Browse entries in the PDBbind-CN Database
HEADER 6PL1_COMPLEX COMPND 6PL1_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 49 ALA CYS VAL HIS HIS ILE LYS ARG ARG ASP ILE VAL LEU SEQRES 2 A 49 LYS TRP GLU LEU GLY GLU GLY ALA PHE GLY LYS VAL PHE SEQRES 3 A 49 LEU ALA GLU CYS HIS ASN LEU LEU PRO GLU GLN ASP LYS SEQRES 4 A 49 MET LEU VAL ALA VAL LYS ALA LEU LYS GLU SEQRES 1 A 132 SER ALA ARG GLN ASP PHE GLN ARG GLU ALA GLU LEU LEU SEQRES 2 A 132 THR MET LEU GLN HIS GLN HIS ILE VAL ARG PHE PHE GLY SEQRES 3 A 132 VAL CYS THR GLU GLY ARG PRO LEU LEU MET VAL PHE GLU SEQRES 4 A 132 TYR MET ARG HIS GLY ASP LEU ASN ARG PHE LEU ARG SER SEQRES 5 A 132 HIS GLY PRO ASP ALA LYS LEU LEU ALA GLY GLY GLU ASP SEQRES 6 A 132 VAL ALA PRO GLY PRO LEU GLY LEU GLY GLN LEU LEU ALA SEQRES 7 A 132 VAL ALA SER GLN VAL ALA ALA GLY MET VAL TYR LEU ALA SEQRES 8 A 132 GLY LEU HIS PHE VAL HIS ARG ASP LEU ALA THR ARG ASN SEQRES 9 A 132 CYS LEU VAL GLY GLN GLY LEU VAL VAL LYS ILE GLY ASP SEQRES 10 A 132 PHE GLY MET SER ARG ASP ILE TYR SEP THR ASP TYR TYR SEQRES 11 A 132 ARG VAL SEQRES 1 A 109 THR MET LEU PRO ILE ARG TRP MET PRO PRO GLU SER ILE SEQRES 2 A 109 LEU TYR ARG LYS PHE THR THR GLU SER ASP VAL TRP SER SEQRES 3 A 109 PHE GLY VAL VAL LEU TRP GLU ILE PHE THR TYR GLY LYS SEQRES 4 A 109 GLN PRO TRP TYR GLN LEU SER ASN THR GLU ALA ILE ASP SEQRES 5 A 109 CYS ILE THR GLN GLY ARG GLU LEU GLU ARG PRO ARG ALA SEQRES 6 A 109 CYS PRO PRO GLU VAL TYR ALA ILE MET ARG GLY CYS TRP SEQRES 7 A 109 GLN ARG GLU PRO GLN GLN ARG HIS SER ILE LYS ASP VAL SEQRES 8 A 109 HIS ALA ARG LEU GLN ALA LEU ALA GLN ALA PRO PRO VAL SEQRES 9 A 109 TYR LEU ASP VAL LEU HET SEP A 677 11 HET OOJ A 348 48 ATOM 1 N ALA A 500 -13.632 -3.306 9.639 1.00 75.69 N ATOM 2 CA ALA A 500 -13.024 -4.608 9.191 1.00 68.51 C ATOM 3 C ALA A 500 -11.515 -4.656 9.381 1.00 62.70 C ATOM 4 O ALA A 500 -10.993 -5.599 9.940 1.00 67.67 O ATOM 5 CB ALA A 500 -13.385 -4.908 7.751 1.00 66.96 C ATOM 6 HN3 ALA A 500 -13.219 -2.525 9.090 1.00 0.00 H ATOM 7 HN2 ALA A 500 -13.436 -3.163 10.650 1.00 0.00 H ATOM 8 HN1 ALA A 500 -14.660 -3.334 9.485 1.00 0.00 H ATOM 9 N CYS A 501 -10.828 -3.639 8.889 1.00 60.76 N ATOM 10 CA CYS A 501 -9.429 -3.404 9.234 1.00 62.28 C ATOM 11 C CYS A 501 -9.339 -2.866 10.669 1.00 57.10 C ATOM 12 O CYS A 501 -8.465 -3.248 11.444 1.00 53.46 O ATOM 13 CB CYS A 501 -8.826 -2.396 8.259 1.00 64.03 C ATOM 14 SG CYS A 501 -7.104 -1.967 8.595 1.00 71.36 S ATOM 15 H CYS A 501 -11.300 -2.984 8.234 1.00 0.00 H ATOM 16 N VAL A 502 -10.266 -1.974 11.000 1.00 47.46 N ATOM 17 CA VAL A 502 -10.333 -1.326 12.299 1.00 46.39 C ATOM 18 C VAL A 502 -10.845 -2.310 13.366 1.00 45.41 C ATOM 19 O VAL A 502 -11.765 -3.083 13.110 1.00 48.19 O ATOM 20 CB VAL A 502 -11.273 -0.097 12.180 1.00 50.86 C ATOM 21 CG1 VAL A 502 -11.473 0.609 13.507 1.00 59.27 C ATOM 22 CG2 VAL A 502 -10.725 0.905 11.165 1.00 53.70 C ATOM 23 H VAL A 502 -10.984 -1.725 10.290 1.00 0.00 H ATOM 24 N HIS A 503 -10.239 -2.283 14.551 1.00 42.20 N ATOM 25 CA HIS A 503 -10.787 -3.000 15.717 1.00 43.09 C ATOM 26 C HIS A 503 -12.024 -2.287 16.248 1.00 43.96 C ATOM 27 O HIS A 503 -12.109 -1.059 16.176 1.00 42.38 O ATOM 28 CB HIS A 503 -9.740 -3.127 16.812 1.00 47.17 C ATOM 29 CG HIS A 503 -8.648 -4.090 16.477 1.00 56.83 C ATOM 30 ND1 HIS A 503 -8.608 -5.371 16.981 1.00 64.26 N ATOM 31 CD2 HIS A 503 -7.572 -3.972 15.666 1.00 68.42 C ATOM 32 CE1 HIS A 503 -7.547 -5.998 16.503 1.00 62.61 C ATOM 33 NE2 HIS A 503 -6.903 -5.171 15.701 1.00 66.77 N ATOM 34 H HIS A 503 -9.357 -1.743 14.657 1.00 0.00 H ATOM 35 N HIS A 504 -12.979 -3.060 16.767 1.00 38.43 N ATOM 36 CA HIS A 504 -14.251 -2.533 17.287 1.00 33.86 C ATOM 37 C HIS A 504 -14.408 -2.861 18.767 1.00 37.26 C ATOM 38 O HIS A 504 -13.977 -3.920 19.217 1.00 38.81 O ATOM 39 CB HIS A 504 -15.427 -3.107 16.510 1.00 39.99 C ATOM 40 CG HIS A 504 -15.581 -2.516 15.148 1.00 38.79 C ATOM 41 ND1 HIS A 504 -14.739 -2.833 14.104 1.00 38.68 N ATOM 42 CD2 HIS A 504 -16.458 -1.607 14.664 1.00 43.81 C ATOM 43 CE1 HIS A 504 -15.092 -2.143 13.035 1.00 41.97 C ATOM 44 NE2 HIS A 504 -16.132 -1.392 13.348 1.00 41.61 N ATOM 45 H HIS A 504 -12.817 -4.087 16.806 1.00 0.00 H ATOM 46 N ILE A 505 -15.025 -1.940 19.500 1.00 35.92 N ATOM 47 CA ILE A 505 -15.204 -2.048 20.945 1.00 42.08 C ATOM 48 C ILE A 505 -16.690 -1.839 21.211 1.00 37.18 C ATOM 49 O ILE A 505 -17.304 -0.925 20.653 1.00 37.89 O ATOM 50 CB ILE A 505 -14.335 -1.007 21.712 1.00 41.63 C ATOM 51 CG1 ILE A 505 -12.840 -1.289 21.496 1.00 44.21 C ATOM 52 CG2 ILE A 505 -14.612 -1.032 23.212 1.00 38.88 C ATOM 53 CD1 ILE A 505 -11.925 -0.111 21.774 1.00 47.15 C ATOM 54 H ILE A 505 -15.400 -1.098 19.019 1.00 0.00 H ATOM 55 N LYS A 506 -17.255 -2.687 22.068 1.00 41.05 N ATOM 56 CA LYS A 506 -18.684 -2.596 22.432 1.00 45.44 C ATOM 57 C LYS A 506 -18.932 -1.416 23.361 1.00 38.40 C ATOM 58 O LYS A 506 -18.165 -1.206 24.296 1.00 36.97 O ATOM 59 CB LYS A 506 -19.181 -3.898 23.098 1.00 48.49 C ATOM 60 CG LYS A 506 -19.804 -4.895 22.120 1.00 52.33 C ATOM 61 CD LYS A 506 -20.891 -5.767 22.754 1.00 55.73 C ATOM 62 CE LYS A 506 -22.184 -5.755 21.948 1.00 54.57 C ATOM 63 NZ LYS A 506 -22.031 -6.254 20.550 1.00 69.11 N ATOM 64 HZ1 LYS A 506 -21.347 -5.657 20.043 1.00 0.00 H ATOM 65 HZ2 LYS A 506 -21.689 -7.236 20.569 1.00 0.00 H ATOM 66 HZ3 LYS A 506 -22.951 -6.215 20.067 1.00 0.00 H ATOM 67 H LYS A 506 -16.673 -3.436 22.494 1.00 0.00 H ATOM 68 N ARG A 507 -20.007 -0.665 23.117 1.00 36.01 N ATOM 69 CA ARG A 507 -20.310 0.522 23.910 1.00 39.86 C ATOM 70 C ARG A 507 -20.403 0.224 25.417 1.00 45.86 C ATOM 71 O ARG A 507 -20.002 1.055 26.237 1.00 43.33 O ATOM 72 CB ARG A 507 -21.588 1.206 23.408 1.00 41.20 C ATOM 73 CG ARG A 507 -21.971 2.511 24.109 1.00 43.54 C ATOM 74 CD ARG A 507 -20.959 3.632 23.881 1.00 44.42 C ATOM 75 NE ARG A 507 -21.215 4.786 24.744 1.00 51.41 N ATOM 76 CZ ARG A 507 -20.900 4.862 26.040 1.00 52.96 C ATOM 77 NH1 ARG A 507 -20.302 3.843 26.671 1.00 48.02 N ATOM 78 NH2 ARG A 507 -21.192 5.968 26.722 1.00 53.92 N ATOM 79 HE ARG A 507 -21.679 5.612 24.314 1.00 0.00 H ATOM 80 HH12 ARG A 507 -20.066 3.923 27.681 1.00 0.00 H ATOM 81 HH11 ARG A 507 -20.074 2.971 26.151 1.00 0.00 H ATOM 82 HH22 ARG A 507 -20.950 6.036 27.731 1.00 0.00 H ATOM 83 HH21 ARG A 507 -21.662 6.764 26.245 1.00 0.00 H ATOM 84 H ARG A 507 -20.646 -0.932 22.341 1.00 0.00 H ATOM 85 N ARG A 508 -20.907 -0.958 25.772 1.00 41.34 N ATOM 86 CA ARG A 508 -21.042 -1.356 27.185 1.00 48.51 C ATOM 87 C ARG A 508 -19.709 -1.601 27.886 1.00 39.61 C ATOM 88 O ARG A 508 -19.648 -1.576 29.108 1.00 44.62 O ATOM 89 CB ARG A 508 -21.959 -2.580 27.350 1.00 46.27 C ATOM 90 CG ARG A 508 -21.444 -3.892 26.783 1.00 55.51 C ATOM 91 CD ARG A 508 -22.483 -4.994 26.973 1.00 60.72 C ATOM 92 NE ARG A 508 -22.070 -6.248 26.350 1.00 72.76 N ATOM 93 CZ ARG A 508 -22.760 -7.381 26.299 1.00 49.45 C ATOM 94 NH1 ARG A 508 -23.911 -7.499 26.955 1.00 48.50 N ATOM 95 NH2 ARG A 508 -22.281 -8.435 25.646 1.00 48.61 N ATOM 96 HE ARG A 508 -21.134 -6.254 25.897 1.00 0.00 H ATOM 97 HH12 ARG A 508 -24.446 -8.390 26.910 1.00 0.00 H ATOM 98 HH11 ARG A 508 -24.276 -6.701 27.513 1.00 0.00 H ATOM 99 HH22 ARG A 508 -22.829 -9.318 25.612 1.00 0.00 H ATOM 100 HH21 ARG A 508 -21.358 -8.376 25.170 1.00 0.00 H ATOM 101 H ARG A 508 -21.214 -1.619 25.030 1.00 0.00 H ATOM 102 N ASP A 509 -18.657 -1.857 27.116 1.00 44.21 N ATOM 103 CA ASP A 509 -17.297 -1.965 27.648 1.00 38.20 C ATOM 104 C ASP A 509 -16.580 -0.621 27.918 1.00 38.70 C ATOM 105 O ASP A 509 -15.478 -0.620 28.474 1.00 38.81 O ATOM 106 CB ASP A 509 -16.440 -2.836 26.713 1.00 47.50 C ATOM 107 CG ASP A 509 -16.780 -4.332 26.805 1.00 51.02 C ATOM 108 OD1 ASP A 509 -17.351 -4.787 27.819 1.00 45.70 O ATOM 109 OD2 ASP A 509 -16.438 -5.063 25.861 1.00 44.98 O ATOM 110 H ASP A 509 -18.805 -1.986 26.095 1.00 0.00 H ATOM 111 N ILE A 510 -17.188 0.496 27.529 1.00 35.98 N ATOM 112 CA ILE A 510 -16.658 1.837 27.783 1.00 35.34 C ATOM 113 C ILE A 510 -17.531 2.505 28.824 1.00 39.54 C ATOM 114 O ILE A 510 -18.736 2.633 28.622 1.00 39.84 O ATOM 115 CB ILE A 510 -16.675 2.709 26.513 1.00 39.25 C ATOM 116 CG1 ILE A 510 -15.837 2.051 25.414 1.00 42.87 C ATOM 117 CG2 ILE A 510 -16.156 4.123 26.821 1.00 42.72 C ATOM 118 CD1 ILE A 510 -16.051 2.631 24.032 1.00 41.38 C ATOM 119 H ILE A 510 -18.089 0.412 27.016 1.00 0.00 H ATOM 120 N VAL A 511 -16.914 2.942 29.921 1.00 34.66 N ATOM 121 CA VAL A 511 -17.586 3.716 30.957 1.00 33.61 C ATOM 122 C VAL A 511 -16.906 5.078 31.063 1.00 37.85 C ATOM 123 O VAL A 511 -15.777 5.180 31.556 1.00 38.08 O ATOM 124 CB VAL A 511 -17.549 2.990 32.327 1.00 33.85 C ATOM 125 CG1 VAL A 511 -18.311 3.783 33.380 1.00 44.10 C ATOM 126 CG2 VAL A 511 -18.145 1.594 32.216 1.00 39.28 C ATOM 127 H VAL A 511 -15.905 2.720 30.044 1.00 0.00 H ATOM 128 N LEU A 512 -17.608 6.123 30.630 1.00 36.96 N ATOM 129 CA LEU A 512 -17.101 7.489 30.687 1.00 35.97 C ATOM 130 C LEU A 512 -17.010 7.996 32.124 1.00 45.68 C ATOM 131 O LEU A 512 -17.913 7.761 32.922 1.00 40.77 O ATOM 132 CB LEU A 512 -18.003 