541 11.825 11.754 1.00 20.33 C ATOM 2329 CG PRO A 796 5.094 10.430 11.772 1.00 20.25 C ATOM 2330 CD PRO A 796 4.592 9.820 13.048 1.00 17.25 C ATOM 2331 N LYS A 797 3.335 14.387 13.490 1.00 12.58 N ATOM 2332 CA LYS A 797 2.184 15.225 13.792 1.00 11.69 C ATOM 2333 C LYS A 797 1.004 14.907 12.892 1.00 11.56 C ATOM 2334 O LYS A 797 -0.149 14.926 13.339 1.00 15.13 O ATOM 2335 CB LYS A 797 2.526 16.717 13.670 1.00 19.94 C ATOM 2336 CG LYS A 797 1.310 17.601 13.991 1.00 31.75 C ATOM 2337 CD LYS A 797 1.586 19.086 13.881 1.00 42.38 C ATOM 2338 CE LYS A 797 0.326 19.836 13.453 1.00 41.27 C ATOM 2339 NZ LYS A 797 -0.878 19.488 14.248 1.00 39.46 N ATOM 2340 HZ1 LYS A 797 -1.075 18.472 14.150 1.00 0.00 H ATOM 2341 HZ2 LYS A 797 -0.708 19.714 15.249 1.00 0.00 H ATOM 2342 HZ3 LYS A 797 -1.691 20.035 13.901 1.00 0.00 H ATOM 2343 H LYS A 797 4.244 14.827 13.241 1.00 0.00 H ATOM 2344 N GLU A 798 1.281 14.600 11.627 1.00 11.07 N ATOM 2345 CA GLU A 798 0.200 14.321 10.684 1.00 13.95 C ATOM 2346 C GLU A 798 -0.581 13.086 11.050 1.00 10.55 C ATOM 2347 O GLU A 798 -1.798 13.045 10.851 1.00 12.69 O ATOM 2348 CB GLU A 798 0.730 14.176 9.254 1.00 20.49 C ATOM 2349 CG GLU A 798 2.215 13.889 9.148 1.00 38.95 C ATOM 2350 CD GLU A 798 3.063 15.124 9.404 1.00 26.50 C ATOM 2351 OE1 GLU A 798 2.906 16.129 8.680 1.00 42.10 O ATOM 2352 OE2 GLU A 798 3.861 15.092 10.357 1.00 30.67 O ATOM 2353 H GLU A 798 2.270 14.559 11.308 1.00 0.00 H ATOM 2354 N VAL A 799 0.111 12.076 11.575 1.00 9.71 N ATOM 2355 CA VAL A 799 -0.555 10.848 12.013 1.00 8.21 C ATOM 2356 C VAL A 799 -1.367 11.102 13.278 1.00 10.06 C ATOM 2357 O VAL A 799 -2.481 10.617 13.412 1.00 9.97 O ATOM 2358 CB VAL A 799 0.458 9.710 12.268 1.00 13.25 C ATOM 2359 CG1 VAL A 799 -0.262 8.486 12.788 1.00 13.64 C ATOM 2360 CG2 VAL A 799 1.234 9.365 10.978 1.00 13.84 C ATOM 2361 H VAL A 799 1.143 12.161 11.676 1.00 0.00 H ATOM 2362 N TYR A 800 -0.815 11.876 14.209 1.00 8.64 N ATOM 2363 CA TYR A 800 -1.584 12.239 15.393 1.00 9.16 C ATOM 2364 C TYR A 800 -2.822 13.055 15.021 1.00 8.43 C ATOM 2365 O TYR A 800 -3.878 12.916 15.637 1.00 9.80 O ATOM 2366 CB TYR A 800 -0.721 13.022 16.392 1.00 9.14 C ATOM 2367 CG TYR A 800 -1.408 13.179 17.733 1.00 9.74 C ATOM 2368 CD1 TYR A 800 -1.721 12.063 18.502 1.00 11.67 C ATOM 2369 CD2 TYR A 800 -1.761 14.426 18.215 1.00 12.88 C ATOM 2370 CE1 TYR A 800 -2.358 12.187 19.724 1.00 11.12 C ATOM 2371 CE2 TYR A 800 -2.392 14.564 19.441 1.00 11.53 C ATOM 2372 CZ TYR A 800 -2.678 13.435 20.192 1.00 9.79 C ATOM 2373 OH TYR A 800 -3.319 13.548 21.411 1.00 12.12 O ATOM 2374 HH TYR A 800 -3.440 12.647 21.804 1.00 0.00 H ATOM 2375 H TYR A 800 0.160 12.220 14.093 1.00 0.00 H ATOM 2376 N ASP A 801 -2.707 13.899 14.005 1.00 10.10 N ATOM 2377 CA ASP A 801 -3.865 14.675 13.562 1.00 10.38 C ATOM 2378 C ASP A 801 -4.972 13.769 13.013 1.00 9.40 C ATOM 2379 O ASP A 801 -6.149 14.081 13.142 1.00 11.13 O ATOM 2380 CB ASP A 801 -3.451 15.718 12.521 1.00 13.35 C ATOM 2381 CG ASP A 801 -2.754 16.922 13.150 1.00 24.83 C ATOM 2382 OD1 ASP A 801 -2.929 17.155 14.365 1.00 25.49 O ATOM 2383 OD2 ASP A 801 -2.028 17.636 12.428 1.00 22.55 O ATOM 2384 H ASP A 801 -1.792 14.009 13.522 1.00 0.00 H ATOM 2385 N VAL A 802 -4.599 12.641 12.415 1.00 9.71 N ATOM 2386 CA VAL A 802 -5.593 11.655 12.006 1.00 5.97 C ATOM 2387 C VAL A 802 -6.261 11.044 13.243 1.00 7.37 C ATOM 2388 O VAL A 802 -7.476 10.926 13.281 1.00 8.94 O ATOM 2389 CB VAL A 802 -4.977 10.548 11.132 1.00 8.70 C ATOM 2390 CG1 VAL A 802 -6.019 9.460 10.821 1.00 10.27 C ATOM 2391 CG2 VAL A 802 -4.458 11.143 9.823 1.00 9.12 C ATOM 2392 H VAL A 802 -3.590 12.461 12.238 1.00 0.00 H ATOM 2393 N MET A 803 -5.484 10.695 14.266 1.00 9.25 N ATOM 2394 CA MET A 803 -6.075 10.202 15.513 1.00 10.02 C ATOM 2395 C MET A 803 -7.074 11.202 16.094 1.00 7.73 C ATOM 2396 O MET A 803 -8.170 10.834 16.491 1.00 8.72 O ATOM 2397 CB MET A 803 -4.993 9.903 16.565 1.00 7.56 C ATOM 2398 CG MET A 803 -3.985 8.849 16.179 1.00 10.27 C ATOM 2399 SD MET A 803 -2.832 8.566 17.560 1.00 14.76 S ATOM 2400 CE MET A 803 -1.451 7.875 16.661 1.00 15.21 C ATOM 2401 H MET A 803 -4.451 10.773 14.180 1.00 0.00 H ATOM 2402 N LEU A 804 -6.693 12.477 16.149 1.00 10.88 N ATOM 2403 CA LEU A 804 -7.606 13.497 16.665 1.00 9.66 C ATOM 2404 C LEU A 804 -8.862 13.603 15.802 1.00 9.98 C ATOM 2405 O LEU A 804 -9.950 13.863 16.313 1.00 9.51 O ATOM 2406 CB LEU A 804 -6.907 14.857 16.746 1.00 9.13 C ATOM 2407 CG LEU A 804 -5.714 14.949 17.691 1.00 11.20 C ATOM 2408 CD1 LEU A 804 -5.069 16.325 17.588 1.00 13.96 C ATOM 2409 CD2 LEU A 804 -6.148 14.672 19.124 1.00 15.86 C ATOM 2410 H LEU A 804 -5.743 12.748 15.824 1.00 0.00 H ATOM 2411 N GLY A 805 -8.704 13.414 14.495 1.00 7.61 N ATOM 2412 CA GLY A 805 -9.845 13.385 13.595 1.00 7.37 C ATOM 2413 C GLY A 805 -10.795 12.233 13.890 1.00 7.03 C ATOM 2414 O GLY A 805 -12.002 12.335 13.644 1.00 10.30 O ATOM 2415 H GLY A 805 -7.747 13.285 14.110 1.00 0.00 H ATOM 2416 N CYS A 806 -10.255 11.132 14.417 1.00 9.07 N ATOM 2417 CA CYS A 806 -11.073 9.992 14.845 1.00 8.12 C ATOM 2418 C CYS A 806 -11.741 10.217 16.190 1.00 7.81 C ATOM 2419 O CYS A 806 -12.705 9.523 16.540 1.00 8.33 O ATOM 2420 CB CYS A 806 -10.223 8.714 14.946 1.00 5.96 C ATOM 2421 SG CYS A 806 -9.493 8.173 13.377 1.00 9.47 S ATOM 2422 H CYS A 806 -9.222 11.081 14.528 1.00 0.00 H ATOM 2423 N TRP A 807 -11.206 11.156 16.965 1.00 10.51 N ATOM 2424 CA TRP A 807 -11.595 11.285 18.373 1.00 7.86 C ATOM 2425 C TRP A 807 -12.396 12.544 18.675 1.00 10.92 C ATOM 2426 O TRP A 807 -12.459 12.995 19.820 1.00 13.33 O ATOM 2427 CB TRP A 807 -10.361 11.247 19.269 1.00 8.99 C ATOM 2428 CG TRP A 807 -9.616 9.939 19.230 1.00 6.12 C ATOM 2429 CD1 TRP A 807 -10.117 8.709 18.884 1.00 7.77 C ATOM 2430 CD2 TRP A 807 -8.236 9.740 19.541 1.00 7.01 C ATOM 2431 NE1 TRP A 807 -9.126 7.761 18.967 1.00 5.71 N ATOM 2432 CE2 TRP A 807 -7.961 8.370 19.362 1.00 6.40 C ATOM 2433 CE3 TRP A 807 -7.198 10.594 19.944 1.00 8.20 C ATOM 2434 CZ2 TRP A 807 -6.695 7.828 19.580 1.00 8.65 C ATOM 2435 CZ3 TRP A 807 -5.937 10.051 20.163 1.00 9.83 C ATOM 2436 CH2 TRP A 807 -5.701 8.678 19.991 1.00 9.40 C ATOM 