8.424 29.879 1.00 37.82 C ATOM 133 CG LEU A 512 -18.168 8.146 28.382 1.00 37.80 C ATOM 134 CD1 LEU A 512 -18.957 9.285 27.761 1.00 41.73 C ATOM 135 CD2 LEU A 512 -16.848 7.990 27.649 1.00 42.26 C ATOM 136 H LEU A 512 -18.556 5.958 30.235 1.00 0.00 H ATOM 137 N LYS A 513 -15.928 8.714 32.434 1.00 36.41 N ATOM 138 CA LYS A 513 -15.693 9.254 33.780 1.00 35.36 C ATOM 139 C LYS A 513 -15.864 10.767 33.822 1.00 35.08 C ATOM 140 O LYS A 513 -16.676 11.293 34.588 1.00 44.74 O ATOM 141 CB LYS A 513 -14.306 8.860 34.264 1.00 35.88 C ATOM 142 CG LYS A 513 -14.153 7.363 34.505 1.00 35.34 C ATOM 143 CD LYS A 513 -12.703 6.962 34.758 1.00 42.62 C ATOM 144 CE LYS A 513 -12.109 7.577 36.021 1.00 41.43 C ATOM 145 NZ LYS A 513 -12.806 7.109 37.243 1.00 49.01 N ATOM 146 HZ1 LYS A 513 -13.810 7.375 37.191 1.00 0.00 H ATOM 147 HZ2 LYS A 513 -12.723 6.075 37.313 1.00 0.00 H ATOM 148 HZ3 LYS A 513 -12.372 7.550 38.079 1.00 0.00 H ATOM 149 H LYS A 513 -15.223 8.899 31.692 1.00 0.00 H ATOM 150 N TRP A 514 -15.101 11.463 32.992 1.00 35.43 N ATOM 151 CA TRP A 514 -15.198 12.914 32.870 1.00 31.43 C ATOM 152 C TRP A 514 -14.466 13.401 31.629 1.00 33.78 C ATOM 153 O TRP A 514 -13.688 12.666 31.025 1.00 34.90 O ATOM 154 CB TRP A 514 -14.645 13.621 34.122 1.00 35.94 C ATOM 155 CG TRP A 514 -13.301 13.118 34.603 1.00 36.70 C ATOM 156 CD1 TRP A 514 -12.073 13.378 34.050 1.00 38.70 C ATOM 157 CD2 TRP A 514 -13.060 12.294 35.743 1.00 37.63 C ATOM 158 NE1 TRP A 514 -11.089 12.768 34.781 1.00 33.62 N ATOM 159 CE2 TRP A 514 -11.666 12.095 35.827 1.00 37.54 C ATOM 160 CE3 TRP A 514 -13.890 11.719 36.722 1.00 44.08 C ATOM 161 CZ2 TRP A 514 -11.078 11.328 36.843 1.00 34.84 C ATOM 162 CZ3 TRP A 514 -13.302 10.958 37.734 1.00 42.91 C ATOM 163 CH2 TRP A 514 -11.906 10.770 37.781 1.00 39.61 C ATOM 164 HE1 TRP A 514 -10.070 12.809 34.576 1.00 0.00 H ATOM 165 H TRP A 514 -14.407 10.956 32.406 1.00 0.00 H ATOM 166 N GLU A 515 -14.724 14.649 31.263 1.00 35.67 N ATOM 167 CA GLU A 515 -14.070 15.285 30.131 1.00 40.71 C ATOM 168 C GLU A 515 -12.614 15.632 30.465 1.00 41.96 C ATOM 169 O GLU A 515 -12.278 15.902 31.618 1.00 39.81 O ATOM 170 CB GLU A 515 -14.816 16.551 29.721 1.00 44.90 C ATOM 171 CG GLU A 515 -14.371 17.115 28.377 1.00 48.71 C ATOM 172 CD GLU A 515 -15.372 18.105 27.799 1.00 51.89 C ATOM 173 OE1 GLU A 515 -15.942 18.896 28.568 1.00 48.61 O ATOM 174 OE2 GLU A 515 -15.605 18.079 26.578 1.00 66.72 O ATOM 175 H GLU A 515 -15.422 15.195 31.807 1.00 0.00 H ATOM 176 N LEU A 516 -11.774 15.570 29.442 1.00 42.23 N ATOM 177 CA LEU A 516 -10.354 15.953 29.506 1.00 48.53 C ATOM 178 C LEU A 516 -10.076 17.165 28.636 1.00 42.40 C ATOM 179 O LEU A 516 -9.338 18.060 29.036 1.00 62.08 O ATOM 180 CB LEU A 516 -9.460 14.808 29.025 1.00 41.79 C ATOM 181 CG LEU A 516 -9.383 13.571 29.899 1.00 46.73 C ATOM 182 CD1 LEU A 516 -8.601 12.488 29.178 1.00 40.54 C ATOM 183 CD2 LEU A 516 -8.770 13.881 31.258 1.00 44.98 C ATOM 184 H LEU A 516 -12.143 15.227 28.532 1.00 0.00 H ATOM 185 N GLY A 517 -10.649 17.179 27.442 1.00 43.85 N ATOM 186 CA GLY A 517 -10.472 18.289 26.523 1.00 48.92 C ATOM 187 C GLY A 517 -11.591 18.348 25.523 1.00 56.17 C ATOM 188 O GLY A 517 -12.429 17.448 25.455 1.00 52.53 O ATOM 189 H GLY A 517 -11.241 16.374 27.155 1.00 0.00 H ATOM 190 N GLU A 518 -11.601 19.418 24.739 1.00 53.40 N ATOM 191 CA GLU A 518 -12.669 19.637 23.787 1.00 54.65 C ATOM 192 C GLU A 518 -12.232 20.566 22.674 1.00 65.29 C ATOM 193 O GLU A 518 -11.758 21.672 22.933 1.00 62.75 O ATOM 194 CB GLU A 518 -13.881 20.232 24.505 1.00 63.53 C ATOM 195 CG GLU A 518 -15.063 20.534 23.596 1.00 66.98 C ATOM 196 CD GLU A 518 -16.292 21.022 24.345 1.00 80.17 C ATOM 197 OE1 GLU A 518 -16.179 21.363 25.543 1.00 78.48 O ATOM 198 OE2 GLU A 518 -17.380 21.074 23.729 1.00 77.32 O ATOM 199 H GLU A 518 -10.829 20.111 24.810 1.00 0.00 H ATOM 200 N GLY A 519 -12.416 20.110 21.439 1.00 63.74 N ATOM 201 CA GLY A 519 -12.174 20.930 20.259 1.00 71.31 C ATOM 202 C GLY A 519 -13.462 21.238 19.513 1.00 80.26 C ATOM 203 O GLY A 519 -14.555 21.097 20.052 1.00 60.37 O ATOM 204 H GLY A 519 -12.745 19.132 21.310 1.00 0.00 H ATOM 205 N ALA A 520 -13.327 21.669 18.264 1.00 74.90 N ATOM 206 CA ALA A 520 -14.480 22.001 17.420 1.00 69.83 C ATOM 207 C ALA A 520 -15.122 20.758 16.784 1.00 70.94 C ATOM 208 O ALA A 520 -16.340 20.715 16.587 1.00 70.86 O ATOM 209 CB ALA A 520 -14.063 22.986 16.341 1.00 71.63 C ATOM 210 H ALA A 520 -12.370 21.775 17.870 1.00 0.00 H ATOM 211 N PHE A 521 -14.291 19.773 16.442 1.00 67.78 N ATOM 212 CA PHE A 521 -14.732 18.511 15.841 1.00 65.63 C ATOM 213 C PHE A 521 -14.946 17.364 16.846 1.00 64.44 C ATOM 214 O PHE A 521 -15.377 16.273 16.449 1.00 62.46 O ATOM 215 CB PHE A 521 -13.738 18.081 14.754 1.00 63.01 C ATOM 216 CG PHE A 521 -13.720 18.992 13.556 1.00 72.09 C ATOM 217 CD1 PHE A 521 -14.596 18.782 12.491 1.00 67.43 C ATOM 218 CD2 PHE A 521 -12.831 20.068 13.489 1.00 73.64 C ATOM 219 CE1 PHE A 521 -14.580 19.622 11.383 1.00 71.76 C ATOM 220 CE2 PHE A 521 -12.811 20.909 12.382 1.00 66.55 C ATOM 221 CZ PHE A 521 -13.686 20.686 11.326 1.00 61.13 C ATOM 222 H PHE A 521 -13.274 19.908 16.611 1.00 0.00 H ATOM 223 N GLY A 522 -14.667 17.593 18.132 1.00 64.51 N ATOM 224 CA GLY A 522 -14.921 16.559 19.138 1.00 54.58 C ATOM 225 C GLY A 522 -14.655 16.908 20.588 1.00 51.75 C ATOM 226 O GLY A 522 -14.165 17.995 20.917 1.00 52.48 O ATOM 227 H GLY A 522 -14.268 18.509 18.420 1.00 0.00 H ATOM 228 N LYS A 523 -15.007 15.956 21.448 1.00 45.49 N ATOM 229 CA LYS A 523 -14.752 16.011 22.883 1.00 46.15 C ATOM 230 C LYS A 523 -13.963 14.775 23.258 1.00 42.47 C ATOM 231 O LYS A 523 -14.194 13.703 22.701 1.00 37.97 O ATOM 232 CB LYS A 523 -16.057 15.995 23.677 1.00 52.60 C ATOM 233 CG LYS A 523 -17.004 17.144 23.385 1.00 59.15 C ATOM 234 CD LYS A 523 -18.080 17.266 24.455 1.00 56.43 C ATOM 235 CE LYS A 523 -19.277 18.082 23.996 1.00 61.15 C ATOM 236 NZ LYS A 523 -20.089 17.382 22.958 1.00 57.86 N ATOM 237 HZ1 LYS A 523 -19.495 17.191 22.126 1.00 0.00 H ATOM 238 HZ2 LYS A 523 -20.445 16.484 23.345 1.00 0.00 H ATOM 239 HZ3 LYS A 523 -20.891 17.984 22.683 1.00 0.00 H ATOM 240 H LYS A 523 -15.496 15.118 21.073 1.00 0.00 H ATOM 241 N VAL A 524 -13.051 14.929 24.215 1.00 39.03 N ATOM 242 CA VAL A 524 -12.251 13.825 24.718 1.00 35.55 C ATOM 243 C VAL A 524 -12.621 13.575 26.162 1.00 32.01 C ATOM 244 O VAL A 524 -12.629 14.502 26.961 1.00 37.53 O ATOM 245 CB VAL A 524 -10.742 14.122 24.633 1.00 43.27 C ATOM 246 CG1 VAL A 524 -9.930 12.918 25.076 1.00 42.25 C ATOM 247 CG2 VAL A 524 -10.364 14.486 23.221 1.00 47.11 C ATOM 248 H VAL A 524 -12.905 15.876 24.619 1.00 0.00 H ATOM 249 N PHE A 525 -12.900 12.317 26.486 1.00 28.75 N ATOM 250 CA PHE A 525 -13.215 11.890 27.843 1.00 32.44 C ATOM 251 C PHE A 525 -12.191 10.898 28.364 1.00 32.51 C ATOM 252 O PHE A 525 -11.636 10.135 27.596 1.00 31.79 O ATOM 253 CB PHE A 525 -14.586 11.210 27.873 1.00 33.40 C ATOM 254 CG PHE A 525 -15.721 12.141 27.592 1.00 32.19 C ATOM 255 CD1 PHE A 525 -16.134 12.380 26.286 1.00 36.62 C ATOM 256 CD2 PHE A 525 -16.370 12.792 28.631 1.00 34.90 C ATOM 257 CE1 PHE A 525 -17.184 13.242 26.025 1.00 34.09 C ATOM 258 CE2 PHE A 525 -17.417 13.671 28.373 1.00 40.01 C ATOM 259 CZ PHE A 525 -17.818 13.899 27.069 1.00 34.74 C ATOM 260 H PHE A 525 -12.893 11.600 25.732 1.00 0.00 H ATOM 261 N LEU A 526 -11.961 10.913 29.674 1.00 30.99 N ATOM 262 CA LEU A 526 -11.322 9.800 30.349 1.00 35.43 C ATOM 263 C LEU A 526 -12.414 8.763 30.562 1.00 35.25 C ATOM 264 O LEU A 526 -13.528 9.105 30.973 1.00 32.67 O ATOM 265 CB LEU A 526 -10.724 10.211 31.703 1.00 35.30 C ATOM 266 CG LEU A 526 -9.965 9.110 32.471 1.00 40.96 C ATOM 267 CD1 LEU A 526 -8.605 8.822 31.834 1.00 38.48 C ATOM 268 CD2 LEU A 526 -9.802 9.482 33.946 1.00 41.12 C ATOM 269 H LEU A 526 -12.247 11.745 30.229 1.00 0.00 H ATOM 270 N ALA A 527 -12.084 7.507 30.289 1.00 32.47 N ATOM 271 CA ALA A 527 -13.028 6.400 30.446 1.00 36.43 C ATOM 272 C ALA A 527 -12.342 5.150 30.973 1.00 33.38 C ATOM 273 O ALA A 527 -11.130 5.007 30.864 1.00 35.30 O ATOM 274 CB ALA A 527 -13.691 6.094 29.106 1.00 36.01 C ATOM 275 H ALA A 527 -11.122 7.302 29.952 1.00 0.00 H ATOM 276 N GLU A 528 -13.138 4.246 31.534 1.00 33.83 N ATOM 277 CA GLU A 528 -12.706 2.887 31.867 1.00 40.73 C ATOM 278 C GLU A 528 -13.081 2.014 30.695 1.00 40.42 C ATOM 279 O GLU A 528 -14.170 2.166 30.151 1.00 46.27 O ATOM 280 CB GLU A 528 -13.423 2.370 33.117 1.00 44.42 C ATOM 281 CG GLU A 528 -13.273 3.241 34.357 1.00 50.83 C ATOM 282 CD GLU A 528 -13.913 2.619 35.607 1.00 40.24 C ATOM 283 OE1 GLU A 528 -14.663 1.623 35.491 1.00 39.84 O ATOM 284 OE2 GLU A 528 -13.651 3.136 36.714 1.00 40.09 O ATOM 285 H GLU A 528 -14.119 4.518 31.748 1.00 0.00 H ATOM 286 N CYS A 529 -12.197 1.111 30.293 1.00 36.89 N ATOM 287 CA CYS A 529 -12.515 0.172 29.220 1.00 37.54 C ATOM 288 C CYS A 529 -12.293 -1.254 29.672 1.00 45.06 C ATOM 289 O CYS A 529 -11.183 -1.627 30.044 1.00 47.46 O ATOM 290 CB CYS A 529 -11.721 0.462 27.947 1.00 46.11 C ATOM 291 SG CYS A 529 -12.429 -0.351 26.490 1.00 48.03 S ATOM 292 H CYS A 529 -11.263 1.071 30.749 1.00 0.00 H ATOM 293 N HIS A 530 -13.362 -2.047 29.633 1.00 47.23 N ATOM 294 CA HIS A 530 -13.336 -3.434 30.088 1.00 42.46 C ATOM 295 C HIS A 530 -13.039 -4.401 28.971 1.00 47.01 C ATOM 296 O HIS A 530 -13.400 -4.163 27.824 1.00 49.32 O ATOM 297 CB HIS A 530 -14.670 -3.800 30.726 1.00 51.25 C ATOM 298 CG HIS A 530 -14.977 -2.989 31.939 1.00 52.88 C ATOM 299 ND1 HIS A 530 -15.472 -1.707 31.862 1.00 59.13 N ATOM 300 CD2 HIS A 530 -14.820 -3.254 33.257 1.00 63.11 C ATOM 301 CE1 HIS A 530 -15.632 -1.225 33.080 1.00 70.76 C ATOM 302 NE2 HIS A 530 -15.239 -2.143 33.945 1.00 66.42 N ATOM 303 H HIS A 530 -14.254 -1.662 29.262 1.00 0.00 H ATOM 304 N ASN A 531 -12.371 -5.495 29.333 1.00 49.02 N ATOM 305 CA ASN A 531 -12.059 -6.584 28.420 1.00 50.12 C ATOM 306 C ASN A 531 -11.241 -6.144 27.200 1.00 60.02 C ATOM 307 O ASN A 531 -11.330 -6.751 26.134 1.00 49.59 O ATOM 308 CB ASN A 531 -13.356 -7.297 27.979 1.00 63.92 C ATOM 309 CG ASN A 531 -14.188 -7.779 29.156 1.00 59.48 C ATOM 310 OD1 ASN A 531 -13.747 -8.645 29.915 1.00 68.46 O ATOM 311 ND2 ASN A 531 -15.395 -7.226 29.316 1.00 57.50 N ATOM 312 HD22 ASN A 531 -15.726 -6.498 28.651 1.00 0.00 H ATOM 313 HD21 ASN A 531 -16.003 -7.524 30.106 1.00 0.00 H ATOM 314 H ASN A 531 -12.056 -5.575 30.321 1.00 0.00 H ATOM 315 N LEU A 532 -10.432 -5.099 27.365 1.00 57.47 N ATOM 316 CA LEU A 532 -9.691 -4.538 26.252 1.00 52.34 C ATOM 317 C LEU A 532 -8.387 -5.288 26.066 1.00 50.68 C ATOM 318 O LEU A 532 -8.072 -5.704 24.954 1.00 60.19 O ATOM 319 CB LEU A 532 -9.416 -3.043 26.463 1.00 48.56 C ATOM 320 CG LEU A 532 -8.871 -2.307 25.230 1.00 47.69 C ATOM 321 CD1 LEU A 532 -9.819 -2.372 24.035 1.00 52.15 C ATOM 322 CD2 LEU A 532 -8.573 -0.856 25.567 1.00 44.31 C ATOM 323 H LEU A 532 -10.330 -4.677 28.310 1.00 0.00 H ATOM 324 N LEU A 533 -7.625 -5.431 27.150 1.00 55.90 N ATOM 325 CA LEU A 533 -6.347 -6.159 27.115 1.00 67.60 C ATOM 326 C LEU A 533 -6.334 -7.379 28.042 1.00 66.60 C ATOM 327 O LEU A 533 -6.900 -7.315 29.132 1.00 71.90 O ATOM 328 CB LEU A 533 -5.179 -5.223 27.463 1.00 59.14 C ATOM 329 CG LEU A 533 -4.819 -4.183 26.391 1.00 61.82 C ATOM 330 CD1 LEU A 533 -3.787 -3.202 26.923 1.00 57.58 C ATOM 331 CD2 LEU A 533 -4.296 -4.829 25.115 1.00 66.37 C ATOM 332 H LEU A 533 -7.944 -5.015 28.048 1.00 0.00 H ATOM 333 N PRO A 534 -5.676 -8.490 27.614 1.00 72.20 N ATOM 334 CA PRO A 534 -5.516 -9.674 28.486 1.00 77.71 C ATOM 335 C PRO A 534 -4.838 -9.393 29.834 1.00 83.10 C ATOM 336 O PRO A 534 -5.138 -10.070 30.818 1.00 84.82 O ATOM 337 CB PRO A 534 -4.626 -10.611 27.654 1.00 66.44 C ATOM 338 CG PRO A 534 -4.799 -10.178 26.246 1.00 68.50 C ATOM 339 CD PRO A 534 -5.045 -8.703 26.293 1.00 70.44 C ATOM 340 N GLU A 535 -3.928 -8.416 29.854 1.00 79.02 N ATOM 341 CA GLU A 535 -3.201 -8.016 31.061 1.00 87.71 C ATOM 342 C GLU A 535 -4.153 -7.489 32.127 1.00 84.81 C ATOM 343 O GLU A 535 -4.239 -8.042 33.228 1.00 80.76 O ATOM 344 CB GLU A 535 -2.145 -6.946 30.703 1.00 96.85 C ATOM 345 CG GLU A 535 -1.342 -6.364 31.871 1.00 94.47 C ATOM 346 CD GLU A 535 -0.569 -7.402 32.670 1.00 98.98 C ATOM 347 OE1 GLU A 535 -0.165 -8.442 32.101 1.00112.61 O ATOM 348 OE2 GLU A 535 -0.350 -7.163 33.877 1.00 91.67 O ATOM 349 H GLU A 535 -3.725 -7.913 28.967 1.00 0.00 H ATOM 350 N GLN A 536 -4.870 -6.424 31.776 1.00 89.08 N ATOM 351 CA GLN A 536 -5.783 -5.741 32.689 1.00 81.15 C ATOM 352 C GLN A 536 -7.221 -5.956 32.218 1.00 76.77 C ATOM 353 O GLN A 536 -7.565 -5.644 31.069 1.00 66.86 O ATOM 354 CB GLN A 536 -5.455 -4.248 32.753 1.00 73.75 C ATOM 355 CG GLN A 536 -4.043 -3.949 33.241 1.00 84.41 C ATOM 356 CD GLN A 536 -3.857 -2.512 33.722 1.00 90.69 C ATOM 357 OE1 GLN A 536 -4.545 -1.596 33.263 1.00 78.23 O ATOM 358 NE2 GLN A 536 -2.913 -2.308 34.649 1.00 84.13 N ATOM 359 HE22 GLN A 536 -2.356 -3.109 35.009 1.00 0.00 H ATOM 360 HE21 GLN A 536 -2.737 -1.348 35.009 1.00 0.00 H ATOM 361 H GLN A 536 -4.776 -6.061 30.806 1.00 0.00 H ATOM 362 N ASP A 537 -8.046 -6.517 33.097 1.00 71.04 N ATOM 363 CA ASP A 537 -9.488 -6.664 32.843 1.00 76.64 C ATOM 364 C ASP A 537 -10.207 -5.304 32.748 1.00 79.16 C ATOM 365 O ASP A 537 -11.214 -5.180 32.041 1.00 70.47 O ATOM 366 CB ASP A 537 -10.150 -7.564 33.909 1.00 83.28 C ATOM 367 CG ASP A 537 -10.091 -6.973 35.319 1.00 88.53 C ATOM 368 OD1 ASP A 537 -9.114 -6.257 35.635 1.00 94.43 O ATOM 369 OD2 ASP A 537 -11.019 -7.241 36.117 1.00 87.11 O ATOM 370 H ASP A 537 -7.658 -6.865 33.997 1.00 0.00 H ATOM 371 N LYS A 538 -9.683 -4.312 33.476 1.00 67.44 N ATOM 372 CA LYS A 538 -10.141 -2.922 33.435 1.00 59.79 C ATOM 373 C LYS A 538 -8.919 -2.003 33.323 1.00 69.78 C ATOM 374 O LYS A 538 -7.905 -2.231 33.985 1.00 71.44 O ATOM 375 CB LYS A 538 -10.940 -2.584 34.704 1.00 58.29 C ATOM 376 CG LYS A 538 -11.223 -1.097 34.920 1.00 61.73 C ATOM 377 CD LYS A 538 -12.271 -0.858 35.998 1.00 69.98 C ATOM 378 CE LYS A 538 -11.816 -1.270 37.365 1.00 48.70 C ATOM 379 NZ LYS A 538 -12.810 -0.881 38.401 1.00 47.31 N ATOM 380 HZ1 LYS A 538 -12.936 0.151 38.389 1.00 0.00 H ATOM 381 HZ2 LYS A 538 -13.719 -1.344 38.199 1.00 0.00 H ATOM 382 HZ3 LYS A 538 -12.468 -1.179 39.337 1.00 0.00 H ATOM 383 H LYS A 538 -8.896 -4.544 34.115 1.00 0.00 H ATOM 384 N MET A 539 -9.038 -0.953 32.509 1.00 54.88 N ATOM 385 CA MET A 539 -7.971 0.018 32.329 1.00 44.54 C ATOM 386 C MET A 539 -8.514 1.369 31.894 1.00 44.00 C ATOM 387 O MET A 539 -9.594 1.454 31.307 1.00 45.10 O ATOM 388 CB MET A 539 -6.972 -0.484 31.291 1.00 50.30 C ATOM 389 CG MET A 539 -7.538 -0.602 29.886 1.00 46.65 C ATOM 390 SD MET A 539 -6.329 -1.269 28.744 1.00 54.66 S ATOM 391 CE MET A 539 -5.197 0.096 28.563 1.00 48.71 C ATOM 392 H MET A 539 -9.926 -0.824 31.984 1.00 0.00 H ATOM 393 N LEU A 540 -7.744 2.416 32.165 1.00 38.00 N ATOM 394 CA LEU A 540 -8.112 3.759 31.758 1.00 39.58 C ATOM 395 C LEU A 540 -7.730 4.022 30.308 1.00 35.20 C ATOM 396 O LEU A 540 -6.657 3.630 29.860 1.00 36.89 O ATOM 397 CB LEU A 540 -7.480 4.793 32.674 1.00 40.48 C ATOM 398 CG LEU A 540 -7.976 4.782 34.124 1.00 45.57 C ATOM 399 CD1 LEU A 540 -7.100 5.713 34.943 1.00 47.75 C ATOM 400 CD2 LEU A 540 -9.436 5.187 34.263 1.00 40.83 C ATOM 401 H LEU A 540 -6.854 2.270 32.683 1.00 0.00 H ATOM 402 N VAL A 541 -8.635 4.685 29.590 1.00 32.10 N ATOM 403 CA VAL A 541 -8.446 5.074 28.199 1.00 35.31 C ATOM 404 C VAL A 541 -8.948 6.492 28.000 1.00 27.47 C ATOM 405 O VAL A 541 -9.669 7.023 28.831 1.00 29.45 O ATOM 406 CB VAL A 541 -9.215 4.150 27.210 1.00 34.36 C ATOM 407 CG1 VAL A 541 -8.647 2.738 27.227 1.00 39.34 C ATOM 408 CG2 VAL A 541 -10.712 4.130 27.517 1.00 35.50 C ATOM 409 H VAL A 541 -9.532 4.941 30.051 1.00 0.00 H ATOM 410 N ALA A 542 -8.589 7.065 26.855 1.00 31.43 N ATOM 411 CA ALA A 542 -9.073 8.371 26.424 1.00 37.18 C ATOM 412 C ALA A 542 -10.016 8.144 25.248 1.00 37.74 C ATOM 413 O ALA A 542 -9.653 7.471 24.286 1.00 36.95 O ATOM 414 CB ALA A 542 -7.904 9.258 26.021 1.00 40.17 C ATOM 415 H ALA A 542 -7.928 6.555 26.234 1.00 0.00 H ATOM 416 N VAL A 543 -11.230 8.684 25.337 1.00 35.85 N ATOM 417 CA VAL A 543 -12.272 8.433 24.343 1.00 38.96 C ATOM 418 C VAL A 543 -12.592 9.723 23.610 1.00 29.32 C ATOM 419 O VAL A 543 -12.980 10.688 24.236 1.00 33.35 O ATOM 420 CB VAL A 543 -13.541 7.841 25.007 1.00 37.24 C ATOM 421 CG1 VAL A 543 -14.663 7.657 23.999 1.00 44.09 C ATOM 422 CG2 VAL A 543 -13.209 6.485 25.608 1.00 38.45 C ATOM 423 H VAL A 543 -11.444 9.306 26.142 1.00 0.00 H ATOM 424 N LYS A 544 -12.443 9.730 22.287 1.00 33.73 N ATOM 425 CA LYS A 544 -12.815 10.897 21.473 1.00 35.10 C ATOM 426 C LYS A 544 -14.178 10.664 20.856 1.00 39.43 C ATOM 427 O LYS A 544 -14.359 9.716 20.081 1.00 37.15 O ATOM 428 CB LYS A 544 -11.811 11.181 20.362 1.00 42.80 C ATOM 429 CG LYS A 544 -12.028 12.531 19.672 1.00 45.58 C ATOM 430 CD LYS A 544 -11.155 12.682 18.436 1.00 47.83 C ATOM 431 CE LYS A 544 -11.259 14.084 17.844 1.00 57.73 C ATOM 432 NZ LYS A 544 -10.703 14.159 16.474 1.00 43.19 N ATOM 433 HZ1 LYS A 544 -9.698 13.891 16.494 1.00 0.00 H ATOM 434 HZ2 LYS A 544 -11.225 13.508 15.853 1.00 0.00 H ATOM 435 HZ3 LYS A 544 -10.797 15.131 16.116 1.00 0.00 H ATOM 436 H LYS A 544 -12.053 8.888 21.817 1.00 0.00 H ATOM 437 N ALA A 545 -15.117 11.547 21.198 1.00 39.39 N ATOM 438 CA ALA A 545 -16.478 11.501 20.687 1.00 45.57 C ATOM 439 C ALA A 545 -16.605 12.516 19.563 1.00 43.77 C ATOM 440 O ALA A 545 -16.317 13.706 19.741 1.00 44.39 O ATOM 441 CB ALA A 545 -17.475 11.813 21.796 1.00 46.13 C ATOM 442 H ALA A 545 -14.864 12.306 21.863 1.00 0.00 H ATOM 443 N LEU A 546 -17.038 12.032 18.407 1.00 44.66 N ATOM 444 CA LEU A 546 -17.205 12.856 17.219 1.00 54.67 C ATOM 445 C LEU A 546 -18.392 13.815 17.355 1.00 54.96 C ATOM 446 O LEU A 546 -19.463 13.429 17.837 1.00 51.70 O ATOM 447 CB LEU A 546 -17.396 11.950 15.993 1.00 52.34 C ATOM 448 CG LEU A 546 -17.645 12.612 14.634 1.00 62.26 C ATOM 449 CD1 LEU A 546 -16.471 13.497 14.235 1.00 64.73 C ATOM 450 CD2 LEU A 546 -17.902 11.547 13.582 1.00 61.74 C ATOM 451 H LEU A 546 -17.268 11.020 18.347 1.00 0.00 H ATOM 