2437 HE1 TRP A 807 -9.240 6.747 18.764 1.00 0.00 H ATOM 2438 H TRP A 807 -10.501 11.809 16.567 1.00 0.00 H ATOM 2439 N GLN A 808 -13.015 13.111 17.649 1.00 10.04 N ATOM 2440 CA GLN A 808 -14.003 14.160 17.881 1.00 10.14 C ATOM 2441 C GLN A 808 -15.091 13.648 18.816 1.00 11.90 C ATOM 2442 O GLN A 808 -15.569 12.517 18.671 1.00 11.35 O ATOM 2443 CB GLN A 808 -14.614 14.615 16.561 1.00 13.36 C ATOM 2444 CG GLN A 808 -13.587 15.108 15.571 1.00 14.39 C ATOM 2445 CD GLN A 808 -12.973 16.405 16.017 1.00 24.16 C ATOM 2446 OE1 GLN A 808 -13.666 17.410 16.144 1.00 26.26 O ATOM 2447 NE2 GLN A 808 -11.674 16.392 16.272 1.00 20.19 N ATOM 2448 HE22 GLN A 808 -11.129 15.515 16.149 1.00 0.00 H ATOM 2449 HE21 GLN A 808 -11.199 17.259 16.595 1.00 0.00 H ATOM 2450 H GLN A 808 -12.797 12.808 16.678 1.00 0.00 H ATOM 2451 N ARG A 809 -15.488 14.474 19.780 1.00 12.41 N ATOM 2452 CA ARG A 809 -16.511 14.050 20.730 1.00 12.60 C ATOM 2453 C ARG A 809 -17.838 13.816 20.015 1.00 15.28 C ATOM 2454 O ARG A 809 -18.502 12.802 20.242 1.00 15.95 O ATOM 2455 CB ARG A 809 -16.674 15.070 21.861 1.00 19.25 C ATOM 2456 CG ARG A 809 -17.633 14.593 22.940 1.00 22.81 C ATOM 2457 CD ARG A 809 -17.417 15.297 24.278 1.00 37.45 C ATOM 2458 NE ARG A 809 -18.208 14.672 25.337 1.00 38.26 N ATOM 2459 CZ ARG A 809 -17.738 13.787 26.212 1.00 35.87 C ATOM 2460 NH1 ARG A 809 -18.543 13.268 27.135 1.00 34.69 N ATOM 2461 NH2 ARG A 809 -16.463 13.422 26.177 1.00 31.03 N ATOM 2462 HE ARG A 809 -19.210 14.939 25.412 1.00 0.00 H ATOM 2463 HH12 ARG A 809 -18.173 12.576 27.818 1.00 0.00 H ATOM 2464 HH11 ARG A 809 -19.542 13.554 27.174 1.00 0.00 H ATOM 2465 HH22 ARG A 809 -16.101 12.730 26.864 1.00 0.00 H ATOM 2466 HH21 ARG A 809 -15.825 13.828 25.463 1.00 0.00 H ATOM 2467 H ARG A 809 -15.069 15.423 19.857 1.00 0.00 H ATOM 2468 N GLU A 810 -18.222 14.739 19.138 1.00 13.40 N ATOM 2469 CA GLU A 810 -19.426 14.552 18.323 1.00 13.07 C ATOM 2470 C GLU A 810 -19.164 13.522 17.232 1.00 10.88 C ATOM 2471 O GLU A 810 -18.306 13.750 16.381 1.00 12.23 O ATOM 2472 CB GLU A 810 -19.856 15.872 17.675 1.00 15.53 C ATOM 2473 CG GLU A 810 -20.125 17.015 18.647 1.00 31.43 C ATOM 2474 CD GLU A 810 -21.460 16.887 19.345 1.00 41.97 C ATOM 2475 OE1 GLU A 810 -22.323 16.131 18.848 1.00 41.70 O ATOM 2476 OE2 GLU A 810 -21.643 17.543 20.392 1.00 44.22 O ATOM 2477 H GLU A 810 -17.659 15.607 19.029 1.00 0.00 H ATOM 2478 N PRO A 811 -19.907 12.402 17.228 1.00 12.89 N ATOM 2479 CA PRO A 811 -19.578 11.345 16.261 1.00 10.09 C ATOM 2480 C PRO A 811 -19.661 11.803 14.811 1.00 10.45 C ATOM 2481 O PRO A 811 -18.883 11.325 13.989 1.00 9.96 O ATOM 2482 CB PRO A 811 -20.629 10.263 16.551 1.00 12.49 C ATOM 2483 CG PRO A 811 -20.989 10.485 17.993 1.00 17.12 C ATOM 2484 CD PRO A 811 -20.935 11.971 18.195 1.00 15.09 C ATOM 2485 N GLN A 812 -20.558 12.737 14.496 1.00 12.15 N ATOM 2486 CA GLN A 812 -20.720 13.134 13.102 1.00 15.49 C ATOM 2487 C GLN A 812 -19.584 14.025 12.627 1.00 12.25 C ATOM 2488 O GLN A 812 -19.449 14.260 11.430 1.00 16.50 O ATOM 2489 CB GLN A 812 -22.063 13.843 12.875 1.00 21.96 C ATOM 2490 CG GLN A 812 -23.279 12.936 13.088 1.00 35.90 C ATOM 2491 CD GLN A 812 -23.146 11.579 12.398 1.00 47.47 C ATOM 2492 OE1 GLN A 812 -23.141 10.533 13.054 1.00 45.18 O ATOM 2493 NE2 GLN A 812 -23.049 11.593 11.073 1.00 49.45 N ATOM 2494 HE22 GLN A 812 -23.057 12.498 10.561 1.00 0.00 H ATOM 2495 HE21 GLN A 812 -22.965 10.699 10.548 1.00 0.00 H ATOM 2496 H GLN A 812 -21.138 13.179 15.238 1.00 0.00 H ATOM 2497 N GLN A 813 -18.757 14.504 13.553 1.00 11.22 N ATOM 2498 CA GLN A 813 -17.612 15.335 13.178 1.00 13.92 C ATOM 2499 C GLN A 813 -16.358 14.517 12.936 1.00 9.69 C ATOM 2500 O GLN A 813 -15.368 15.027 12.416 1.00 12.28 O ATOM 2501 CB GLN A 813 -17.334 16.387 14.251 1.00 11.70 C ATOM 2502 CG GLN A 813 -18.385 17.436 14.255 1.00 19.83 C ATOM 2503 CD GLN A 813 -18.199 18.411 15.358 1.00 21.11 C ATOM 2504 OE1 GLN A 813 -17.108 18.549 15.914 1.00 24.88 O ATOM 2505 NE2 GLN A 813 -19.273 19.083 15.712 1.00 24.40 N ATOM 2506 HE22 GLN A 813 -20.171 18.930 15.210 1.00 0.00 H ATOM 2507 HE21 GLN A 813 -19.224 19.767 16.494 1.00 0.00 H ATOM 2508 H GLN A 813 -18.926 14.285 14.556 1.00 0.00 H ATOM 2509 N ARG A 814 -16.390 13.247 13.314 1.00 10.50 N ATOM 2510 CA ARG A 814 -15.229 12.391 13.091 1.00 6.69 C ATOM 2511 C ARG A 814 -14.991 12.196 11.600 1.00 9.10 C ATOM 2512 O ARG A 814 -15.942 12.202 10.815 1.00 10.74 O ATOM 2513 CB ARG A 814 -15.422 11.034 13.766 1.00 5.55 C ATOM 2514 CG ARG A 814 -15.417 11.132 15.255 1.00 6.84 C ATOM 2515 CD ARG A 814 -15.868 9.850 15.936 1.00 5.42 C ATOM 2516 NE ARG A 814 -16.278 10.215 17.280 1.00 8.86 N ATOM 2517 CZ ARG A 814 -17.029 9.471 18.077 1.00 9.26 C ATOM 2518 NH1 ARG A 814 -17.431 8.260 17.703 1.00 8.61 N ATOM 2519 NH2 ARG A 814 -17.359 9.954 19.265 1.00 10.04 N ATOM 2520 HE ARG A 814 -15.956 11.134 17.646 1.00 0.00 H ATOM 2521 HH12 ARG A 814 -18.021 7.688 18.341 1.00 0.00 H ATOM 2522 HH11 ARG A 814 -17.156 7.885 16.773 1.00 0.00 H ATOM 2523 HH22 ARG A 814 -17.948 9.390 19.910 1.00 0.00 H ATOM 2524 HH21 ARG A 814 -17.029 10.897 19.553 1.00 0.00 H ATOM 2525 H ARG A 814 -17.242 12.861 13.769 1.00 0.00 H ATOM 2526 N LEU A 815 -13.726 12.026 11.214 1.00 9.83 N ATOM 2527 CA LEU A 815 -13.394 11.576 9.867 1.00 9.04 C ATOM 2528 C LEU A 815 -14.140 10.287 9.588 1.00 9.89 C ATOM 2529 O LEU A 815 -14.350 9.499 10.504 1.00 11.80 O ATOM 2530 CB LEU A 815 -11.887 11.338 9.722 1.00 8.18 C ATOM 2531 CG LEU A 815 -10.973 12.546 9.924 1.00 13.16 C ATOM 2532 CD1 LEU A 815 -9.520 12.095 10.083 1.00 12.70 C ATOM 2533 CD2 LEU A 815 -11.125 13.501 8.754 1.00 13.82 C ATOM 2534 H LEU A 815 -12.959 12.219 11.889 1.00 0.00 H ATOM 2535 N ASN A 816 -14.564 10.059 8.348 1.00 8.79 N ATOM 2536 CA ASN A 816 -15.104 8.746 8.053 1.00 10.48 C ATOM 2537 C ASN A 816 -13.946 7.907 7.536 1.00 8.44 C ATOM 2538 O ASN A 816 -12.863 8.432 7.242 1.00 9.51 O ATOM 2539 CB ASN A 816 -16.297 8.792 7.081 1.00 15.85 C ATOM 2540 CG ASN A 816 -15.919 9.226 5.682 1.00 18.90 C ATOM 2541 OD1 ASN A 816 -15.021 8.673 5.061 1.00 17.71 O ATOM 2542 ND2 ASN A 816 -16.631 10.219 5.167 1.00 23.80 N