452 N LYS A 547 -18.173 15.060 16.933 1.00 60.70 N ATOM 453 CA LYS A 547 -19.235 16.055 16.770 1.00 71.07 C ATOM 454 C LYS A 547 -19.614 16.082 15.297 1.00 71.61 C ATOM 455 O LYS A 547 -19.031 16.850 14.527 1.00 76.81 O ATOM 456 CB LYS A 547 -18.738 17.444 17.174 1.00 72.16 C ATOM 457 CG LYS A 547 -18.760 17.721 18.658 1.00 74.83 C ATOM 458 CD LYS A 547 -18.177 19.098 18.935 1.00 71.27 C ATOM 459 CE LYS A 547 -17.863 19.272 20.405 1.00 71.56 C ATOM 460 NZ LYS A 547 -17.026 20.473 20.628 1.00 74.17 N ATOM 461 HZ1 LYS A 547 -16.133 20.374 20.104 1.00 0.00 H ATOM 462 HZ2 LYS A 547 -17.535 21.316 20.292 1.00 0.00 H ATOM 463 HZ3 LYS A 547 -16.825 20.570 21.644 1.00 0.00 H ATOM 464 H LYS A 547 -17.197 15.340 16.708 1.00 0.00 H ATOM 465 N GLU A 548 -20.561 15.234 14.898 1.00 77.84 N ATOM 466 CA GLU A 548 -20.982 15.173 13.488 1.00 82.94 C ATOM 467 C GLU A 548 -22.021 16.259 13.204 1.00 81.43 C ATOM 468 O GLU A 548 -22.691 16.242 12.171 1.00 87.09 O ATOM 469 CB GLU A 548 -21.474 13.765 13.091 1.00 74.71 C ATOM 470 CG GLU A 548 -22.896 13.376 13.493 1.00 82.09 C ATOM 471 CD GLU A 548 -23.395 12.218 12.642 1.00 62.42 C ATOM 472 OE1 GLU A 548 -22.713 11.173 12.620 1.00 62.48 O ATOM 473 OE2 GLU A 548 -24.473 12.341 12.022 1.00 61.20 O ATOM 474 H GLU A 548 -21.010 14.605 15.594 1.00 0.00 H TER 475 GLU A 548 ATOM 476 N SER A 552 -21.301 13.379 6.807 1.00 79.00 N ATOM 477 CA SER A 552 -20.047 13.855 6.214 1.00 68.52 C ATOM 478 C SER A 552 -18.805 13.502 7.045 1.00 73.59 C ATOM 479 O SER A 552 -17.828 12.958 6.520 1.00 80.05 O ATOM 480 CB SER A 552 -20.112 15.370 6.016 1.00 71.58 C ATOM 481 OG SER A 552 -19.004 15.831 5.256 1.00 65.85 O ATOM 482 HG SER A 552 -19.069 16.812 5.142 1.00 0.00 H ATOM 483 HN3 SER A 552 -21.423 13.806 7.747 1.00 0.00 H ATOM 484 HN2 SER A 552 -21.269 12.343 6.897 1.00 0.00 H ATOM 485 HN1 SER A 552 -22.097 13.651 6.196 1.00 0.00 H ATOM 486 N ALA A 553 -18.848 13.841 8.331 1.00 79.20 N ATOM 487 CA ALA A 553 -17.732 13.607 9.258 1.00 70.11 C ATOM 488 C ALA A 553 -17.416 12.125 9.529 1.00 72.57 C ATOM 489 O ALA A 553 -16.293 11.802 9.948 1.00 62.44 O ATOM 490 CB ALA A 553 -17.989 14.330 10.571 1.00 62.81 C ATOM 491 H ALA A 553 -19.711 14.292 8.697 1.00 0.00 H ATOM 492 N ARG A 554 -18.395 11.244 9.299 1.00 58.12 N ATOM 493 CA ARG A 554 -18.223 9.792 9.466 1.00 59.83 C ATOM 494 C ARG A 554 -17.172 9.210 8.519 1.00 68.10 C ATOM 495 O ARG A 554 -16.497 8.229 8.861 1.00 71.83 O ATOM 496 CB ARG A 554 -19.561 9.067 9.256 1.00 67.19 C ATOM 497 CG ARG A 554 -19.533 7.571 9.555 1.00 66.64 C ATOM 498 CD ARG A 554 -20.839 6.870 9.255 1.00 46.90 C ATOM 499 NE ARG A 554 -20.747 5.420 9.421 1.00 44.00 N ATOM 500 CZ ARG A 554 -21.792 4.599 9.489 1.00 41.84 C ATOM 501 NH1 ARG A 554 -23.029 5.074 9.412 1.00 41.36 N ATOM 502 NH2 ARG A 554 -21.598 3.294 9.640 1.00 41.19 N ATOM 503 HE ARG A 554 -19.798 5.001 9.491 1.00 0.00 H ATOM 504 HH12 ARG A 554 -23.840 4.425 9.466 1.00 0.00 H ATOM 505 HH11 ARG A 554 -23.188 6.095 9.298 1.00 0.00 H ATOM 506 HH22 ARG A 554 -22.413 2.650 9.693 1.00 0.00 H ATOM 507 HH21 ARG A 554 -20.631 2.916 9.705 1.00 0.00 H ATOM 508 H ARG A 554 -19.321 11.601 8.988 1.00 0.00 H ATOM 509 N GLN A 555 -17.064 9.802 7.326 1.00 62.62 N ATOM 510 CA GLN A 555 -16.064 9.412 6.338 1.00 57.01 C ATOM 511 C GLN A 555 -14.659 9.732 6.849 1.00 54.10 C ATOM 512 O GLN A 555 -13.770 8.872 6.829 1.00 63.74 O ATOM 513 CB GLN A 555 -16.323 10.145 5.016 1.00 64.88 C ATOM 514 CG GLN A 555 -17.616 9.703 4.316 1.00 45.92 C ATOM 515 CD GLN A 555 -17.906 10.462 3.029 1.00 44.37 C ATOM 516 OE1 GLN A 555 -17.450 11.590 2.837 1.00 44.02 O ATOM 517 NE2 GLN A 555 -18.681 9.845 2.143 1.00 43.11 N ATOM 518 HE22 GLN A 555 -19.045 8.892 2.345 1.00 0.00 H ATOM 519 HE21 GLN A 555 -18.923 10.315 1.248 1.00 0.00 H ATOM 520 H GLN A 555 -17.721 10.574 7.092 1.00 0.00 H ATOM 521 N ASP A 556 -14.482 10.969 7.303 1.00 49.89 N ATOM 522 CA ASP A 556 -13.213 11.440 7.890 1.00 55.01 C ATOM 523 C ASP A 556 -12.846 10.619 9.114 1.00 55.48 C ATOM 524 O ASP A 556 -11.700 10.179 9.273 1.00 51.68 O ATOM 525 CB ASP A 556 -13.327 12.908 8.306 1.00 63.00 C ATOM 526 CG ASP A 556 -13.494 13.838 7.127 1.00 72.25 C ATOM 527 OD1 ASP A 556 -12.732 13.708 6.138 1.00 75.31 O ATOM 528 OD2 ASP A 556 -14.394 14.702 7.192 1.00 85.36 O ATOM 529 H ASP A 556 -15.277 11.637 7.241 1.00 0.00 H ATOM 530 N PHE A 557 -13.848 10.423 9.967 1.00 59.71 N ATOM 531 CA PHE A 557 -13.762 9.537 11.129 1.00 54.87 C ATOM 532 C PHE A 557 -13.257 8.130 10.776 1.00 58.94 C ATOM 533 O PHE A 557 -12.262 7.649 11.354 1.00 50.36 O ATOM 534 CB PHE A 557 -15.142 9.475 11.774 1.00 63.94 C ATOM 535 CG PHE A 557 -15.204 8.646 13.008 1.00 65.47 C ATOM 536 CD1 PHE A 557 -14.964 9.215 14.257 1.00 59.34 C ATOM 537 CD2 PHE A 557 -15.517 7.293 12.923 1.00 53.87 C ATOM 538 CE1 PHE A 557 -15.029 8.440 15.404 1.00 71.60 C ATOM 539 CE2 PHE A 557 -15.580 6.517 14.060 1.00 68.29 C ATOM 540 CZ PHE A 557 -15.336 7.085 15.304 1.00 62.22 C ATOM 541 H PHE A 557 -14.742 10.927 9.799 1.00 0.00 H ATOM 542 N GLN A 558 -13.930 7.482 9.826 1.00 52.42 N ATOM 543 CA GLN A 558 -13.549 6.125 9.406 1.00 52.57 C ATOM 544 C GLN A 558 -12.195 6.086 8.682 1.00 53.90 C ATOM 545 O GLN A 558 -11.416 5.151 8.876 1.00 56.39 O ATOM 546 CB GLN A 558 -14.639 5.485 8.537 1.00 62.42 C ATOM 547 CG GLN A 558 -14.400 4.005 8.251 1.00 68.84 C ATOM 548 CD GLN A 558 -15.437 3.258 7.517 1.00 49.52 C ATOM 549 OE1 GLN A 558 -16.527 3.789 7.303 1.00 48.94 O ATOM 550 NE2 GLN A 558 -15.156 2.015 7.129 1.00 48.33 N ATOM 551 HE22 GLN A 558 -14.221 1.606 7.331 1.00 0.00 H ATOM 552 HE21 GLN A 558 -15.871 1.454 6.624 1.00 0.00 H ATOM 553 H GLN A 558 -14.742 7.946 9.372 1.00 0.00 H ATOM 554 N ARG A 559 -11.926 7.088 7.845 1.00 50.30 N ATOM 555 CA ARG A 559 -10.605 7.252 7.222 1.00 50.14 C ATOM 556 C ARG A 559 -9.500 7.411 8.279 1.00 44.40 C ATOM 557 O ARG A 559 -8.436 6.785 8.178 1.00 43.02 O ATOM 558 CB ARG A 559 -10.615 8.466 6.278 1.00 55.35 C ATOM 559 CG ARG A 559 -9.325 8.704 5.498 1.00 57.47 C ATOM 560 CD ARG A 559 -9.371 9.943 4.643 1.00 40.84 C ATOM 561 NE ARG A 559 -8.114 10.175 3.937 1.00 38.69 N ATOM 562 CZ ARG A 559 -7.902 11.189 3.105 1.00 36.94 C ATOM 563 NH1 ARG A 559 -8.863 12.070 2.872 1.00 36.55 N ATOM 564 NH2 ARG A 559 -6.726 11.323 2.506 1.00 36.33 N ATOM 565 HE ARG A 559 -7.335 9.504 4.095 1.00 0.00 H ATOM 566 HH12 ARG A 559 -8.695 12.863 2.220 1.00 0.00 H ATOM 567 HH11 ARG A 559 -9.786 11.969 3.341 1.00 0.00 H ATOM 568 HH22 ARG A 559 -6.562 12.117 1.855 1.00 0.00 H ATOM 569 HH21 ARG A 559 -5.969 10.634 2.687 1.00 0.00 H ATOM 570 H ARG A 559 -12.675 7.776 7.626 1.00 0.00 H ATOM 571 N GLU A 560 -9.760 8.250 9.284 1.00 43.76 N ATOM 572 CA GLU A 560 -8.798 8.486 10.372 1.00 46.40 C ATOM 573 C GLU A 560 -8.522 7.200 11.158 1.00 42.12 C ATOM 574 O GLU A 560 -7.369 6.912 11.506 1.00 37.33 O ATOM 575 CB GLU A 560 -9.276 9.618 11.302 1.00 46.58 C ATOM 576 CG GLU A 560 -8.243 10.009 12.351 1.00 54.53 C ATOM 577 CD GLU A 560 -8.664 11.167 13.236 1.00 65.63 C ATOM 578 OE1 GLU A 560 -9.850 11.567 13.211 1.00 67.43 O ATOM 579 OE2 GLU A 560 -7.789 11.673 13.975 1.00 57.32 O ATOM 580 H GLU A 560 -10.671 8.752 9.298 1.00 0.00 H ATOM 581 N ALA A 561 -9.576 6.424 11.406 1.00 41.94 N ATOM 582 CA ALA A 561 -9.470 5.137 12.109 1.00 41.52 C ATOM 583 C ALA A 561 -8.614 4.122 11.347 1.00 42.65 C ATOM 584 O ALA A 561 -7.791 3.434 11.940 1.00 40.04 O ATOM 585 CB ALA A 561 -10.856 4.560 12.354 1.00 43.07 C ATOM 586 H ALA A 561 -10.514 6.742 11.089 1.00 0.00 H ATOM 587 N GLU A 562 -8.825 4.034 10.036 1.00 43.53 N ATOM 588 CA GLU A 562 -8.048 3.136 9.176 1.00 46.02 C ATOM 589 C GLU A 562 -6.573 3.520 9.158 1.00 42.00 C ATOM 590 O GLU A 562 -5.703 2.655 9.262 1.00 43.43 O ATOM 591 CB GLU A 562 -8.606 3.149 7.757 1.00 48.18 C ATOM 592 CG GLU A 562 -9.946 2.438 7.632 1.00 63.15 C ATOM 593 CD GLU A 562 -10.651 2.693 6.310 1.00 71.62 C ATOM 594 OE1 GLU A 562 -9.987 3.125 5.336 1.00 65.59 O ATOM 595 OE2 GLU A 562 -11.880 2.452 6.254 1.00 69.74 O ATOM 596 H GLU A 562 -9.567 4.623 9.606 1.00 0.00 H ATOM 597 N LEU A 563 -6.318 4.822 9.062 1.00 42.20 N ATOM 598 CA LEU A 563 -4.967 5.373 9.084 1.00 35.94 C ATOM 599 C LEU A 563 -4.266 5.109 10.409 1.00 41.89 C ATOM 600 O LEU A 563 -3.147 4.604 10.436 1.00 39.98 O ATOM 601 CB LEU A 563 -5.025 6.878 8.801 1.00 41.90 C ATOM 602 CG LEU A 563 -3.709 7.655 8.666 1.00 51.20 C ATOM 603 CD1 LEU A 563 -2.864 7.140 7.508 1.00 47.57 C ATOM 604 CD2 LEU A 563 -4.006 9.140 8.495 1.00 56.67 C ATOM 605 H LEU A 563 -7.119 5.478 8.967 1.00 0.00 H ATOM 606 N LEU A 564 -4.934 5.443 11.511 1.00 45.84 N ATOM 607 CA LEU A 564 -4.387 5.189 12.850 1.00 41.96 C ATOM 608 C LEU A 564 -4.045 3.719 13.117 1.00 41.45 C ATOM 609 O LEU A 564 -3.023 3.418 13.740 1.00 44.08 O ATOM 610 CB LEU A 564 -5.353 5.688 13.921 1.00 42.76 C ATOM 611 CG LEU A 564 -5.277 7.185 14.210 1.00 45.51 C ATOM 612 CD1 LEU A 564 -6.542 7.618 14.921 1.00 43.88 C ATOM 613 CD2 LEU A 564 -4.051 7.521 15.046 1.00 46.13 C ATOM 614 H LEU A 564 -5.866 5.895 11.421 1.00 0.00 H ATOM 