ATOM 2543 HD22 ASN A 816 -17.386 10.663 5.728 1.00 0.00 H ATOM 2544 HD21 ASN A 816 -16.434 10.554 4.202 1.00 0.00 H ATOM 2545 H ASN A 816 -14.510 10.796 7.616 1.00 0.00 H ATOM 2546 N ILE A 817 -14.136 6.598 7.498 1.00 7.39 N ATOM 2547 CA ILE A 817 -12.997 5.717 7.292 1.00 7.23 C ATOM 2548 C ILE A 817 -12.471 5.815 5.845 1.00 8.53 C ATOM 2549 O ILE A 817 -11.292 5.555 5.583 1.00 8.56 O ATOM 2550 CB ILE A 817 -13.368 4.252 7.677 1.00 8.34 C ATOM 2551 CG1 ILE A 817 -12.110 3.384 7.752 1.00 9.98 C ATOM 2552 CG2 ILE A 817 -14.416 3.669 6.726 1.00 10.90 C ATOM 2553 CD1 ILE A 817 -11.110 3.881 8.747 1.00 11.88 C ATOM 2554 H ILE A 817 -15.091 6.203 7.614 1.00 0.00 H ATOM 2555 N LYS A 818 -13.326 6.219 4.909 1.00 8.92 N ATOM 2556 CA LYS A 818 -12.867 6.431 3.537 1.00 11.08 C ATOM 2557 C LYS A 818 -11.909 7.613 3.467 1.00 10.83 C ATOM 2558 O LYS A 818 -10.909 7.563 2.756 1.00 9.40 O ATOM 2559 CB LYS A 818 -14.049 6.665 2.593 1.00 13.61 C ATOM 2560 CG LYS A 818 -15.010 5.504 2.521 1.00 20.17 C ATOM 2561 CD LYS A 818 -16.279 5.886 1.758 1.00 33.74 C ATOM 2562 CE LYS A 818 -17.157 6.831 2.578 1.00 43.15 C ATOM 2563 NZ LYS A 818 -18.440 7.148 1.882 1.00 51.50 N ATOM 2564 HZ1 LYS A 818 -18.235 7.604 0.970 1.00 0.00 H ATOM 2565 HZ2 LYS A 818 -18.971 6.269 1.720 1.00 0.00 H ATOM 2566 HZ3 LYS A 818 -19.004 7.791 2.473 1.00 0.00 H ATOM 2567 H LYS A 818 -14.323 6.384 5.154 1.00 0.00 H ATOM 2568 N GLU A 819 -12.233 8.671 4.214 1.00 9.09 N ATOM 2569 CA GLU A 819 -11.383 9.847 4.315 1.00 11.32 C ATOM 2570 C GLU A 819 -10.058 9.464 4.957 1.00 9.32 C ATOM 2571 O GLU A 819 -8.994 9.862 4.498 1.00 9.45 O ATOM 2572 CB GLU A 819 -12.083 10.950 5.128 1.00 15.10 C ATOM 2573 CG GLU A 819 -13.349 11.495 4.447 1.00 21.41 C ATOM 2574 CD GLU A 819 -14.149 12.473 5.316 1.00 29.27 C ATOM 2575 OE1 GLU A 819 -14.086 12.388 6.562 1.00 16.68 O ATOM 2576 OE2 GLU A 819 -14.852 13.334 4.741 1.00 28.95 O ATOM 2577 H GLU A 819 -13.128 8.654 4.744 1.00 0.00 H ATOM 2578 N ILE A 820 -10.131 8.673 6.018 1.00 7.88 N ATOM 2579 CA ILE A 820 -8.927 8.230 6.722 1.00 6.28 C ATOM 2580 C ILE A 820 -8.018 7.413 5.799 1.00 7.48 C ATOM 2581 O ILE A 820 -6.803 7.625 5.745 1.00 8.83 O ATOM 2582 CB ILE A 820 -9.312 7.411 7.965 1.00 7.91 C ATOM 2583 CG1 ILE A 820 -9.924 8.340 9.014 1.00 9.45 C ATOM 2584 CG2 ILE A 820 -8.106 6.698 8.540 1.00 9.92 C ATOM 2585 CD1 ILE A 820 -10.761 7.605 10.066 1.00 11.20 C ATOM 2586 H ILE A 820 -11.063 8.361 6.357 1.00 0.00 H ATOM 2587 N TYR A 821 -8.615 6.494 5.051 1.00 7.16 N ATOM 2588 CA TYR A 821 -7.854 5.691 4.106 1.00 7.16 C ATOM 2589 C TYR A 821 -7.098 6.570 3.110 1.00 10.84 C ATOM 2590 O TYR A 821 -5.907 6.353 2.868 1.00 11.00 O ATOM 2591 CB TYR A 821 -8.776 4.724 3.366 1.00 9.97 C ATOM 2592 CG TYR A 821 -8.023 3.796 2.449 1.00 10.83 C ATOM 2593 CD1 TYR A 821 -7.336 2.701 2.956 1.00 11.15 C ATOM 2594 CD2 TYR A 821 -7.978 4.026 1.085 1.00 18.68 C ATOM 2595 CE1 TYR A 821 -6.637 1.849 2.129 1.00 15.55 C ATOM 2596 CE2 TYR A 821 -7.276 3.177 0.245 1.00 28.98 C ATOM 2597 CZ TYR A 821 -6.611 2.092 0.776 1.00 26.12 C ATOM 2598 OH TYR A 821 -5.913 1.245 -0.049 1.00 33.47 O ATOM 2599 HH TYR A 821 -5.500 0.526 0.492 1.00 0.00 H ATOM 2600 H TYR A 821 -9.640 6.346 5.141 1.00 0.00 H ATOM 2601 N LYS A 822 -7.785 7.561 2.537 1.00 8.64 N ATOM 2602 CA LYS A 822 -7.159 8.460 1.568 1.00 12.55 C ATOM 2603 C LYS A 822 -6.005 9.225 2.193 1.00 11.18 C ATOM 2604 O LYS A 822 -4.960 9.399 1.574 1.00 11.31 O ATOM 2605 CB LYS A 822 -8.184 9.447 0.993 1.00 14.56 C ATOM 2606 CG LYS A 822 -9.045 8.852 -0.100 1.00 34.31 C ATOM 2607 CD LYS A 822 -9.940 9.903 -0.732 1.00 47.70 C ATOM 2608 CE LYS A 822 -10.570 9.382 -2.019 1.00 57.08 C ATOM 2609 NZ LYS A 822 -9.530 8.987 -3.017 1.00 63.08 N ATOM 2610 HZ1 LYS A 822 -8.942 9.813 -3.249 1.00 0.00 H ATOM 2611 HZ2 LYS A 822 -8.933 8.237 -2.615 1.00 0.00 H ATOM 2612 HZ3 LYS A 822 -9.994 8.638 -3.880 1.00 0.00 H ATOM 2613 H LYS A 822 -8.786 7.697 2.785 1.00 0.00 H ATOM 2614 N ILE A 823 -6.189 9.680 3.427 1.00 9.15 N ATOM 2615 CA ILE A 823 -5.148 10.452 4.101 1.00 8.84 C ATOM 2616 C ILE A 823 -3.916 9.606 4.380 1.00 10.63 C ATOM 2617 O ILE A 823 -2.783 10.012 4.079 1.00 11.18 O ATOM 2618 CB ILE A 823 -5.669 11.048 5.416 1.00 11.52 C ATOM 2619 CG1 ILE A 823 -6.711 12.128 5.125 1.00 11.96 C ATOM 2620 CG2 ILE A 823 -4.506 11.625 6.218 1.00 10.73 C ATOM 2621 CD1 ILE A 823 -7.561 12.511 6.337 1.00 12.67 C ATOM 2622 H ILE A 823 -7.084 9.485 3.919 1.00 0.00 H ATOM 2623 N LEU A 824 -4.134 8.423 4.947 1.00 8.96 N ATOM 2624 CA LEU A 824 -3.016 7.524 5.252 1.00 7.15 C ATOM 2625 C LEU A 824 -2.213 7.209 4.006 1.00 17.81 C ATOM 2626 O LEU A 824 -1.015 7.088 4.038 1.00 14.83 O ATOM 2627 CB LEU A 824 -3.519 6.227 5.879 1.00 8.96 C ATOM 2628 CG LEU A 824 -4.087 6.387 7.271 1.00 9.75 C ATOM 2629 CD1 LEU A 824 -4.707 5.062 7.676 1.00 11.70 C ATOM 2630 CD2 LEU A 824 -2.977 6.800 8.214 1.00 16.91 C ATOM 2631 H LEU A 824 -5.106 8.133 5.176 1.00 0.00 H ATOM 2632 N HIS A 825 -2.911 7.079 2.900 1.00 16.08 N ATOM 2633 CA HIS A 825 -2.316 6.786 1.621 1.00 15.61 C ATOM 2634 C HIS A 825 -1.541 7.996 1.105 1.00 16.68 C ATOM 2635 O HIS A 825 -0.402 7.839 0.634 1.00 20.45 O ATOM 2636 CB HIS A 825 -3.452 6.231 0.772 1.00 26.53 C ATOM 2637 CG HIS A 825 -3.017 5.416 -0.401 1.00 47.99 C ATOM 2638 ND1 HIS A 825 -1.730 4.954 -0.583 1.00 59.66 N ATOM 2639 CD2 HIS A 825 -3.762 4.742 -1.302 1.00 56.78 C ATOM 2640 CE1 HIS A 825 -1.679 4.202 -1.666 1.00 54.97 C ATOM 2641 NE2 HIS A 825 -2.906 4.026 -2.101 1.00 57.08 N ATOM 2642 H HIS A 825 -3.943 7.193 2.951 1.00 0.00 H ATOM 2643 N ALA A 826 -2.041 9.203 1.326 1.00 17.63 N ATOM 2644 CA ALA A 826 -1.265 10.390 0.955 1.00 19.79 C ATOM 2645 C ALA A 826 -0.071 10.629 1.879 1.00 25.73 C ATOM 2646 O ALA A 826 0.915 11.245 1.467 1.00 27.35 O ATOM 2647 CB ALA A 826 -2.158 11.621 0.939 1.00 21.21 C ATOM 2648 H ALA A 826 -2.980 9.308 1.761 1.00 0.00 H ATOM 2649 N LEU A 827 -0.154 10.145 3.119 1.00 16.68 N ATOM 2650 CA LEU A 827 0.906 10.388 4.099 1.00 16.78 C ATOM 2651 C LEU A 827 2.167 9.579 3.830 1.00 23.13 C ATOM 2652 O LEU A 827 3.264 9.994 4.192 1.00 25.19 O ATOM 2653 CB LEU A 827 0.415 10.088 5.516 1.00 19.76 C ATOM 2654 CG LEU A 827 -0.464 11.165 6.144 1.00 19.89 C ATOM 2655 CD1 LEU A 827 -0.725 10.840 7.606 1.00 16.50 C ATOM 2656 CD2 LEU A 827 0.189 12.529 5.989 1.00 27.75 C ATOM 2657 H LEU A 827 -0.986 9.585 3.394 1.00 0.00 H ATOM 2658 N GLY A 828 2.011 8.420 3.209 1.00 21.11 N ATOM 2659 CA GLY A 828 3.154 7.588 2.897 1.00 26.54 C ATOM 2660 C GLY A 828 4.023 8.147 1.783 1.00 30.60 C ATOM 2661 O GLY A 828 3.523 8.561 0.734 1.00 31.02 O ATOM 2662 H GLY A 828 1.057 8.104 2.942 1.00 0.00 H ATOM 2663 N LYS A 829 5.333 8.147 2.018 1.00 24.40 N ATOM 2664 CA LYS A 829 6.309 8.582 1.021 1.00 35.44 C ATOM 2665 C LYS A 829 6.337 7.622 -0.161 1.00 42.02 C ATOM 2666 O LYS A 829 6.431 8.036 -1.319 1.00 52.36 O ATOM 2667 CB LYS A 829 7.701 8.678 1.645 1.00 40.18 C ATOM 2668 CG LYS A 829 7.818 9.725 2.731 1.00 49.25 C ATOM 2669 CD LYS A 829 7.885 11.117 2.138 1.00 53.00 C ATOM 2670 CE LYS A 829 9.110 11.265 1.246 1.00 57.43 C ATOM 2671 NZ LYS A 829 10.361 10.855 1.946 1.00 59.65 N ATOM 2672 HZ1 LYS A 829 10.497 11.450 2.788 1.00 0.00 H ATOM 2673 HZ2 LYS A 829 10.285 9.858 2.233 1.00 0.00 H ATOM 2674 HZ3 LYS A 829 11.170 10.971 1.303 1.00 0.00 H ATOM 2675 H LYS A 829 5.675 7.825 2.946 1.00 0.00 H ATOM 2676 N ALA A 830 6.264 6.332 0.145 1.00 29.46 N ATOM 2677 CA ALA A 830 6.251 5.298 -0.879 1.00 25.55 C ATOM 2678 C ALA A 830 5.264 4.210 -0.503 1.00 18.27 C ATOM 2679 O ALA A 830 5.654 3.114 -0.098 1.00 21.55 O ATOM 2680 CB ALA A 830 7.644 4.713 -1.068 1.00 24.22 C ATOM 2681 H ALA A 830 6.215 6.052 1.146 1.00 0.00 H ATOM 2682 N THR A 831 3.979 4.523 -0.633 1.00 22.96 N ATOM 2683 CA THR A 831 2.936 3.563 -0.314 1.00 19.37 C ATOM 2684 C THR A 831 3.054 2.322 -1.182 1.00 17.64 C ATOM 2685 O THR A 831 3.199 2.434 -2.404 1.00 15.66 O ATOM 2686 CB THR A 831 1.544 4.145 -0.507 1.00 22.81 C ATOM 2687 OG1 THR A 831 1.497 5.473 0.033 1.00 28.95 O ATOM 2688 CG2 THR A 831 0.574 3.243 0.208 1.00 23.76 C ATOM 2689 HG1 THR A 831 2.159 6.042 -0.434 1.00 0.00 H ATOM 2690 H THR A 831 3.715 5.471 -0.969 1.00 0.00 H ATOM 2691 N PRO A 832 3.002 1.136 -0.560 1.00 16.90 N ATOM 2692 CA PRO A 832 3.045 -0.093 -1.359 1.00 14.81 C ATOM 2693 C PRO A 832 1.981 -0.109 -2.435 1.00 17.68 C ATOM 2694 O PRO A 832 0.906 0.501 -2.313 1.00 16.25 O ATOM 2695 CB PRO A 832 2.788 -1.197 -0.327 1.00 14.90 C ATOM 2696 CG PRO A 832 3.293 -0.614 0.951 1.00 18.92 C ATOM 2697 CD PRO A 832 2.992 0.849 0.889 1.00 15.54 C ATOM 2698 N ILE A 833 2.309 -0.795 -3.516 1.00 16.35 N ATOM 2699 CA ILE A 833 1.432 -0.881 -4.659 1.00 17.38 C ATOM 2700 C ILE A 833 0.643 -2.179 -4.594 1.00 18.06 C ATOM 2701 O ILE A 833 1.221 -3.245 -4.427 1.00 17.88 O ATOM 2702 CB ILE A 833 2.251 -0.807 -5.959 1.00 21.70 C ATOM 2703 CG1 ILE A 833 2.985 0.538 -6.011 1.00 26.03 C ATOM 2704 CG2 ILE A 833 1.358 -1.025 -7.166 1.00 26.66 C ATOM 2705 CD1 ILE A 833 3.932 0.680 -7.147 1.00 28.59 C ATOM 2706 H ILE A 833 3.225 -1.287 -3.544 1.00 0.00 H ATOM 2707 N TYR A 834 -0.674 -2.098 -4.733 1.00 18.28 N ATOM 2708 CA TYR A 834 -1.496 -3.298 -4.667 1.00 20.73 C ATOM 2709 C TYR A 834 -1.741 -3.887 -6.059 1.00 25.40 C ATOM 2710 O TYR A 834 -2.105 -3.165 -6.986 1.00 26.41 O ATOM 2711 CB TYR A 834 -2.826 -2.990 -3.976 1.00 19.76 C ATOM 2712 CG TYR A 834 -3.687 -4.216 -3.783 1.00 22.95 C ATOM 2713 CD1 TYR A 834 -3.397 -5.143 -2.790 1.00 29.15 C ATOM 2714 CD2 TYR A 834 -4.786 -4.450 -4.599 1.00 29.19 C ATOM 2715 CE1 TYR A 834 -4.179 -6.271 -2.616 1.00 32.68 C ATOM 2716 CE2 TYR A 834 -5.574 -5.574 -4.431 1.00 29.68 C ATOM 2717 CZ TYR A 834 -5.265 -6.478 -3.442 1.00 32.69 C ATOM 2718 OH TYR A 834 -6.046 -7.597 -3.273 1.00 33.87 O ATOM 2719 HH TYR A 834 -5.688 -8.138 -2.525 1.00 0.00 H ATOM 2720 H TYR A 834 -1.122 -1.172 -4.890 1.00 0.00 H ATOM 2721 N LEU A 835 -1.538 -5.194 -6.204 1.00 20.34 N ATOM 2722 CA LEU A 835 -1.763 -5.853 -7.490 1.00 21.45 C ATOM 2723 C LEU A 835 -2.732 -7.044 -7.412 1.00 37.43 C ATOM 2724 O LEU A 835 -2.965 -7.600 -6.338 1.00 37.03 O ATOM 2725 CB LEU A 835 -0.428 -6.318 -8.079 1.00 28.78 C ATOM 2726 CG LEU A 835 0.576 -5.204 -8.403 1.00 31.58 C ATOM 2727 CD1 LEU A 835 1.864 -5.797 -8.937 1.00 34.68 C ATOM 2728 CD2 LEU A 835 0.003 -4.198 -9.402 1.00 33.53 C ATOM 2729 H LEU A 835 -1.214 -5.755 -5.391 1.00 0.00 H ATOM 2730 N ASP A 836 -3.262 -7.434 -8.574 1.00 49.58 N ATOM 2731 CA ASP A 836 -4.217 -8.543 -8.715 1.00 54.38 C ATOM 2732 C ASP A 836 -3.784 -9.487 -9.868 1.00 63.26 C ATOM 2733 O ASP A 836 -4.335 -10.566 -10.124 1.00 64.58 O ATOM 2734 CB ASP A 836 -5.612 -7.973 -8.956 1.00 59.06 C ATOM 2735 CG ASP A 836 -6.702 -9.017 -8.834 1.00 71.48 C ATOM 2736 OD1 ASP A 836 -6.666 -10.081 -9.481 1.00 74.00 O ATOM 2737 OD2 ASP A 836 -7.621 -8.793 -8.034 1.00 74.22 O ATOM 2738 H ASP A 836 -2.981 -6.921 -9.434 1.00 0.00 H ATOM 2739 N ILE A 837 -2.733 -9.051 -10.539 1.00 68.88 N ATOM 2740 CA ILE A 837 -2.270 -9.626 -11.804 1.00 69.56 C ATOM 2741 C ILE A 837 -3.316 -9.610 -12.918 1.00 68.30 C ATOM 2742 O ILE A 837 -3.030 -9.104 -14.008 1.00 67.01 O ATOM 2743 CB ILE A 837 -1.764 -11.076 -11.642 1.00 72.33 C ATOM 2744 H ILE A 837 -2.201 -8.249 -10.144 1.00 0.00 H TER 2745 ILE A 837 HETATM 2746 O HOH 1 -19.895 -33.891 11.134 1.00 31.30 O HETATM 2747 O HOH 2 0.869 15.360 26.360 1.00 53.31 O HETATM 2748 O HOH 3 -23.187 -8.165 34.830 1.00 43.83 O HETATM 2749 O HOH 4 -6.099 -23.416 25.097 1.00 45.56 O HETATM 2750 O HOH 5 -10.567 9.680 25.702 1.00 31.66 O HETATM 2751 O HOH 6 11.105 -2.540 10.134 1.00 43.48 O HETATM 2752 O HOH 7 0.730 -28.832 -0.853 1.00 44.25 O HETATM 2753 O HOH 8 -9.577 -29.293 -4.668 1.00 43.18 O HETATM 2754 O HOH 9 -26.605 -14.885 4.819 1.00 40.79 O HETATM 2755 O HOH 10 -27.295 -27.841 14.520 1.00 43.25 O HETATM 2756 O HOH 11 -4.541 -2.415 32.391 1.00 26.98 O HETATM 2757 O HOH 12 -2.000 -13.853 21.017 1.00 55.24 O HETATM 2758 O HOH 13 -9.972 -8.209 30.375 1.00 28.45 O HETATM 2759 O HOH 14 14.618 -0.474 20.019 1.00 48.88 O HETATM 2760 O HOH 15 -22.847 -4.456 15.689 1.00 38.83 O HETATM 2761 O HOH 16 -17.445 -8.171 15.293 1.00 22.03 O HETATM 2762 O HOH 17 -3.316 -10.744 -0.324 1.00 41.09 O HETATM 2763 O HOH 18 15.845 13.823 22.547 1.00 