615 N THR A 565 -4.904 2.816 12.659 1.00 41.96 N ATOM 616 CA THR A 565 -4.643 1.366 12.766 1.00 43.31 C ATOM 617 C THR A 565 -3.373 0.942 12.010 1.00 39.23 C ATOM 618 O THR A 565 -2.635 0.074 12.480 1.00 55.51 O ATOM 619 CB THR A 565 -5.838 0.547 12.248 1.00 49.95 C ATOM 620 OG1 THR A 565 -7.038 1.010 12.878 1.00 46.42 O ATOM 621 CG2 THR A 565 -5.661 -0.949 12.539 1.00 56.04 C ATOM 622 HG1 THR A 565 -7.174 1.967 12.664 1.00 0.00 H ATOM 623 H THR A 565 -5.786 3.139 12.212 1.00 0.00 H ATOM 624 N MET A 566 -3.139 1.542 10.844 1.00 51.13 N ATOM 625 CA MET A 566 -1.931 1.281 10.032 1.00 48.36 C ATOM 626 C MET A 566 -0.650 1.795 10.691 1.00 53.17 C ATOM 627 O MET A 566 0.384 1.108 10.699 1.00 44.50 O ATOM 628 CB MET A 566 -2.065 1.943 8.652 1.00 52.32 C ATOM 629 CG MET A 566 -3.054 1.274 7.711 1.00 55.95 C ATOM 630 SD MET A 566 -3.221 2.209 6.147 1.00 41.59 S ATOM 631 CE MET A 566 -1.568 2.152 5.450 1.00 40.59 C ATOM 632 H MET A 566 -3.838 2.225 10.488 1.00 0.00 H ATOM 633 N LEU A 567 -0.728 2.996 11.265 1.00 49.25 N ATOM 634 CA LEU A 567 0.452 3.705 11.767 1.00 49.67 C ATOM 635 C LEU A 567 0.939 3.264 13.147 1.00 51.33 C ATOM 636 O LEU A 567 1.842 3.895 13.701 1.00 58.15 O ATOM 637 CB LEU A 567 0.185 5.225 11.771 1.00 42.39 C ATOM 638 CG LEU A 567 -0.100 5.883 10.418 1.00 46.95 C ATOM 639 CD1 LEU A 567 -0.490 7.339 10.603 1.00 48.88 C ATOM 640 CD2 LEU A 567 1.082 5.775 9.463 1.00 47.70 C ATOM 641 H LEU A 567 -1.661 3.446 11.360 1.00 0.00 H ATOM 642 N GLN A 568 0.388 2.184 13.696 1.00 48.88 N ATOM 643 CA GLN A 568 0.682 1.795 15.075 1.00 45.62 C ATOM 644 C GLN A 568 2.137 1.364 15.299 1.00 45.75 C ATOM 645 O GLN A 568 2.647 0.507 14.600 1.00 51.56 O ATOM 646 CB GLN A 568 -0.282 0.694 15.553 1.00 45.03 C ATOM 647 CG GLN A 568 -1.737 1.135 15.692 1.00 45.31 C ATOM 648 CD GLN A 568 -1.908 2.279 16.690 1.00 44.06 C ATOM 649 OE1 GLN A 568 -1.924 2.050 17.890 1.00 42.57 O ATOM 650 NE2 GLN A 568 -2.004 3.512 16.198 1.00 47.75 N ATOM 651 HE22 GLN A 568 -1.986 3.664 15.169 1.00 0.00 H ATOM 652 HE21 GLN A 568 -2.097 4.323 16.842 1.00 0.00 H ATOM 653 H GLN A 568 -0.266 1.604 13.132 1.00 0.00 H ATOM 654 N HIS A 569 2.778 1.973 16.299 1.00 49.01 N ATOM 655 CA HIS A 569 4.208 1.784 16.580 1.00 43.73 C ATOM 656 C HIS A 569 4.586 2.404 17.930 1.00 46.62 C ATOM 657 O HIS A 569 3.844 3.236 18.458 1.00 47.21 O ATOM 658 CB HIS A 569 5.050 2.419 15.471 1.00 56.31 C ATOM 659 CG HIS A 569 6.357 1.732 15.240 1.00 60.72 C ATOM 660 ND1 HIS A 569 7.565 2.317 15.548 1.00 62.71 N ATOM 661 CD2 HIS A 569 6.646 0.505 14.744 1.00 62.52 C ATOM 662 CE1 HIS A 569 8.544 1.482 15.246 1.00 71.57 C ATOM 663 NE2 HIS A 569 8.013 0.376 14.754 1.00 63.38 N ATOM 664 H HIS A 569 2.237 2.615 16.912 1.00 0.00 H ATOM 665 N GLN A 570 5.761 2.029 18.446 1.00 43.25 N ATOM 666 CA GLN A 570 6.253 2.421 19.793 1.00 47.07 C ATOM 667 C GLN A 570 6.153 3.915 20.171 1.00 47.55 C ATOM 668 O GLN A 570 5.897 4.250 21.340 1.00 52.99 O ATOM 669 CB GLN A 570 7.713 1.958 19.964 1.00 48.04 C ATOM 670 CG GLN A 570 8.265 2.071 21.381 1.00 46.91 C ATOM 671 CD GLN A 570 9.654 1.463 21.573 1.00 36.93 C ATOM 672 OE1 GLN A 570 10.353 1.164 20.604 1.00 36.51 O ATOM 673 NE2 GLN A 570 10.051 1.267 22.829 1.00 36.14 N ATOM 674 HE22 GLN A 570 9.429 1.534 23.619 1.00 0.00 H ATOM 675 HE21 GLN A 570 10.983 0.847 23.020 1.00 0.00 H ATOM 676 H GLN A 570 6.373 1.421 17.865 1.00 0.00 H ATOM 677 N HIS A 571 6.384 4.795 19.203 1.00 42.51 N ATOM 678 CA HIS A 571 6.350 6.251 19.435 1.00 42.19 C ATOM 679 C HIS A 571 5.299 6.997 18.619 1.00 35.74 C ATOM 680 O HIS A 571 5.417 8.198 18.369 1.00 33.88 O ATOM 681 CB HIS A 571 7.748 6.814 19.233 1.00 42.64 C ATOM 682 CG HIS A 571 8.725 6.259 20.210 1.00 38.62 C ATOM 683 ND1 HIS A 571 8.677 6.571 21.554 1.00 46.27 N ATOM 684 CD2 HIS A 571 9.712 5.344 20.066 1.00 47.16 C ATOM 685 CE1 HIS A 571 9.630 5.909 22.187 1.00 44.42 C ATOM 686 NE2 HIS A 571 10.276 5.164 21.307 1.00 39.41 N ATOM 687 H HIS A 571 6.596 4.445 18.247 1.00 0.00 H ATOM 688 N ILE A 572 4.269 6.263 18.214 1.00 36.25 N ATOM 689 CA ILE A 572 3.072 6.821 17.594 1.00 39.43 C ATOM 690 C ILE A 572 1.964 6.547 18.611 1.00 37.34 C ATOM 691 O ILE A 572 2.011 5.521 19.308 1.00 31.58 O ATOM 692 CB ILE A 572 2.761 6.151 16.232 1.00 42.60 C ATOM 693 CG1 ILE A 572 3.934 6.321 15.239 1.00 43.48 C ATOM 694 CG2 ILE A 572 1.465 6.689 15.642 1.00 39.79 C ATOM 695 CD1 ILE A 572 4.255 7.749 14.819 1.00 44.53 C ATOM 696 H ILE A 572 4.318 5.233 18.346 1.00 0.00 H ATOM 697 N VAL A 573 0.982 7.451 18.688 1.00 34.36 N ATOM 698 CA VAL A 573 -0.119 7.341 19.659 1.00 38.94 C ATOM 699 C VAL A 573 -0.871 6.013 19.510 1.00 38.81 C ATOM 700 O VAL A 573 -1.228 5.615 18.392 1.00 33.79 O ATOM 701 CB VAL A 573 -1.124 8.507 19.531 1.00 41.23 C ATOM 702 CG1 VAL A 573 -1.654 8.620 18.109 1.00 42.00 C ATOM 703 CG2 VAL A 573 -2.267 8.328 20.514 1.00 44.05 C ATOM 704 H VAL A 573 0.996 8.262 18.038 1.00 0.00 H ATOM 705 N ARG A 574 -1.080 5.329 20.635 1.00 34.51 N ATOM 706 CA ARG A 574 -1.711 4.012 20.627 1.00 42.08 C ATOM 707 C ARG A 574 -3.231 4.148 20.508 1.00 40.53 C ATOM 708 O ARG A 574 -3.886 4.775 21.349 1.00 34.99 O ATOM 709 CB ARG A 574 -1.325 3.192 21.856 1.00 43.62 C ATOM 710 CG ARG A 574 -1.620 1.718 21.658 1.00 48.61 C ATOM 711 CD ARG A 574 -1.091 0.844 22.776 1.00 54.01 C ATOM 712 NE ARG A 574 -1.412 -0.560 22.502 1.00 71.22 N ATOM 713 CZ ARG A 574 -1.254 -1.573 23.356 1.00 69.33 C ATOM 714 NH1 ARG A 574 -0.763 -1.373 24.580 1.00 73.78 N ATOM 715 NH2 ARG A 574 -1.588 -2.804 22.979 1.00 59.67 N ATOM 716 HE ARG A 574 -1.796 -0.786 21.562 1.00 0.00 H ATOM 717 HH12 ARG A 574 -0.647 -2.175 25.231 1.00 0.00 H ATOM 718 HH11 ARG A 574 -0.496 -0.415 24.883 1.00 0.00 H ATOM 719 HH22 ARG A 574 -1.468 -3.600 23.638 1.00 0.00 H ATOM 720 HH21 ARG A 574 -1.969 -2.971 22.026 1.00 0.00 H ATOM 721 H ARG A 574 -0.786 5.744 21.542 1.00 0.00 H ATOM 722 N PHE A 575 -3.758 3.562 19.435 1.00 39.50 N ATOM 723 CA PHE A 575 -5.167 3.608 19.067 1.00 44.35 C ATOM 724 C PHE A 575 -5.702 2.189 19.233 1.00 41.67 C ATOM 725 O PHE A 575 -5.150 1.251 18.659 1.00 40.18 O ATOM 726 CB PHE A 575 -5.292 4.097 17.617 1.00 39.10 C ATOM 727 CG PHE A 575 -6.689 4.047 17.058 1.00 39.26 C ATOM 728 CD1 PHE A 575 -7.704 4.841 17.594 1.00 42.12 C ATOM 729 CD2 PHE A 575 -6.996 3.213 15.985 1.00 41.15 C ATOM 730 CE1 PHE A 575 -8.992 4.804 17.072 1.00 44.85 C ATOM 731 CE2 PHE A 575 -8.281 3.175 15.464 1.00 40.59 C ATOM 732 CZ PHE A 575 -9.283 3.968 16.005 1.00 38.60 C ATOM 733 H PHE A 575 -3.116 3.031 18.813 1.00 0.00 H ATOM 734 N PHE A 576 -6.744 2.033 20.042 1.00 38.08 N ATOM 735 CA PHE A 576 -7.299 0.705 20.357 1.00 39.77 C ATOM 736 C PHE A 576 -8.418 0.278 19.425 1.00 39.35 C ATOM 737 O PHE A 576 -8.585 -0.905 19.149 1.00 41.79 O ATOM 738 CB PHE A 576 -7.793 0.658 21.799 1.00 41.48 C ATOM 739 CG PHE A 576 -6.691 0.648 22.812 1.00 36.66 C ATOM 740 CD1 PHE A 576 -5.768 -0.396 22.844 1.00 44.82 C ATOM 741 CD2 PHE A 576 -6.585 1.656 23.749 1.00 36.66 C ATOM 742 CE1 PHE A 576 -4.754 -0.416 23.789 1.00 43.43 C ATOM 743 CE2 PHE A 576 -5.577 1.641 24.694 1.00 40.23 C ATOM 744 CZ PHE A 576 -4.657 0.609 24.716 1.00 42.77 C ATOM 745 H PHE A 576 -7.182 2.875 20.467 1.00 0.00 H ATOM 746 N GLY A 577 -9.202 1.234 18.965 1.00 32.14 N ATOM 747 CA GLY A 577 -10.228 0.960 17.993 1.00 39.32 C ATOM 748 C GLY A 577 -11.391 1.898 18.140 1.00 39.27 C ATOM 749 O GLY A 577 -11.286 2.960 18.764 1.00 39.74 O ATOM 750 H GLY A 577 -9.076 2.206 19.312 1.00 0.00 H ATOM 751 N VAL A 578 -12.512 1.475 17.576 1.00 32.09 N ATOM 752 CA VAL A 578 -13.667 2.319 17.399 1.00 32.66 C ATOM 753 C VAL A 578 -14.887 1.687 18.061 1.00 37.77 C ATOM 754 O VAL A 578 -14.930 0.474 18.253 1.00 40.41 O ATOM 755 CB VAL A 578 -13.891 2.549 15.888 1.00 41.98 C ATOM 756 CG1 VAL A 578 -14.527 1.344 15.196 1.00 44.05 C ATOM 757 CG2 VAL A 578 -14.715 3.781 15.650 1.00 54.41 C ATOM 758 H VAL A 578 -12.561 0.490 17.246 1.00 0.00 H ATOM 759 N CYS A 579 -15.867 2.512 18.413 1.00 42.04 N ATOM 760 CA CYS A 579 -17.204 2.032 18.802 1.00 40.63 C ATOM 761 C CYS A 579 -18.231 2.686 17.887 1.00 42.46 C ATOM 762 O CYS A 579 -18.514 3.880 18.015 1.00 47.80 O ATOM 763 CB CYS A 579 -17.512 2.350 20.260 1.00 44.05 C ATOM 764 SG CYS A 579 -19.151 1.786 20.792 1.00 48.80 S ATOM 765 H CYS A 579 -15.683 3.536 18.414 1.00 0.00 H ATOM 766 N THR A 580 -18.754 1.903 16.946 1.00 42.50 N ATOM 767 CA THR A 580 -19.732 2.370 15.949 1.00 47.72 C ATOM 768 C THR A 580 -21.175 1.913 16.212 1.00 50.87 C ATOM 769 O THR A 580 -22.058 2.201 15.404 1.00 62.46 O ATOM 770 CB THR A 580 -19.327 1.909 14.527 1.00 48.46 C ATOM 771 OG1 THR A 580 -18.949 0.530 14.559 1.00 60.66 O ATOM 772 CG2 THR A 580 -18.165 2.726 14.015 1.00 52.20 C ATOM 773 HG1 THR A 580 -18.691 0.239 13.649 1.00 0.00 H ATOM 774 H THR A 580 -18.456 0.907 16.913 1.00 0.00 H ATOM 775 N GLU A 581 -21.430 1.230 17.328 1.00 53.93 N ATOM 776 CA GLU A 581 -22.792 0.741 17.610 1.00 63.59 C ATOM 777 C GLU A 581 -23.600 1.857 18.271 1.00 56.64 C ATOM 778 O GLU A 581 -23.328 2.259 19.397 1.00 57.52 O