46.99 O HETATM 2764 O HOH 19 -4.140 -10.007 -3.025 1.00 33.93 O HETATM 2765 O HOH 20 -14.947 -11.139 24.068 1.00 45.70 O HETATM 2766 O HOH 21 1.557 7.988 -0.922 1.00 18.48 O HETATM 2767 O HOH 22 -9.332 -10.768 21.019 1.00 20.41 O HETATM 2768 O HOH 23 -3.808 -20.388 30.472 1.00 33.42 O HETATM 2769 O HOH 24 1.782 -12.345 16.789 1.00 15.49 O HETATM 2770 O HOH 25 -9.741 12.254 34.004 1.00 43.79 O HETATM 2771 O HOH 26 -4.317 -6.049 23.438 1.00 15.46 O HETATM 2772 O HOH 27 -17.141 -4.510 36.534 1.00 46.37 O HETATM 2773 O HOH 28 -19.829 11.202 21.716 1.00 20.39 O HETATM 2774 O HOH 29 -18.981 -8.369 -0.420 1.00 24.71 O HETATM 2775 O HOH 30 -21.700 -35.872 13.305 1.00 34.06 O HETATM 2776 O HOH 31 -9.886 -20.349 31.991 1.00 41.44 O HETATM 2777 O HOH 32 -4.457 -21.222 5.105 1.00 14.94 O HETATM 2778 O HOH 33 -18.312 7.041 9.840 1.00 16.28 O HETATM 2779 O HOH 34 -9.702 -2.505 30.347 1.00 17.74 O HETATM 2780 O HOH 35 -0.336 -9.133 23.118 1.00 38.98 O HETATM 2781 O HOH 36 -5.890 -28.821 0.713 1.00 17.97 O HETATM 2782 O HOH 37 -15.203 -9.111 20.316 1.00 25.06 O HETATM 2783 O HOH 38 -21.681 -8.794 2.698 1.00 38.38 O HETATM 2784 O HOH 39 -10.321 -1.856 27.709 1.00 11.66 O HETATM 2785 O HOH 40 -7.330 -14.619 7.261 1.00 17.73 O HETATM 2786 O HOH 41 5.502 -2.506 23.089 1.00 19.11 O HETATM 2787 O HOH 42 -2.839 -2.387 22.994 1.00 11.12 O HETATM 2788 O HOH 43 -13.130 -19.325 21.102 1.00 38.24 O HETATM 2789 O HOH 44 0.079 -17.265 6.832 1.00 19.75 O HETATM 2790 O HOH 45 -3.706 19.553 15.150 1.00 30.30 O HETATM 2791 O HOH 46 -6.342 -16.980 24.184 1.00 38.49 O HETATM 2792 O HOH 47 -21.475 5.751 18.035 1.00 19.86 O HETATM 2793 O HOH 48 -17.856 0.461 17.673 1.00 8.52 O HETATM 2794 O HOH 49 5.944 1.167 23.526 1.00 36.12 O HETATM 2795 O HOH 50 -22.200 -21.356 26.229 1.00 37.65 O HETATM 2796 O HOH 51 -1.811 7.101 36.465 1.00 37.28 O HETATM 2797 O HOH 52 -14.205 -22.248 24.601 1.00 54.06 O HETATM 2798 O HOH 53 -1.639 0.315 -1.547 1.00 36.69 O HETATM 2799 O HOH 54 -13.115 -15.403 0.982 1.00 34.30 O HETATM 2800 O HOH 55 -8.598 -7.555 33.956 1.00 36.11 O HETATM 2801 O HOH 56 -13.099 -31.645 3.101 1.00 20.83 O HETATM 2802 O HOH 57 10.840 -9.853 19.694 1.00 26.61 O HETATM 2803 O HOH 58 0.876 -12.317 2.055 1.00 27.17 O HETATM 2804 O HOH 59 -15.172 -36.936 7.684 1.00 21.90 O HETATM 2805 O HOH 60 -14.755 -7.752 -1.441 1.00 33.00 O HETATM 2806 O HOH 61 -23.146 8.075 14.750 1.00 29.44 O HETATM 2807 O HOH 62 -1.598 17.400 9.787 1.00 29.65 O HETATM 2808 O HOH 63 -13.666 -15.358 22.714 1.00 29.11 O HETATM 2809 O HOH 64 -17.568 -37.197 9.882 1.00 30.41 O HETATM 2810 O HOH 65 -3.317 -4.993 26.946 1.00 20.85 O HETATM 2811 O HOH 66 -18.316 11.006 11.260 1.00 14.33 O HETATM 2812 O HOH 67 -8.923 3.095 40.491 1.00 44.50 O HETATM 2813 O HOH 68 -21.316 -4.200 30.797 1.00 39.63 O HETATM 2814 O HOH 69 -5.204 -21.150 31.427 1.00 43.02 O HETATM 2815 O HOH 70 -15.034 -14.810 17.946 1.00 25.47 O HETATM 2816 O HOH 71 -1.083 -18.422 20.371 1.00 38.59 O HETATM 2817 O HOH 72 6.426 0.511 -0.253 1.00 20.69 O HETATM 2818 O HOH 73 -17.856 -0.366 10.696 1.00 16.45 O HETATM 2819 O HOH 74 -11.394 -30.111 2.594 1.00 39.19 O HETATM 2820 O HOH 75 -3.790 4.932 38.152 1.00 47.41 O HETATM 2821 O HOH 76 -9.248 -13.220 29.784 1.00 41.37 O HETATM 2822 O HOH 77 -23.872 5.526 11.470 1.00 26.51 O HETATM 2823 O HOH 78 10.705 5.110 9.695 1.00 28.16 O HETATM 2824 O HOH 79 4.780 8.456 -3.452 1.00 41.15 O HETATM 2825 O HOH 80 -2.886 15.535 23.241 1.00 32.35 O HETATM 2826 O HOH 81 -4.308 14.512 25.650 1.00 38.91 O HETATM 2827 O HOH 82 8.769 -7.366 10.536 1.00 45.36 O HETATM 2828 O HOH 83 -6.275 -11.732 20.410 1.00 26.93 O HETATM 2829 O HOH 84 5.111 -10.299 21.389 1.00 21.46 O HETATM 2830 O HOH 85 -17.068 2.408 2.982 1.00 20.01 O HETATM 2831 O HOH 86 -11.089 5.131 23.940 1.00 12.80 O HETATM 2832 O HOH 87 1.018 -6.579 2.698 1.00 16.49 O HETATM 2833 O HOH 88 -18.718 15.005 8.882 1.00 43.67 O HETATM 2834 O HOH 89 -22.483 0.336 0.330 1.00 33.44 O HETATM 2835 O HOH 90 -21.365 -0.056 26.200 1.00 30.52 O HETATM 2836 O HOH 91 -2.036 6.092 27.668 1.00 14.85 O HETATM 2837 O HOH 92 -30.100 -26.600 -1.777 1.00 21.45 O HETATM 2838 O HOH 93 -16.846 8.662 11.343 1.00 18.42 O HETATM 2839 O HOH 94 -22.293 2.071 6.820 1.00 33.08 O HETATM 2840 O HOH 95 6.166 5.207 20.573 1.00 23.79 O HETATM 2841 O HOH 96 -24.581 -10.902 6.063 1.00 45.32 O HETATM 2842 O HOH 97 -9.452 -5.019 32.722 1.00 42.62 O HETATM 2843 O HOH 98 -12.029 -2.710 20.760 1.00 9.76 O HETATM 2844 O HOH 99 -7.413 -11.717 -0.812 1.00 39.43 O HETATM 2845 O HOH 100 -4.712 9.578 -1.186 1.00 27.79 O HETATM 2846 O HOH 101 -14.687 -1.043 17.341 1.00 8.50 O HETATM 2847 O HOH 102 -1.890 -11.681 29.750 1.00 46.19 O HETATM 2848 O HOH 103 -34.744 -19.064 18.945 1.00 50.41 O HETATM 2849 O HOH 104 -14.105 -13.777 5.038 1.00 15.53 O HETATM 2850 O HOH 105 -27.817 -25.267 25.720 1.00 19.89 O HETATM 2851 O HOH 106 7.604 -4.153 23.130 1.00 34.35 O HETATM 2852 O HOH 107 -5.204 -4.802 21.107 1.00 7.93 O HETATM 2853 O HOH 108 -18.028 -3.277 -0.943 1.00 42.42 O HETATM 2854 O HOH 109 -20.176 -7.013 15.279 1.00 23.03 O HETATM 2855 O HOH 110 -13.044 11.410 25.186 1.00 22.31 O HETATM 2856 O HOH 111 -15.921 1.228 19.572 1.00 11.66 O HETATM 2857 O HOH 112 16.084 -6.626 23.931 1.00 40.60 O HETATM 2858 O HOH 113 -2.106 8.993 26.768 1.00 20.37 O HETATM 2859 O HOH 114 -8.962 -12.280 2.746 1.00 16.03 O HETATM 2860 O HOH 115 0.446 -15.398 4.884 1.00 21.87 O HETATM 2861 O HOH 116 0.764 5.308 2.742 1.00 19.98 O HETATM 2862 O HOH 117 3.892 -21.819 11.414 1.00 48.07 O HETATM 2863 O HOH 118 -8.185 -16.385 8.805 1.00 17.42 O HETATM 2864 O HOH 119 -15.272 -13.230 23.948 1.00 52.88 O HETATM 2865 O HOH 120 -17.445 -7.409 18.574 1.00 26.62 O HETATM 2866 O HOH 121 -14.307 -34.568 14.786 1.00 23.12 O HETATM 2867 O HOH 122 7.664 7.809 12.778 1.00 40.99 O HETATM 2868 O HOH 123 -24.472 -30.998 9.078 1.00 48.34 O HETATM 2869 O HOH 124 -0.173 -27.733 20.984 1.00 25.47 O HETATM 2870 O HOH 125 -18.334 -19.051 17.570 1.00 38.24 O HETATM 2871 O HOH 126 -25.870 0.795 18.881 1.00 29.52 O HETATM 2872 O HOH 127 -12.290 -27.552 21.763 1.00 33.51 O HETATM 2873 O HOH 128 3.327 