ATOM 779 CB GLU A 581 -22.797 -0.575 18.406 1.00 57.76 C ATOM 780 CG GLU A 581 -22.594 -0.506 19.911 1.00 50.49 C ATOM 781 CD GLU A 581 -22.730 -1.860 20.573 1.00 59.11 C ATOM 782 OE1 GLU A 581 -23.782 -2.513 20.405 1.00 72.30 O ATOM 783 OE2 GLU A 581 -21.792 -2.280 21.270 1.00 62.91 O ATOM 784 H GLU A 581 -20.663 1.041 18.004 1.00 0.00 H ATOM 785 N GLY A 582 -24.581 2.371 17.539 1.00 69.37 N ATOM 786 CA GLY A 582 -25.282 3.591 17.930 1.00 68.94 C ATOM 787 C GLY A 582 -24.397 4.816 17.766 1.00 65.16 C ATOM 788 O GLY A 582 -23.416 4.799 17.012 1.00 62.76 O ATOM 789 H GLY A 582 -24.859 1.890 16.660 1.00 0.00 H ATOM 790 N ARG A 583 -24.753 5.880 18.477 1.00 50.84 N ATOM 791 CA ARG A 583 -24.022 7.140 18.434 1.00 49.84 C ATOM 792 C ARG A 583 -23.852 7.687 19.849 1.00 50.45 C ATOM 793 O ARG A 583 -24.595 7.292 20.745 1.00 62.11 O ATOM 794 CB ARG A 583 -24.768 8.144 17.571 1.00 52.58 C ATOM 795 CG ARG A 583 -24.844 7.756 16.114 1.00 57.60 C ATOM 796 CD ARG A 583 -25.340 8.926 15.286 1.00 57.29 C ATOM 797 NE ARG A 583 -26.069 8.492 14.096 1.00 62.85 N ATOM 798 CZ ARG A 583 -26.450 9.296 13.106 1.00 70.11 C ATOM 799 NH1 ARG A 583 -26.159 10.597 13.127 1.00 75.51 N ATOM 800 NH2 ARG A 583 -27.120 8.794 12.075 1.00 77.31 N ATOM 801 HE ARG A 583 -26.307 7.483 14.017 1.00 0.00 H ATOM 802 HH12 ARG A 583 -26.464 11.211 12.345 1.00 0.00 H ATOM 803 HH11 ARG A 583 -25.627 10.998 13.925 1.00 0.00 H ATOM 804 HH22 ARG A 583 -27.421 9.416 11.298 1.00 0.00 H ATOM 805 HH21 ARG A 583 -27.344 7.779 12.045 1.00 0.00 H ATOM 806 H ARG A 583 -25.590 5.811 19.091 1.00 0.00 H ATOM 807 N PRO A 584 -22.868 8.588 20.063 1.00 49.07 N ATOM 808 CA PRO A 584 -21.912 9.135 19.095 1.00 47.66 C ATOM 809 C PRO A 584 -20.819 8.120 18.754 1.00 48.39 C ATOM 810 O PRO A 584 -20.573 7.187 19.531 1.00 48.31 O ATOM 811 CB PRO A 584 -21.339 10.355 19.820 1.00 58.03 C ATOM 812 CG PRO A 584 -21.546 10.087 21.280 1.00 55.04 C ATOM 813 CD PRO A 584 -22.474 8.922 21.445 1.00 51.79 C ATOM 814 N LEU A 585 -20.203 8.277 17.586 1.00 44.59 N ATOM 815 CA LEU A 585 -19.093 7.411 17.187 1.00 46.93 C ATOM 816 C LEU A 585 -17.896 7.739 18.076 1.00 43.13 C ATOM 817 O LEU A 585 -17.583 8.919 18.277 1.00 43.23 O ATOM 818 CB LEU A 585 -18.741 7.611 15.710 1.00 55.29 C ATOM 819 CG LEU A 585 -19.875 7.478 14.680 1.00 60.81 C ATOM 820 CD1 LEU A 585 -19.285 7.326 13.283 1.00 60.15 C ATOM 821 CD2 LEU A 585 -20.814 6.313 14.977 1.00 56.44 C ATOM 822 H LEU A 585 -20.517 9.031 16.942 1.00 0.00 H ATOM 823 N LEU A 586 -17.277 6.707 18.647 1.00 40.02 N ATOM 824 CA LEU A 586 -16.161 6.878 19.591 1.00 40.58 C ATOM 825 C LEU A 586 -14.887 6.318 18.991 1.00 40.45 C ATOM 826 O LEU A 586 -14.922 5.293 18.322 1.00 40.11 O ATOM 827 CB LEU A 586 -16.436 6.170 20.929 1.00 40.07 C ATOM 828 CG LEU A 586 -17.812 6.378 21.572 1.00 41.89 C ATOM 829 CD1 LEU A 586 -17.936 5.589 22.864 1.00 44.39 C ATOM 830 CD2 LEU A 586 -18.076 7.842 21.841 1.00 44.66 C ATOM 831 H LEU A 586 -17.594 5.744 18.417 1.00 0.00 H ATOM 832 N MET A 587 -13.773 7.006 19.233 1.00 38.25 N ATOM 833 CA MET A 587 -12.435 6.486 18.977 1.00 39.47 C ATOM 834 C MET A 587 -11.740 6.313 20.310 1.00 32.73 C ATOM 835 O MET A 587 -11.834 7.183 21.170 1.00 36.52 O ATOM 836 CB MET A 587 -11.650 7.448 18.106 1.00 42.27 C ATOM 837 CG MET A 587 -11.950 7.272 16.637 1.00 49.62 C ATOM 838 SD MET A 587 -11.325 8.675 15.719 1.00 55.01 S ATOM 839 CE MET A 587 -9.650 8.166 15.488 1.00 54.59 C ATOM 840 H MET A 587 -13.862 7.965 19.625 1.00 0.00 H ATOM 841 N VAL A 588 -11.032 5.199 20.472 1.00 32.66 N ATOM 842 CA VAL A 588 -10.507 4.804 21.775 1.00 34.96 C ATOM 843 C VAL A 588 -9.000 4.760 21.712 1.00 34.46 C ATOM 844 O VAL A 588 -8.434 4.044 20.888 1.00 35.19 O ATOM 845 CB VAL A 588 -11.066 3.448 22.221 1.00 33.89 C ATOM 846 CG1 VAL A 588 -10.505 3.050 23.584 1.00 37.79 C ATOM 847 CG2 VAL A 588 -12.588 3.527 22.271 1.00 36.06 C ATOM 848 H VAL A 588 -10.847 4.593 19.647 1.00 0.00 H ATOM 849 N PHE A 589 -8.376 5.547 22.590 1.00 38.37 N ATOM 850 CA PHE A 589 -6.933 5.726 22.638 1.00 35.57 C ATOM 851 C PHE A 589 -6.372 5.402 24.009 1.00 34.73 C ATOM 852 O PHE A 589 -7.073 5.437 25.018 1.00 31.08 O ATOM 853 CB PHE A 589 -6.575 7.181 22.363 1.00 36.08 C ATOM 854 CG PHE A 589 -6.889 7.636 20.979 1.00 34.84 C ATOM 855 CD1 PHE A 589 -5.967 7.462 19.954 1.00 40.30 C ATOM 856 CD2 PHE A 589 -8.079 8.289 20.701 1.00 37.39 C ATOM 857 CE1 PHE A 589 -6.240 7.901 18.669 1.00 44.57 C ATOM 858 CE2 PHE A 589 -8.359 8.732 19.413 1.00 36.55 C ATOM 859 CZ PHE A 589 -7.442 8.544 18.402 1.00 42.43 C ATOM 860 H PHE A 589 -8.956 6.064 23.282 1.00 0.00 H ATOM 861 N GLU A 590 -5.073 5.120 24.028 1.00 35.69 N ATOM 862 CA GLU A 590 -4.321 5.000 25.268 1.00 36.96 C ATOM 863 C GLU A 590 -4.376 6.337 25.988 1.00 33.86 C ATOM 864 O GLU A 590 -4.301 7.388 25.345 1.00 36.45 O ATOM 865 CB GLU A 590 -2.875 4.633 24.948 1.00 39.23 C ATOM 866 CG GLU A 590 -1.920 4.554 26.130 1.00 44.70 C ATOM 867 CD GLU A 590 -0.461 4.370 25.703 1.00 45.47 C ATOM 868 OE1 GLU A 590 -0.089 4.696 24.550 1.00 38.20 O ATOM 869 OE2 GLU A 590 0.328 3.899 26.539 1.00 45.45 O ATOM 870 H GLU A 590 -4.577 4.980 23.125 1.00 0.00 H ATOM 871 N TYR A 591 -4.524 6.285 27.312 1.00 33.48 N ATOM 872 CA TYR A 591 -4.524 7.479 28.150 1.00 34.22 C ATOM 873 C TYR A 591 -3.071 7.849 28.441 1.00 33.07 C ATOM 874 O TYR A 591 -2.303 7.010 28.877 1.00 32.92 O ATOM 875 CB TYR A 591 -5.288 7.222 29.457 1.00 34.95 C ATOM 876 CG TYR A 591 -5.189 8.360 30.444 1.00 32.81 C ATOM 877 CD1 TYR A 591 -5.618 9.631 30.103 1.00 32.88 C ATOM 878 CD2 TYR A 591 -4.646 8.166 31.718 1.00 38.53 C ATOM 879 CE1 TYR A 591 -5.519 10.685 30.990 1.00 34.77 C ATOM 880 CE2 TYR A 591 -4.539 9.220 32.617 1.00 39.30 C ATOM 881 CZ TYR A 591 -4.985 10.471 32.244 1.00 39.08 C ATOM 882 OH TYR A 591 -4.884 11.509 33.118 1.00 44.23 O ATOM 883 HH TYR A 591 -5.246 12.329 32.698 1.00 0.00 H ATOM 884 H TYR A 591 -4.644 5.357 27.765 1.00 0.00 H ATOM 885 N MET A 592 -2.723 9.110 28.215 1.00 30.98 N ATOM 886 CA MET A 592 -1.368 9.629 28.393 1.00 33.89 C ATOM 887 C MET A 592 -1.453 10.705 29.457 1.00 36.90 C ATOM 888 O MET A 592 -1.867 11.833 29.181 1.00 29.97 O ATOM 889 CB MET A 592 -0.842 10.210 27.083 1.00 31.82 C ATOM 890 CG MET A 592 -0.800 9.217 25.936 1.00 33.93 C ATOM 891 SD MET A 592 0.415 7.905 26.170 1.00 36.45 S ATOM 892 CE MET A 592 1.888 8.707 25.546 1.00 39.22 C ATOM 893 H MET A 592 -3.460 9.769 27.891 1.00 0.00 H ATOM 894 N ARG A 593 -1.076 10.340 30.679 1.00 36.56 N ATOM 895 CA ARG A 593 -1.406 11.148 31.868 1.00 36.68 C ATOM 896 C ARG A 593 -0.825 12.547 31.943 1.00 34.53 C ATOM 897 O ARG A 593 -1.383 13.381 32.633 1.00 33.64 O ATOM 898 CB ARG A 593 -1.078 10.390 33.158 1.00 41.41 C ATOM 899 CG ARG A 593 0.378 9.991 33.328 1.00 51.76 C ATOM 900 CD ARG A 593 0.525 9.138 34.575 1.00 62.05 C ATOM 901 NE ARG A 593 0.352 10.032 35.707 1.00 54.79 N ATOM 902 CZ ARG A 593 1.323 10.491 36.496 1.00 68.00 C ATOM 903 NH1 ARG A 593 2.591 10.100 36.392 1.00 74.81 N ATOM 904 NH2 ARG A 593 1.015 11.342 37.439 1.00 72.70 N ATOM 905 HE ARG A 593 -0.617 10.342 35.921 1.00 0.00 H ATOM 906 HH12 ARG A 593 3.310 10.490 37.034 1.00 0.00 H ATOM 907 HH11 ARG A 593 2.863 9.404 35.669 1.00 0.00 H ATOM 908 HH22 ARG A 593 1.756 11.714 38.067 1.00 0.00 H ATOM 909 HH21 ARG A 593 0.029 11.648 37.562 1.00 0.00 H ATOM 910 H ARG A 593 -0.534 9.461 30.800 1.00 0.00 H ATOM 911 N HIS A 594 0.284 12.815 31.263 1.00 34.72 N ATOM 912 CA HIS A 594 0.861 14.174 31.274 1.00 31.30 C ATOM 913 C HIS A 594 0.304 15.103 30.182 1.00 31.34 C ATOM 914 O HIS A 594 0.657 16.271 30.138 1.00 34.74 O ATOM 915 CB HIS A 594 2.395 14.092 31.203 1.00 33.62 C ATOM 916 CG HIS A 594 3.010 13.467 32.413 1.00 37.37 C ATOM 917 ND1 HIS A 594 3.013 14.086 33.643 1.00 40.06 N ATOM 918 CD2 HIS A 594 3.611 12.268 32.593 1.00 42.19 C ATOM 919 CE1 HIS A 594 3.610 13.305 34.528 1.00 38.55 C ATOM 920 NE2 HIS A 594 3.981 12.195 33.914 1.00 40.34 N ATOM 921 H HIS A 594 0.750 12.061 30.718 1.00 0.00 H ATOM 922 N GLY A 595 -0.558 14.590 29.304 1.00 29.75 N ATOM 923 CA GLY A 595 -1.157 15.406 28.249 1.00 31.42 C ATOM 924 C GLY A 595 -0.156 15.694 27.140 1.00 30.24 C ATOM 925 O GLY A 595 0.776 14.917 26.907 1.00 31.88 O ATOM 926 H GLY A 595 -0.811 13.583 29.371 1.00 0.00 H ATOM 927 N ASP A 596 -0.346 16.818 26.465 1.00 29.63 N ATOM 928 CA ASP A 596 0.445 17.144 25.300 1.00 30.38 C ATOM 929 C ASP A 596 1.845 17.637 25.707 1.00 33.60 C ATOM 930 O ASP A 596 2.032 18.192 26.787 1.00 29.62 O ATOM 931 CB ASP A 596 -0.303 18.101 24.354 1.00 34.51 C ATOM 932 CG ASP A 596 -0.274 19.551 24.798 1.00 39.62 C ATOM 933 OD1 ASP A 596 0.820 20.147 24.821 1.00 33.59 O ATOM 934 OD2 ASP A 596 -1.357 20.120 25.061 1.00 37.81 O ATOM 935 H ASP A 596 -1.082 17.482 26.781 1.00 0.00 H ATOM 936 N LEU A 597 2.815 17.422 24.829 1.00 31.42 N ATOM 937 CA LEU A 597 4.202 17.724 25.154 1.00 27.48 C ATOM 938 C LEU A 597 4.449 19.215 25.414 1.00 30.06 C ATOM 939 O LEU A 597 5.293 19.554 26.236 1.00 29.87 O ATOM 940 CB LEU A 597 5.113 17.196 24.062 1.00 32.19 C ATOM 941 CG LEU A 597 6.615 17.438 24.196 1.00 31.16 C ATOM 942 CD1 LEU A 597 7.172 16.863 25.490 1.00 28.76 C ATOM 943 CD2 LEU A 597 7.295 16.842 22.991 1.00 29.82 C ATOM 944 H LEU A 597 2.582 17.032 23.894 1.00 0.00 H ATOM 945 N ASN A 598 3.705 20.105 24.748 1.00 29.38 N ATOM 946 CA ASN A 598 3.897 21.538 24.964 1.00 34.04 C ATOM 947 C ASN A 598 3.585 21.960 26.403 1.00 32.55 C ATOM 948 O ASN A 598 4.377 22.672 27.016 1.00 32.04 O ATOM 949 CB ASN A 598 3.079 22.388 23.984 1.00 34.97 C ATOM 950 CG ASN A 598 3.448 23.865 24.053 1.00 32.65 C ATOM 951 OD1 ASN A 598 2.747 24.650 24.669 1.00 37.78 O ATOM 952 ND2 ASN A 598 4.560 24.236 23.446 1.00 35.98 N ATOM 953 HD22 ASN A 598 5.130 23.535 22.931 1.00 0.00 H ATOM 954 HD21 ASN A 598 4.866 25.229 23.483 1.00 0.00 H ATOM 955 H ASN A 598 2.986 19.776 24.073 1.00 0.00 H ATOM 956 N ARG A 599 2.431 21.529 26.913 1.00 33.36 N ATOM 957 CA ARG A 599 2.010 21.799 28.296 1.00 33.34 C ATOM 958 C ARG A 599 3.001 21.197 29.292 1.00 36.19 C ATOM 959 O ARG A 599 3.377 21.858 30.268 1.00 42.37 O ATOM 960 CB ARG A 599 0.591 21.264 28.571 1.00 38.45 C ATOM 961 CG ARG A 599 0.084 21.545 29.987 1.00 45.48 C ATOM 962 CD ARG A 599 -1.348 21.079 30.208 1.00 60.88 C ATOM 963 NE ARG A 599 -1.808 21.348 31.589 1.00 43.04 N ATOM 964 CZ ARG A 599 -1.586 20.568 32.649 1.00 41.31 C ATOM 965 NH1 ARG A 599 -0.904 19.428 32.557 1.00 40.72 N ATOM 966 NH2 ARG A 599 -2.057 20.938 33.834 1.00 40.41 N ATOM 967 HE ARG A 599 -2.351 22.221 31.747 1.00 0.00 H ATOM 968 HH12 ARG A 599 -0.750 18.845 33.404 1.00 0.00 H ATOM 969 HH11 ARG A 599 -0.526 19.121 31.638 1.00 0.00 H ATOM 970 HH22 ARG A 599 -1.892 20.340 34.669 1.00 0.00 H ATOM 971 HH21 ARG A 599 -2.591 21.825 33.927 1.00 0.00 H ATOM 972 H ARG A 599 1.797 20.974 26.303 1.00 0.00 H ATOM 973 N PHE A 600 3.430 19.965 29.029 1.00 28.99 N ATOM 974 CA PHE A 600 4.421 19.295 29.856 1.00 32.72 C ATOM 975 C PHE A 600 5.731 20.083 29.933 1.00 35.06 C ATOM 976 O PHE A 600 6.264 20.285 31.024 1.00 30.48 O ATOM 977 CB PHE A 600 4.705 17.897 29.333 1.00 31.99 C ATOM 978 CG PHE A 600 5.699 17.126 30.167 1.00 36.27 C ATOM 979 CD1 PHE A 600 5.321 16.573 31.393 1.00 41.82 C ATOM 980 CD2 PHE A 600 7.011 16.952 29.736 1.00 36.10 C ATOM 981 CE1 PHE A 600 6.231 15.860 32.163 1.00 37.41 C ATOM 982 CE2 PHE A 600 7.926 16.246 30.506 1.00 34.50 C ATOM 983 CZ PHE A 600 7.534 15.708 31.724 1.00 37.78 C ATOM 984 H PHE A 600 3.043 19.464 28.204 1.00 0.00 H ATOM 985 N LEU A 601 6.228 20.521 28.777 1.00 32.07 N ATOM 986 CA LEU A 601 7.460 21.323 28.705 1.00 34.48 C ATOM 987 C LEU A 601 7.339 22.620 29.499 1.00 34.52 C ATOM 988 O LEU A 601 8.211 22.942 30.318 1.00 34.72 O ATOM 989 CB LEU A 601 7.812 21.634 27.251 1.00 33.78 C ATOM 990 CG LEU A 601 8.324 20.460 26.421 1.00 29.01 C ATOM 991 CD1 LEU A 601 8.193 20.775 24.934 1.00 33.81 C ATOM 992 CD2 LEU A 601 9.759 20.098 26.778 1.00 35.24 C ATOM 993 H LEU A 601 5.728 20.288 27.895 1.00 0.00 H ATOM 994 N ARG A 602 6.244 23.338 29.283 1.00 32.79 N ATOM 995 CA ARG A 602 5.984 24.593 30.000 1.00 36.09 C ATOM 996 C ARG A 602 5.857 24.418 31.518 1.00 39.24 C ATOM 997 O ARG A 602 6.234 25.299 32.259 1.00 37.55 O ATOM 998 CB ARG A 602 4.725 25.259 29.469 1.00 29.33 C ATOM 999 CG ARG A 602 4.886 25.801 28.051 1.00 37.56 C ATOM 1000 CD ARG A 602 3.564 26.272 27.491 1.00 36.45 C ATOM 1001 NE ARG A 602 3.672 26.948 26.188 1.00 43.53 N ATOM 1002 CZ ARG A 602 4.091 28.203 25.996 1.00 52.07 C ATOM 1003 NH1 ARG A 602 4.502 28.962 27.017 1.00 47.24 N ATOM 1004 NH2 ARG A 602 4.117 28.710 24.756 1.00 46.79 N ATOM 1005 HE ARG A 602 3.399 26.403 25.345 1.00 0.00 H ATOM 1006 HH12 ARG A 602 4.824 29.936 26.844 1.00 0.00 H ATOM 1007 HH11 ARG A 602 4.500 28.579 27.984 1.00 0.00 H ATOM 1008 HH22 ARG A 602 4.442 29.686 24.600 1.00 0.00 H ATOM 1009 HH21 ARG A 602 3.812 28.128 23.950 1.00 0.00 H ATOM 1010 H ARG A 602 5.550 23.002 28.585 1.00 0.00 H ATOM 1011 N SER A 603 5.313 23.279 31.946 1.00 38.50 N ATOM 1012 CA SER A 603 5.141 22.971 33.370 1.00 40.51 C ATOM 1013 C SER A 603 6.434 22.522 34.071 1.00 40.49 C ATOM 1014 O SER A 603 6.447 22.391 35.296 1.00 41.91 O ATOM 1015 CB SER A 603 4.026 21.933 33.564 1.00 34.51 C ATOM 1016 OG SER A 603 4.366 20.678 33.006 1.00 37.41 O ATOM 1017 HG SER A 603 4.526 20.782 32.035 1.00 0.00 H ATOM 1018 H SER A 603 4.998 22.581 31.243 1.00 0.00 H ATOM 1019 N HIS A 604 7.499 22.276 33.302 1.00 42.01 N ATOM 1020 CA HIS A 604 8.835 21.974 33.840 1.00 46.35 C ATOM 1021 C HIS A 604 9.922 22.876 33.235 1.00 41.28 C ATOM 1022 O HIS A 604 11.004 22.401 32.866 1.00 45.51 O ATOM 1023 CB HIS A 604 9.163 20.505 33.595 1.00 43.16 C ATOM 1024 CG HIS A 604 8.216 19.569 34.268 1.00 42.82 C ATOM 1025 ND1 HIS A 604 7.084 19.082 33.650 1.00 45.20 N ATOM 1026 CD2 HIS A 604 8.211 19.059 35.519 1.00 47.00 C ATOM 1027 CE1 HIS A 604 6.426 18.310 34.498 1.00 46.85 C ATOM 1028 NE2 HIS A 604 7.091 18.280 35.638 1.00 45.50 N ATOM 1029 H HIS A 604 7.377 22.299 32.269 1.00 0.00 H ATOM 1030 N GLY A 605 9.620 24.170 33.147 1.00 41.60 N ATOM 1031 CA GLY A 605 10.527 25.169 32.570 1.00 50.89 C ATOM 1032 C GLY A 605 11.714 25.516 33.461 1.00 61.62 C ATOM 1033 O GLY A 605 11.914 24.880 34.505 1.00 56.87 O ATOM 1034 H GLY A 605 8.697 24.488 33.505 1.00 0.00 H ATOM 1035 N PRO A 606 12.505 26.544 33.080 1.00 55.04 N ATOM 1036 CA PRO A 606 13.624 26.943 33.951 1.00 63.38 C ATOM 1037 C PRO A 606 13.182 27.579 35.285 1.00 60.18 C ATOM 1038 O PRO A 606 13.999 27.689 36.205 1.00 58.90 O ATOM 1039 CB PRO A 606 14.385 27.951 33.091 1.00 65.45 C ATOM 1040 CG PRO A 606 13.310 28.607 32.298 1.00 65.68 C ATOM 1041 CD PRO A 606 12.308 27.515 31.985 1.00 63.62 C ATOM 1042 N ASP A 607 11.915 28.000 35.367 1.00 54.59 N ATOM 1043 CA ASP A 607 11.305 28.509 36.606 1.00 57.00 C ATOM 1044 C ASP A 607 10.771 27.423 37.575 1.00 65.25 C ATOM 1045 O ASP A 607 10.435 27.736 38.719 1.00 62.46 O ATOM 1046 CB ASP A 607 10.173 29.483 36.250 1.00 57.71 C ATOM 1047 CG ASP A 607 10.641 30.766 35.689 1.00 44.98 C ATOM 1048 OD1 ASP A 607 9.910 31.345 34.859 1.00 44.53 O ATOM 1049 OD2 ASP A 607 11.734 31.241 36.067 1.00 44.27 O ATOM 1050 H ASP A 607 11.329 27.966 34.508 1.00 0.00 H ATOM 1051 N ALA A 608 10.692 26.168 37.126 1.00 57.04 N ATOM 1052 CA ALA A 608 10.155 25.069 37.949 1.00 54.52 C ATOM 1053 C ALA A 608 11.038 24.763 39.164 1.00 52.15 C ATOM 1054 O ALA A 608 12.257 24.929 39.104 1.00 56.39 O ATOM 1055 CB ALA A 608 9.975 23.818 37.103 1.00 49.75 C ATOM 1056 H ALA A 608 11.021 25.958 36.162 1.00 0.00 H ATOM 1057 N LYS A 609 10.401 24.314 40.252 1.00 59.31 N ATOM 1058 CA LYS A 609 11.072 24.019 41.537 1.00 53.41 C ATOM 1059 C LYS A 609 10.624 22.629 42.047 1.00 64.12 C ATOM 1060 O LYS A 609 10.188 21.789 41.242 1.00 53.86 O ATOM 1061 CB LYS A 609 10.774 25.142 42.549 1.00 63.40 C ATOM 1062 CG LYS A 609 11.404 26.487 42.199 1.00 56.55 C ATOM 1063 CD LYS A 609 11.216 27.447 43.303 1.00 46.23 C ATOM 1064 CE LYS A 609 11.921 28.745 42.965 1.00 44.66 C ATOM 1065 NZ LYS A 609 11.655 29.797 43.979 1.00 43.82 N ATOM 1066 HZ1 LYS A 609 10.633 29.982 44.025 1.00 0.00 H ATOM 1067 HZ2 LYS A 609 11.992 29.474 44.908 1.00 0.00 H ATOM 1068 HZ3 LYS A 609 12.155 30.669 43.712 1.00 0.00 H ATOM 1069 H LYS A 609 9.374 24.164 40.190 1.00 0.00 H ATOM 1070 N LEU A 610 10.762 22.381 43.356 1.00 61.61 N ATOM 1071 CA LEU A 610 10.346 21.118 44.004 1.00 55.50 C ATOM 1072 C LEU A 610 8.907 20.670 43.722 1.00 55.55 C ATOM 1073 O LEU A 610 8.667 19.493 43.430 1.00 57.77 O ATOM 1074 CB LEU A 610 10.606 21.183 45.516 1.00 56.72 C ATOM 1075 CG LEU A 610 12.084 21.183 45.943 1.00 59.55 C ATOM 1076 CD1 LEU A 610 12.182 21.238 47.463 1.00 62.74 C ATOM 1077 CD2 LEU A 610 12.865 19.979 45.417 1.00 63.26 C ATOM 1078 H LEU A 610 11.187 23.120 43.952 1.00 0.00 H ATOM 1079 N LEU A 611 7.974 21.617 43.796 1.00 56.64 N ATOM 1080 CA LEU A 611 6.544 21.404 43.487 1.00 63.18 C ATOM 1081 C LEU A 611 6.275 20.674 42.159 1.00 64.11 C ATOM 1082 O LEU A 611 5.469 19.738 42.107 1.00 61.37 O ATOM 1083 CB LEU A 611 5.826 22.758 43.447 1.00 56.43 C ATOM 1084 CG LEU A 611 5.689 23.598 44.654 1.00 46.24 C ATOM 1085 CD1 LEU A 611 5.039 24.918 44.275 1.00 45.44 C ATOM 1086 CD2 LEU A 611 4.867 22.868 45.705 1.00 45.66 C ATOM 1087 H LEU A 611 8.271 22.569 44.091 1.00 0.00 H ATOM 1088 N ALA A 612 6.956 21.115 41.100 1.00 59.33 N ATOM 1089 CA ALA A 612 6.888 20.473 39.772 1.00 59.63 C ATOM 1090 C ALA A 612 7.379 19.022 39.762 1.00 66.88 C ATOM 1091 O ALA A 612 7.034 18.260 38.853 1.00 61.05 O ATOM 1092 CB ALA A 612 7.678 21.283 38.751 1.00 61.82 C ATOM 1093 H ALA A 612 7.564 21.951 41.215 1.00 0.00 H ATOM 1094 N GLY A 613 8.209 18.665 40.749 1.00 58.99 N ATOM 1095 CA GLY A 613 8.629 17.284 40.989 1.00 54.46 C ATOM 1096 C GLY A 613 7.453 16.333 41.094 1.00 53.64 C ATOM 1097 O GLY A 613 6.341 16.729 41.466 1.00 52.31 O ATOM 1098 H GLY A 613 8.575 19.408 41.378 1.00 0.00 H ATOM 1099 N GLY A 614 7.686 15.078 40.739 1.00 52.60 N ATOM 1100 CA GLY A 614 6.596 14.122 40.659 1.00 45.28 C ATOM 1101 C GLY A 614 7.051 12.693 40.641 1.00 46.21 C ATOM 1102 O GLY