2.840 3.684 1.00 21.51 O HETATM 2874 O HOH 129 -15.826 0.600 9.382 1.00 10.70 O HETATM 2875 O HOH 130 -13.836 -17.169 18.492 1.00 34.22 O HETATM 2876 O HOH 131 -16.123 13.576 8.141 1.00 31.63 O HETATM 2877 O HOH 132 -12.200 -12.323 3.446 1.00 13.57 O HETATM 2878 O HOH 133 -18.873 -28.426 12.489 1.00 14.27 O HETATM 2879 O HOH 134 4.831 18.686 16.053 1.00 36.88 O HETATM 2880 O HOH 135 -13.624 -15.638 3.610 1.00 21.82 O HETATM 2881 O HOH 136 -14.994 -29.178 0.710 1.00 41.87 O HETATM 2882 O HOH 137 -20.532 0.678 28.802 1.00 28.06 O HETATM 2883 O HOH 138 -19.804 -20.047 19.347 1.00 31.97 O HETATM 2884 O HOH 139 -3.823 -0.165 33.715 1.00 28.17 O HETATM 2885 O HOH 140 -11.820 -1.361 0.945 1.00 22.64 O HETATM 2886 O HOH 141 -0.514 0.668 2.148 1.00 16.98 O HETATM 2887 O HOH 142 -15.518 6.037 36.655 1.00 46.76 O HETATM 2888 O HOH 143 -23.645 -4.266 12.174 1.00 24.01 O HETATM 2889 O HOH 144 5.882 15.619 13.016 1.00 26.61 O HETATM 2890 O HOH 145 -6.388 -37.061 7.530 1.00 41.50 O HETATM 2891 O HOH 146 -2.334 -19.583 4.780 1.00 25.29 O HETATM 2892 O HOH 147 -2.334 0.255 -4.785 1.00 35.67 O HETATM 2893 O HOH 148 -15.885 -19.801 2.403 1.00 40.46 O HETATM 2894 O HOH 149 -23.085 -15.181 0.284 1.00 39.48 O HETATM 2895 O HOH 150 -14.835 -6.492 34.795 1.00 29.21 O HETATM 2896 O HOH 151 -17.626 -4.678 22.076 1.00 32.93 O HETATM 2897 O HOH 152 -10.734 -35.494 12.275 1.00 41.42 O HETATM 2898 O HOH 153 5.044 -10.474 7.518 1.00 20.52 O HETATM 2899 O HOH 154 -6.825 15.309 26.497 1.00 37.09 O HETATM 2900 O HOH 155 -22.580 14.206 15.964 1.00 28.65 O HETATM 2901 O HOH 156 0.793 -2.008 27.844 1.00 16.87 O HETATM 2902 O HOH 157 -21.509 -3.803 -1.612 1.00 44.42 O HETATM 2903 O HOH 158 -0.207 14.888 22.912 1.00 20.54 O HETATM 2904 O HOH 159 -16.647 5.423 8.403 1.00 11.09 O HETATM 2905 O HOH 160 -14.481 -0.938 20.680 1.00 12.37 O HETATM 2906 O HOH 161 9.094 1.125 7.113 1.00 37.83 O HETATM 2907 O HOH 162 7.306 7.327 21.283 1.00 40.70 O HETATM 2908 O HOH 163 -9.195 -11.991 32.116 1.00 31.64 O HETATM 2909 O HOH 164 -14.079 17.023 20.154 1.00 29.36 O HETATM 2910 O HOH 165 -9.630 7.358 24.538 1.00 15.51 O HETATM 2911 O HOH 166 -0.224 -18.008 15.718 1.00 38.78 O HETATM 2912 O HOH 167 -16.118 3.187 9.991 1.00 12.10 O HETATM 2913 O HOH 168 -2.857 -18.101 2.703 1.00 36.26 O HETATM 2914 O HOH 169 0.326 2.919 -3.885 1.00 32.32 O HETATM 2915 O HOH 170 -12.265 -26.190 -1.974 1.00 37.97 O HETATM 2916 O HOH 171 9.814 4.143 6.605 1.00 37.51 O HETATM 2917 O HOH 172 -23.902 -6.569 7.378 1.00 54.00 O HETATM 2918 O HOH 173 -0.215 -14.302 18.222 1.00 22.88 O HETATM 2919 O HOH 174 8.607 1.486 1.707 1.00 45.70 O HETATM 2920 O HOH 175 -0.702 -23.453 3.525 1.00 40.38 O HETATM 2921 O HOH 176 -15.863 -17.370 3.101 1.00 35.91 O HETATM 2922 O HOH 177 -18.365 -20.787 3.033 1.00 21.22 O HETATM 2923 O HOH 178 -1.849 -27.329 -1.066 1.00 37.13 O HETATM 2924 O HOH 179 -9.183 9.526 35.050 1.00 36.12 O HETATM 2925 O HOH 180 -2.353 -4.411 24.593 1.00 21.84 O HETATM 2926 O HOH 181 -8.222 8.956 22.815 1.00 10.90 O HETATM 2927 O HOH 182 -2.372 10.236 29.050 1.00 41.41 O HETATM 2928 O HOH 183 -23.521 2.664 11.823 1.00 16.91 O HETATM 2929 O HOH 184 0.766 -8.382 0.559 1.00 17.07 O HETATM 2930 O HOH 185 -6.097 -34.534 14.257 1.00 28.86 O HETATM 2931 O HOH 186 6.062 -0.716 3.606 1.00 39.77 O HETATM 2932 O HOH 187 -13.017 15.512 23.683 1.00 39.75 O HETATM 2933 O HOH 188 -15.215 15.827 9.499 1.00 35.83 O HETATM 2934 O HOH 189 -16.459 -37.122 18.926 1.00 27.17 O HETATM 2935 O HOH 190 -11.341 -2.330 -1.363 1.00 36.29 O HETATM 2936 O HOH 191 -4.312 -13.874 1.369 1.00 43.37 O HETATM 2937 O HOH 192 -2.793 -10.396 21.981 1.00 35.59 O HETATM 2938 O HOH 193 7.764 12.936 16.030 1.00 44.81 O HETATM 2939 O HOH 194 -12.418 -18.348 1.179 1.00 34.18 O HETATM 2940 O HOH 195 -9.964 -0.019 0.135 1.00 46.73 O HETATM 2941 O HOH 196 0.827 17.480 18.196 1.00 28.00 O HETATM 2942 O HOH 197 -25.290 1.486 13.886 1.00 30.08 O HETATM 2943 O HOH 198 -0.377 -33.577 0.654 1.00 38.06 O HETATM 2944 O HOH 199 -20.770 -14.725 -0.524 1.00 35.97 O HETATM 2945 O HOH 200 2.987 6.884 -2.329 1.00 28.16 O HETATM 2946 O HOH 201 -6.536 -9.202 25.509 1.00 24.26 O HETATM 2947 O HOH 202 -26.157 -1.670 21.747 1.00 44.52 O HETATM 2948 O HOH 203 -24.197 -1.712 16.107 1.00 31.95 O HETATM 2949 O HOH 204 -11.013 0.164 38.364 1.00 27.16 O HETATM 2950 O HOH 205 -10.962 -3.226 37.462 1.00 44.39 O HETATM 2951 O HOH 206 -20.658 -23.915 24.799 1.00 25.90 O HETATM 2952 O HOH 207 -8.401 -1.706 36.856 1.00 30.18 O HETATM 2953 O HOH 208 -8.623 -35.450 13.117 1.00 37.46 O HETATM 2954 O HOH 209 1.740 8.328 24.117 1.00 28.15 O HETATM 2955 O HOH 210 9.444 4.277 13.514 1.00 49.31 O HETATM 2956 O HOH 211 -0.792 -2.556 30.039 1.00 29.33 O HETATM 2957 O HOH 212 -21.098 4.673 7.282 1.00 44.28 O HETATM 2958 O HOH 213 0.495 2.913 3.565 1.00 26.19 O HETATM 2959 O HOH 214 1.715 4.591 -4.204 1.00 44.01 O HETATM 2960 O HOH 215 6.579 17.727 15.397 1.00 41.18 O HETATM 2961 O HOH 216 2.851 6.549 26.248 1.00 40.28 O HETATM 2962 O HOH 217 -6.960 -37.696 5.151 1.00 47.18 O HETATM 2963 O HOH 218 5.687 -13.583 14.602 1.00 44.15 O HETATM 2964 O HOH 219 -19.913 -4.885 22.180 1.00 37.33 O HETATM 2965 O HOH 220 6.339 6.930 4.869 1.00 25.93 O HETATM 2966 O HOH 221 -15.918 10.911 2.037 1.00 45.15 O HETATM 2967 O HOH 222 -19.326 -19.635 21.933 1.00 46.54 O HETATM 2968 O HOH 223 -3.616 -18.772 24.219 1.00 35.99 O HETATM 2969 O HOH 224 3.594 -2.501 27.936 1.00 39.77 O HETATM 2970 O HOH 225 -11.447 -17.441 19.798 1.00 35.91 O HETATM 2971 O HOH 226 -11.913 -19.418 32.696 1.00 42.48 O HETATM 2972 O HOH 227 -13.212 -3.385 -1.990 1.00 46.39 O HETATM 2973 O HOH 228 -16.352 -9.352 24.418 1.00 45.29 O HETATM 2974 O HOH 229 -10.469 15.368 36.534 1.00 35.54 O HETATM 2975 O HOH 230 -7.563 17.198 13.835 1.00 46.00 O HETATM 2976 O HOH 231 -2.525 0.884 0.778 1.00 35.46 O HETATM 2977 O HOH 232 0.410 -16.215 20.068 1.00 48.33 O HETATM 2978 O HOH 233 -5.631 14.503 34.218 1.00 39.09 O HETATM 2979 O HOH 234 -3.414 14.982 8.355 1.00 36.60 O HETATM 2980 O HOH 235 4.494 -12.031 17.065 1.00 28.85 O HETATM 2981 O HOH 236 -3.369 -8.973 23.542 1.00 32.87 O HETATM 2982 O HOH 237 7.415 5.361 12.839 1.00 47.38 O HETATM 2983 O HOH 238 -18.901 4.180 3.907 1.00 38.28 O HETATM 2984 O HOH 239 10.427 7.405 3.052 1.00 44.57 O HETATM 2985 O HOH 240 -4.968 -20.266 25.931 1.00 33.39 O HETATM 2986 O HOH 241 -22.946 -27.232 11.039 1.00 48.38 O HETATM 2987 O HOH 242 -16.549 -41.128 0.287 1.00 56.58 O HETATM 2988 O HOH 243 -14.500 -1.915 0.011 1.00 20.92 O HETATM 2989 O HOH 244 2.027 -14.286 17.960 1.00 42.52 O HETATM 2990 O HOH 245 -11.580 -13.343 0.982 1.00 26.05 O HETATM 2991 O HOH 246 -11.832 -11.618 -1.347 1.00 42.09 O HETATM 2992 O HOH 247 16.039 -3.776 22.494 1.00 60.71 O HETATM 2993 O HOH 248 -8.231 -10.645 -2.149 1.00 51.67 O HETATM 2994 O HOH 249 -23.356 -0.853 29.535 1.00 38.34 O HETATM 2995 O HOH 250 14.979 -2.288 20.798 1.00 67.53 O HETATM 2996 O HOH 251 -21.007 -22.966 -0.777 1.00 34.45 O HETATM 2997 O HOH 252 -17.997 -7.174 20.988 1.00 41.78 O HETATM 2998 O HOH 253 9.130 6.299 5.307 1.00 39.79 O HETATM 2999 O HOH 254 -2.356 8.737 -2.602 1.00 45.96 O HETATM 3000 O HOH 255 -23.530 7.604 17.534 1.00 23.43 O HETATM 3001 O HOH 256 -1.679 -4.970 29.020 1.00 28.97 O HETATM 3002 O HOH 257 -13.017 -6.127 -2.588 1.00 49.46 O HETATM 3003 O HOH 258 1.723 -9.710 24.772 1.00 45.55 O HETATM 3004 O HOH 259 -23.854 1.102 9.839 1.00 35.09 O HETATM 3005 O HOH 260 -11.957 -23.570 25.410 1.00 48.93 O HETATM 3006 O HOH 261 4.424 -21.134 9.339 1.00 31.71 O HETATM 3007 O HOH 262 -6.387 15.004 9.114 1.00 44.37 O HETATM 3008 O HOH 263 -16.119 -19.720 -0.064 1.00 44.10 O HETATM 3009 O HOH 264 -12.722 -26.551 24.713 1.00 36.89 O HETATM 3010 O HOH 265 15.135 -4.467 20.683 1.00 41.57 O HETATM 3011 O HOH 266 -19.194 -22.911 -1.312 1.00 30.50 O HETATM 3012 O HOH 267 -3.281 17.073 8.461 1.00 45.31 O HETATM 3013 O HOH 268 -25.295 -27.474 11.474 1.00 53.19 O HETATM 3014 O HOH 269 -16.132 0.271 -0.883 1.00 38.34 O HETATM 3015 O HOH 270 17.710 -7.033 22.042 1.00 48.23 O HETATM 3016 O HOH 271 -17.355 -4.608 -2.041 1.00 45.19 O HETATM 3017 O HOH 272 0.003 -18.667 18.599 1.00 31.67 O HETATM 3018 O HOH 273 -0.351 -21.120 4.569 1.00 38.19 O HETATM 3019 O HOH 274 5.453 -3.478 2.610 1.00 34.62 O HETATM 3020 O HOH 275 -18.343 -25.309 -2.626 1.00 39.03 O HETATM 3021 O HOH 276 -5.056 16.694 9.413 1.00 42.37 O HETATM 3022 O HOH 277 -22.617 -2.444 25.393 1.00 31.82 O HETATM 3023 O HOH 278 1.567 -19.693 6.082 1.00 28.36 O HETATM 3024 O HOH 279 -17.263 2.144 -0.065 1.00 38.95 O HETATM 3025 O HOH 280 10.590 4.422 3.808 1.00 46.04 O HETATM 3026 O HOH 281 -5.276 -10.743 23.033 1.00 31.30 O HETATM 3027 O HOH 282 -23.044 -8.849 5.567 1.00 53.40 O HETATM 3028 O HOH 283 -18.504 5.231 6.216 1.00 30.76 O HETATM 3029 O HOH 284 -2.148 18.126 21.253 1.00 52.01 O HETATM 3030 O HOH 285 10.945 7.865 9.826 1.00 39.18 O HETATM 3031 O HOH 286 -17.546 -31.592 30.010 1.00 51.25 O HETATM 3032 O HOH 287 0.214 16.876 20.804 1.00 28.64 O HETATM 3033 O HOH 288 -10.912 -33.374 14.463 1.00 39.00 O HETATM 3034 O HOH 289 -19.673 15.806 32.363 1.00 50.79 O HETATM 3035 O HOH 290 17.826 -8.052 19.949 1.00 52.15 O HETATM 3036 O HOH 291 -17.195 11.127 -1.378 1.00 53.92 O HETATM 3037 O HOH 292 -21.513 -35.627 29.431 1.00 46.56 O HETATM 3038 O HOH 293 -26.314 6.244 17.457 1.00 25.18 O HETATM 3039 O HOH 294 -24.621 9.493 18.886 1.00 37.71 O HETATM 3040 O HOH 295 -11.297 22.335 16.067 1.00 37.27 O HETATM 3041 O HOH 296 17.795 -4.366 21.321 1.00 48.42 O HETATM 3042 O HOH 297 19.363 -7.943 23.232 1.00 65.04 O HETATM 3043 O HOH 298 19.012 -9.331 21.638 1.00 55.94 O HETATM 3044 O HOH 299 5.848 15.893 2.682 1.00 48.29 O HETATM 3045 O HOH 300 20.203 -7.609 20.433 1.00 47.07 O HETATM 3046 CBN DZ A 6 -18.694 -13.200 15.853 1.00 0.07 C HETATM 3047 CBO DZ A 6 -18.514 -12.592 17.246 1.00 -0.01 C HETATM 3048 NBP DZ A 6 -18.543 -11.252 17.289 1.00 0.24 N HETATM 3049 CBS DZ A 6 -18.829 -10.847 18.491 1.00 -0.04 C HETATM 3050 H6 DZ A 6 -18.849 -9.747 18.512 1.00 0.08 H HETATM 3051 H7 DZ A 6 -18.065 -11.213 19.193 1.00 0.08 H HETATM 3052 H8 DZ A 6 -19.814 -11.238 18.785 1.00 0.08 H HETATM 3053 CBQ DZ A 6 -19.416 -10.749 16.408 1.00 -0.01 C HETATM 3054 CBR DZ A 6 -19.183 -11.224 14.971 1.00 0.07 C HETATM 3055 NBM DZ A 6 -18.474 -12.366 14.816 1.00 -0.30 N HETATM 3056 CBE DZ A 6 -17.193 -12.504 13.705 1.00 0.02 C HETATM 3057 CBD DZ A 6 -16.260 -13.535 13.893 1.00 -0.03 C HETATM 3058 CBC DZ A 6 -15.074 -13.597 13.179 1.00 0.05 C HETATM 3059 CBH DZ A 6 -14.734 -12.607 12.271 1.00 -0.05 C HETATM 3060 CBG DZ A 6 -15.652 -11.573 12.060 1.00 -0.07 C HETATM 3061 CBF DZ A 6 -16.863 -11.527 12.763 1.00 -0.06 C HETATM 3062 H14 DZ A 6 -17.558 -10.717 12.572 1.00 0.03 H HETATM 3063 CBI DZ A 6 -15.318 -10.501 11.052 1.00 -0.02 C HETATM 3064 CBK DZ A 6 -16.544 -10.155 10.232 1.00 -0.05 C HETATM 3065 H16 DZ A 6 -16.288 -9.373 9.502 1.00 0.03 H HETATM 3066 H17 DZ A 6 -17.339 -9.788 10.898 1.00 0.03 H HETATM 3067 H18 DZ A 6 -16.895 -11.052 9.701 1.00 0.03 H HETATM 3068 CBJ DZ A 6 -14.761 -9.292 11.764 1.00 -0.05 C HETATM 3069 H19 DZ A 6 -13.875 -9.585 12.346 1.00 0.03 H HETATM 3070 H20 DZ A 6 -15.524 -8.881 12.441 1.00 0.03 H HETATM 3071 H21 DZ A 6 -14.478 -8.529 11.024 1.00 0.03 H HETATM 3072 H15 DZ A 6 -14.546 -10.887 10.370 1.00 0.05 H HETATM 3073 H22 DZ A 6 -13.788 -12.633 11.742 1.00 0.03 H HETATM 3074 NBA DZ A 6 -14.236 -14.715 13.552 1.00 -0.24 N HETATM 3075 CAZ DZ A 6 -12.824 -14.604 13.584 1.00 0.23 C HETATM 3076 OBB DZ A 6 -12.226 -13.569 13.307 1.00 -0.38 O HETATM 3077 CAW DZ A 6 -12.028 -15.788 14.130 1.00 0.05 C HETATM 3078 CAX DZ A 6 -10.810 -16.142 13.619 1.00 -0.02 C HETATM 3079 CAY DZ A 6 -10.210 -15.469 12.403 1.00 -0.03 C HETATM 3080 H24 DZ A 6 -10.868 -14.651 12.075 1.00 0.04 H HETATM 3081 H25 DZ A 6 -10.106 -16.204 11.591 1.00 0.04 H HETATM 3082 H26 DZ A 6 -9.220 -15.063 12.659 1.00 0.04 H HETATM 3083 CAS DZ A 6 -10.165 -17.214 14.229 1.00 -0.03 C HETATM 3084 CAT DZ A 6 -10.611 -17.853 15.373 1.00 -0.06 C HETATM 3085 CAU DZ A 6 -11.846 -17.459 15.892 1.00 -0.07 C HETATM 3086 CAV DZ A 6 -12.537 -16.410 15.260 1.00 -0.06 C HETATM 3087 H27 DZ A 6 -13.487 -16.081 15.665 1.00 0.06 H HETATM 3088 H28 DZ A 6 -12.263 -17.951 16.763 1.00 0.06 H HETATM 3089 H29 DZ A 6 -10.024 -18.630 15.848 1.00 0.06 H HETATM 3090 CAR DZ A 6 -8.808 -17.503 13.689 1.00 -0.01 C HETATM 3091 CAQ DZ A 6 -7.561 -17.665 13.215 1.00 0.01 C HETATM 3092 CAP DZ A 6 -6.157 -17.840 12.735 1.00 0.08 C HETATM 3093 CAO DZ A 6 -5.562 -18.192 11.511 1.00 -0.02 C HETATM 3094 NAN DZ A 6 -4.232 -18.096 11.762 1.00 -0.34 N HETATM 3095 CAK DZ A 6 -4.032 -17.683 13.060 1.00 0.16 C HETATM 3096 CAJ DZ A 6 -2.811 -17.438 13.747 1.00 0.06 C HETATM 3097 NAI DZ A 6 -2.908 -17.035 15.024 1.00 -0.30 N HETATM 3098 CAH DZ A 6 -4.092 -16.864 15.646 1.00 0.07 C HETATM 3099 CAM DZ A 6 -5.273 -17.095 14.954 1.00 0.10 C HETATM 3100 NAL DZ A 6 -5.181 -17.519 13.642 1.00 -0.19 N HETATM 3101 H36 DZ A 6 -6.241 -16.947 15.430 1.00 0.12 H HETATM 3102 CAD DZ A 6 -4.108 -16.345 17.059 1.00 -0.02 C HETATM 3103 CAC DZ A 6 -3.253 -16.805 18.046 1.00 -0.07 C HETATM 3104 CAB DZ A 6 -3.327 -16.230 19.304 1.00 -0.04 C HETATM 3105 CAA DZ A 6 -4.230 -15.201 19.563 1.00 0.04 C HETATM 3106 NAG DZ A 6 -4.304 -14.610 20.858 1.00 -0.34 N HETATM 3107 H39 DZ A 6 -4.975 -13.850 21.040 1.00 0.17 H HETATM 3108 H40 DZ A 6 -3.687 -14.943 21.612 1.00 0.17 H HETATM 3109 CAF DZ A 6 -5.068 -14.738 18.565 1.00 -0.04 C HETATM 3110 CAE DZ A 6 -5.000 -15.307 17.314 1.00 -0.07 C HETATM 3111 H42 DZ A 6 -5.645 -14.945 16.522 1.00 0.06 H HETATM 3112 H41 DZ A 6 -5.770 -13.937 18.766 1.00 0.05 H HETATM 3113 H38 DZ A 6 -2.676 -16.584 20.095 1.00 0.05 H HETATM 3114 H37 DZ A 6 -2.542 -17.597 17.839 1.00 0.06 H HETATM 3115 H35 DZ A 6 -1.845 -17.571 13.261 1.00 0.10 H HETATM 3116 H34 DZ A 6 -6.053 -18.475 10.581 1.00 0.04 H HETATM 3117 H32 DZ A 6 -7.714 -16.842 12.501 1.00 0.05 H HETATM 3118 H33 DZ A 6 -7.851 -18.616 12.746 1.00 0.05 H HETATM 3119 H30 DZ A 6 -9.238 -17.939 12.775 1.00 0.04 H HETATM 3120 H31 DZ A 6 -8.653 -18.296 14.436 1.00 0.04 H HETATM 3121 H23 DZ A 6 -14.663 -15.587 13.793 1.00 0.22 H HETATM 3122 H13 DZ A 6 -16.474 -14.309 14.621 1.00 0.03 H HETATM 3123 H11 DZ A 6 -18.648 -10.424 14.438 1.00 0.06 H HETATM 3124 H12 DZ A 6 -20.168 -11.378 14.507 1.00 0.06 H HETATM 3125 H9 DZ A 6 -19.337 -9.652 16.428 1.00 0.08 H HETATM 3126 H10 DZ A 6 -20.429 -11.049 16.713 1.00 0.08 H HETATM 3127 H5 DZ A 6 -17.625 -10.911 17.049 1.00 0.20 H HETATM 3128 H3 DZ A 6 -17.543 -12.925 17.640 1.00 0.08 H HETATM 3129 H4 DZ A 6 -19.321 -12.971 17.890 1.00 0.08 H HETATM 3130 H1 DZ A 6 -19.728 -13.568 15.776 1.00 0.06 H HETATM 3131 H2 DZ A 6 -17.996 -14.045 15.761 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 1039 1040 1043 1044 1045 CONECT 1043 1039 CONECT 1044 1039 CONECT 1045 1039 CONECT 1642 1643 1647 1648 1649 CONECT 1647 1642 CONECT 1648 1642 CONECT 1649 1642 CONECT 3046 3047 3055 3130 3131 CONECT 3047 3046 3048 3128 3129 CONECT 3048 3047 3049 3053 3127 CONECT 3049 3048 3050 3051 3052 CONECT 3050 3049 CONECT 3051 3049 CONECT 3052 3049 CONECT 3053 3048 3054 3125 3126 CONECT 3054 3053 3055 3123 3124 CONECT 3055 3046 3054 3056 CONECT 3056 3055 3057 3061 CONECT 3057 3056 3058 3122 CONECT 3058 3057 3059 3074 CONECT 3059 3058 3060 3073 CONECT 3060 3059 3061 3063 CONECT 3061 3056 3060 3062 CONECT 3062 3061 CONECT 3063 3060 3064 3068 3072 CONECT 3064 3063 3065 3066 3067 CONECT 3065 3064 CONECT 3066 3064 CONECT 3067 3064 CONECT 3068 3063 3069 3070 3071 CONECT 3069 3068 CONECT 3070 3068 CONECT 3071 3068 CONECT 3072 3063 CONECT 3073 3059 CONECT 3074 3058 3075 3121 CONECT 3075 3074 3076 3077 CONECT 3076 3075 CONECT 3077 3075 3078 3086 CONECT 3078 3077 3079 3083 CONECT 3079 3078 3080 3081 3082 CONECT 3080 3079 CONECT 3081 3079 CONECT 3082 3079 CONECT 3083 3078 3084 3090 CONECT 3084 3083 3085 3089 CONECT 3085 3084 3086 3088 CONECT 3086 3077 3085 3087 CONECT 3087 3086 CONECT 3088 3085 CONECT 3089 3084 CONECT 3090 3083 3091 3119 3120 CONECT 3091 3090 3092 3117 3118 CONECT 3092 3091 3093 3100 CONECT 3093 3092 3094 3116 CONECT 3094 3093 3095 CONECT 3095 3094 3096 3100 CONECT 3096 3095 3097 3115 CONECT 3097 3096 3098 CONECT 3098 3097 3099 3102 CONECT 3099 3098 3100 3101 CONECT 3100 3092 3095 3099 CONECT 3101 3099 CONECT 3102 3098 3103 3110 CONECT 3103 3102 3104 3114 CONECT 3104 3103 3105 3113 CONECT 3105 3104 3106 3109 CONECT 3106 3105 3107 3108 CONECT 3107 3106 CONECT 3108 3106 CONECT 3109 3105 3110 3112 CONECT 3110 3102 3109 3111 CONECT 3111 3110 CONECT 3112 3109 CONECT 3113 3104 CONECT 3114 3103 CONECT 3115 3096 CONECT 3116 3093 CONECT 3117 3091 CONECT 3118 3091 CONECT 3119 3090 CONECT 3120 3090 CONECT 3121 3074 CONECT 3122 3057 CONECT 3123 3054 CONECT 3124 3054 CONECT 3125 3053 CONECT 3126 3053 CONECT 3127 3048 CONECT 3128 3047 CONECT 3129 3047 CONECT 3130 3046 CONECT 3131 3046 MASTER 0 0 0 0 0 0 0 0 3128 3 98 23 END
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Structure:
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Related entries of code: 6kzd
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3v5q
RCSB PDB
PDBbind
297aa, >3V5Q_1|Chains... at 97%
4ymj
RCSB PDB
PDBbind
304aa, >4YMJ_1|Chains... at 97%
6kzc
RCSB PDB
PDBbind
312aa, >6KZC_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6kzd
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
TrkC
Ligand Name
DZ6
EC.Number
E.C.-.-.-.-
Resolution
1.71(Å)
Affinity (Kd/Ki/IC50)
IC50=2.95nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Eur.J.Med.Chem. Vol. 179: pp. 470-482
Ligand Properties
Formula
C
3
6
H
4
2
N
7
O
Molecular Weight
588.765
Exact Mass
588.345
No. of atoms
86
No. of bonds
91
Polar Surface Area
92.99
LOGP Value
6.19 (
Computed with XLOGP3
)
7.07 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 6
Canonical SMILES
Nc1ccc(cc1)c1ncc2n(c1)c(CCc1cccc(c1C)C(=O)Nc1cc(cc(c1)N1CC[NH+](CC1)C)C(C)C)cn2
InChI String
InChI=1S/C36H41N7O/c1-24(2)28-18-30(20-32(19-28)42-16-14-41(4)15-17-42)40-36(44)33-7-5-6-26(25(33)3)10-13-31-21-39-35-22-38-34(23-43(31)35)27-8-11-29(37)12-9-27/h5-9,11-12,18-24H,10,13-17,37H2,1-4H3,(H,40,44)/p+1
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):
Q16288
Entrez Gene ID
NCBI Entrez Gene ID:
4916
ASD
Information of known allosteric effects of PDB entries
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