A 614 8.194 12.376 40.970 1.00 51.38 O ATOM 1103 H GLY A 614 8.656 14.776 40.516 1.00 0.00 H ATOM 1104 N GLU A 615 6.123 11.833 40.255 1.00 43.57 N ATOM 1105 CA GLU A 615 6.352 10.398 40.184 1.00 51.70 C ATOM 1106 C GLU A 615 7.287 9.996 39.048 1.00 45.41 C ATOM 1107 O GLU A 615 8.081 9.068 39.204 1.00 43.36 O ATOM 1108 CB GLU A 615 5.007 9.699 40.006 1.00 50.88 C ATOM 1109 CG GLU A 615 5.029 8.186 40.108 1.00 51.97 C ATOM 1110 CD GLU A 615 3.656 7.589 39.841 1.00 64.39 C ATOM 1111 OE1 GLU A 615 2.670 8.087 40.430 1.00 61.86 O ATOM 1112 OE2 GLU A 615 3.559 6.629 39.041 1.00 58.95 O ATOM 1113 H GLU A 615 5.186 12.200 39.990 1.00 0.00 H ATOM 1114 N ASP A 616 7.160 10.668 37.906 1.00 40.24 N ATOM 1115 CA ASP A 616 7.922 10.352 36.688 1.00 42.31 C ATOM 1116 C ASP A 616 9.074 11.289 36.400 1.00 36.40 C ATOM 1117 O ASP A 616 9.868 11.012 35.519 1.00 46.50 O ATOM 1118 CB ASP A 616 7.004 10.453 35.462 1.00 53.03 C ATOM 1119 CG ASP A 616 5.851 9.499 35.509 1.00 52.89 C ATOM 1120 OD1 ASP A 616 5.969 8.418 36.126 1.00 74.43 O ATOM 1121 OD2 ASP A 616 4.830 9.817 34.877 1.00 54.55 O ATOM 1122 H ASP A 616 6.486 11.459 37.873 1.00 0.00 H ATOM 1123 N VAL A 617 9.131 12.411 37.101 1.00 42.51 N ATOM 1124 CA VAL A 617 10.012 13.496 36.733 1.00 41.91 C ATOM 1125 C VAL A 617 10.511 14.208 37.982 1.00 41.95 C ATOM 1126 O VAL A 617 9.748 14.433 38.936 1.00 39.70 O ATOM 1127 CB VAL A 617 9.281 14.468 35.758 1.00 49.26 C ATOM 1128 CG1 VAL A 617 8.011 15.050 36.372 1.00 46.49 C ATOM 1129 CG2 VAL A 617 10.201 15.574 35.268 1.00 49.43 C ATOM 1130 H VAL A 617 8.525 12.514 37.940 1.00 0.00 H ATOM 1131 N ALA A 618 11.794 14.572 37.954 1.00 39.03 N ATOM 1132 CA ALA A 618 12.446 15.268 39.055 1.00 43.11 C ATOM 1133 C ALA A 618 11.895 16.674 39.190 1.00 49.60 C ATOM 1134 O ALA A 618 11.251 17.175 38.265 1.00 42.55 O ATOM 1135 CB ALA A 618 13.950 15.310 38.814 1.00 50.87 C ATOM 1136 H ALA A 618 12.355 14.349 37.107 1.00 0.00 H ATOM 1137 N PRO A 619 12.134 17.321 40.347 1.00 52.67 N ATOM 1138 CA PRO A 619 11.713 18.712 40.421 1.00 54.94 C ATOM 1139 C PRO A 619 12.607 19.603 39.580 1.00 49.12 C ATOM 1140 O PRO A 619 13.667 19.175 39.112 1.00 51.22 O ATOM 1141 CB PRO A 619 11.903 19.040 41.887 1.00 55.60 C ATOM 1142 CG PRO A 619 13.068 18.207 42.293 1.00 54.47 C ATOM 1143 CD PRO A 619 12.826 16.907 41.589 1.00 46.04 C ATOM 1144 N GLY A 620 12.168 20.830 39.367 1.00 54.96 N ATOM 1145 CA GLY A 620 12.979 21.785 38.627 1.00 55.15 C ATOM 1146 C GLY A 620 12.923 21.622 37.117 1.00 52.67 C ATOM 1147 O GLY A 620 12.123 20.834 36.595 1.00 47.59 O ATOM 1148 H GLY A 620 11.236 21.116 39.731 1.00 0.00 H ATOM 1149 N PRO A 621 13.772 22.379 36.399 1.00 53.17 N ATOM 1150 CA PRO A 621 13.773 22.275 34.948 1.00 48.61 C ATOM 1151 C PRO A 621 14.252 20.922 34.483 1.00 46.59 C ATOM 1152 O PRO A 621 15.142 20.337 35.095 1.00 51.99 O ATOM 1153 CB PRO A 621 14.764 23.364 34.503 1.00 50.35 C ATOM 1154 CG PRO A 621 15.592 23.675 35.696 1.00 53.84 C ATOM 1155 CD PRO A 621 14.720 23.403 36.885 1.00 53.31 C ATOM 1156 N LEU A 622 13.672 20.430 33.396 1.00 45.14 N ATOM 1157 CA LEU A 622 14.116 19.174 32.823 1.00 42.89 C ATOM 1158 C LEU A 622 15.591 19.303 32.453 1.00 52.61 C ATOM 1159 O LEU A 622 16.007 20.311 31.900 1.00 44.58 O ATOM 1160 CB LEU A 622 13.297 18.808 31.588 1.00 42.80 C ATOM 1161 CG LEU A 622 11.802 18.525 31.819 1.00 49.55 C ATOM 1162 CD1 LEU A 622 11.065 18.467 30.488 1.00 50.01 C ATOM 1163 CD2 LEU A 622 11.598 17.238 32.605 1.00 44.38 C ATOM 1164 H LEU A 622 12.890 20.951 32.950 1.00 0.00 H ATOM 1165 N GLY A 623 16.370 18.294 32.805 1.00 50.91 N ATOM 1166 CA GLY A 623 17.798 18.266 32.505 1.00 54.20 C ATOM 1167 C GLY A 623 18.089 17.948 31.056 1.00 49.49 C ATOM 1168 O GLY A 623 17.231 17.455 30.329 1.00 46.42 O ATOM 1169 H GLY A 623 15.949 17.491 33.314 1.00 0.00 H ATOM 1170 N LEU A 624 19.323 18.221 30.643 1.00 47.51 N ATOM 1171 CA LEU A 624 19.789 17.937 29.284 1.00 43.60 C ATOM 1172 C LEU A 624 19.483 16.503 28.868 1.00 37.82 C ATOM 1173 O LEU A 624 19.028 16.253 27.749 1.00 38.87 O ATOM 1174 CB LEU A 624 21.300 18.204 29.181 1.00 41.76 C ATOM 1175 CG LEU A 624 22.009 17.793 27.889 1.00 45.40 C ATOM 1176 CD1 LEU A 624 21.372 18.497 26.696 1.00 48.49 C ATOM 1177 CD2 LEU A 624 23.500 18.110 27.967 1.00 46.86 C ATOM 1178 H LEU A 624 19.987 18.656 31.315 1.00 0.00 H ATOM 1179 N GLY A 625 19.736 15.571 29.781 1.00 44.33 N ATOM 1180 CA GLY A 625 19.462 14.147 29.563 1.00 41.83 C ATOM 1181 C GLY A 625 17.995 13.834 29.284 1.00 40.82 C ATOM 1182 O GLY A 625 17.689 13.002 28.417 1.00 38.43 O ATOM 1183 H GLY A 625 20.146 15.865 30.690 1.00 0.00 H ATOM 1184 N GLN A 626 17.100 14.508 30.001 1.00 41.44 N ATOM 1185 CA GLN A 626 15.652 14.310 29.823 1.00 45.87 C ATOM 1186 C GLN A 626 15.193 14.922 28.502 1.00 42.05 C ATOM 1187 O GLN A 626 14.441 14.301 27.773 1.00 40.35 O ATOM 1188 CB GLN A 626 14.835 14.932 30.960 1.00 41.94 C ATOM 1189 CG GLN A 626 14.891 14.204 32.295 1.00 56.28 C ATOM 1190 CD GLN A 626 15.764 14.919 33.309 1.00 67.27 C ATOM 1191 OE1 GLN A 626 15.267 15.713 34.127 1.00 62.26 O ATOM 1192 NE2 GLN A 626 17.072 14.688 33.237 1.00 70.40 N ATOM 1193 HE22 GLN A 626 17.443 14.015 32.537 1.00 0.00 H ATOM 1194 HE21 GLN A 626 17.723 15.180 33.881 1.00 0.00 H ATOM 1195 H GLN A 626 17.433 15.195 30.708 1.00 0.00 H ATOM 1196 N LEU A 627 15.651 16.140 28.215 1.00 41.60 N ATOM 1197 CA LEU A 627 15.316 16.841 26.960 1.00 36.29 C ATOM 1198 C LEU A 627 15.721 16.054 25.724 1.00 40.51 C ATOM 1199 O LEU A 627 14.978 15.986 24.750 1.00 43.89 O ATOM 1200 CB LEU A 627 15.974 18.217 26.918 1.00 41.41 C ATOM 1201 CG LEU A 627 15.570 19.198 28.019 1.00 36.40 C ATOM 1202 CD1 LEU A 627 16.473 20.422 27.997 1.00 43.98 C ATOM 1203 CD2 LEU A 627 14.106 19.590 27.907 1.00 40.73 C ATOM 1204 H LEU A 627 16.269 16.616 28.903 1.00 0.00 H ATOM 1205 N LEU A 628 16.904 15.452 25.774 1.00 39.25 N ATOM 1206 CA LEU A 628 17.389 14.611 24.690 1.00 35.94 C ATOM 1207 C LEU A 628 16.558 13.340 24.523 1.00 33.60 C ATOM 1208 O LEU A 628 16.333 12.896 23.400 1.00 36.61 O ATOM 1209 CB LEU A 628 18.866 14.251 24.931 1.00 44.74 C ATOM 1210 CG LEU A 628 19.833 15.431 24.748 1.00 44.78 C ATOM 1211 CD1 LEU A 628 21.163 15.199 25.464 1.00 51.29 C ATOM 1212 CD2 LEU A 628 20.048 15.697 23.267 1.00 41.76 C ATOM 1213 H LEU A 628 17.502 15.586 26.614 1.00 0.00 H ATOM 1214 N ALA A 629 16.127 12.757 25.644 1.00 36.52 N ATOM 1215 CA ALA A 629 15.274 11.564 25.646 1.00 38.64 C ATOM 1216 C ALA A 629 13.908 11.849 24.997 1.00 37.26 C ATOM 1217 O ALA A 629 13.405 11.041 24.249 1.00 41.89 O ATOM 1218 CB ALA A 629 15.092 11.053 27.073 1.00 41.00 C ATOM 1219 H ALA A 629 16.409 13.167 26.557 1.00 0.00 H ATOM 1220 N VAL A 630 13.342 13.017 25.276 1.00 41.62 N ATOM 1221 CA VAL A 630 12.112 13.467 24.610 1.00 44.22 C ATOM 1222 C VAL A 630 12.339 13.625 23.102 1.00 40.06 C ATOM 1223 O VAL A 630 11.614 13.050 22.297 1.00 37.17 O ATOM 1224 CB VAL A 630 11.617 14.802 25.194 1.00 36.93 C ATOM 1225 CG1 VAL A 630 10.461 15.370 24.378 1.00 42.67 C ATOM 1226 CG2 VAL A 630 11.191 14.637 26.649 1.00 38.15 C ATOM 1227 H VAL A 630 13.783 13.633 25.988 1.00 0.00 H ATOM 1228 N ALA A 631 13.337 14.425 22.735 1.00 36.80 N ATOM 1229 CA ALA A 631 13.701 14.640 21.334 1.00 33.05 C ATOM 1230 C ALA A 631 13.923 13.336 20.559 1.00 34.81 C ATOM 1231 O ALA A 631 13.439 13.176 19.433 1.00 31.52 O ATOM 1232 CB ALA A 631 14.941 15.514 21.256 1.00 36.01 C ATOM 1233 H ALA A 631 13.880 14.917 23.473 1.00 0.00 H ATOM 1234 N SER A 632 14.639 12.404 21.180 1.00 35.50 N ATOM 1235 CA SER A 632 14.936 11.104 20.568 1.00 40.57 C ATOM 1236 C SER A 632 13.682 10.287 20.242 1.00 36.40 C ATOM 1237 O SER A 632 13.550 9.729 19.151 1.00 42.69 O ATOM 1238 CB SER A 632 15.835 10.292 21.503 1.00 40.04 C ATOM 1239 OG SER A 632 16.233 9.104 20.865 1.00 44.85 O ATOM 1240 HG SER A 632 16.814 8.583 21.474 1.00 0.00 H ATOM 1241 H SER A 632 15.002 12.603 22.134 1.00 0.00 H ATOM 1242 N GLN A 633 12.760 10.235 21.201 1.00 35.99 N ATOM 1243 CA GLN A 633 11.485 9.543 21.017 1.00 36.88 C ATOM 1244 C GLN A 633 10.641 10.118 19.879 1.00 35.48 C ATOM 1245 O GLN A 633 10.093 9.368 19.081 1.00 36.39 O ATOM 1246 CB GLN A 633 10.683 9.552 22.315 1.00 35.24 C ATOM 1247 CG GLN A 633 11.305 8.721 23.417 1.00 39.70 C ATOM 1248 CD GLN A 633 10.439 8.706 24.661 1.00 36.73 C ATOM 1249 OE1 GLN A 633 9.385 8.078 24.676 1.00 43.78 O ATOM 1250 NE2 GLN A 633 10.853 9.420 25.685 1.00 37.80 N ATOM 1251 HE22 GLN A 633 11.754 9.937 25.628 1.00 0.00 H ATOM 1252 HE21 GLN A 633 10.280 9.468 26.551 1.00 0.00 H ATOM 1253 H GLN A 633 12.953 10.702 22.110 1.00 0.00 H ATOM 1254 N VAL A 634 10.551 11.444 19.805 1.00 35.70 N ATOM 1255 CA VAL A 634 9.856 12.111 18.697 1.00 36.58 C ATOM 1256 C VAL A 634 10.541 11.786 17.361 1.00 39.68 C ATOM 1257 O VAL A 634 9.856 11.514 16.374 1.00 38.87 O ATOM 1258 CB VAL A 634 9.745 13.648 18.889 1.00 30.50 C ATOM 1259 CG1 VAL A 634 9.054 14.313 17.700 1.00 31.79 C ATOM 1260 CG2 VAL A 634 8.987 13.999 20.156 1.00 33.67 C ATOM 1261 H VAL A 634 10.985 12.023 20.552 1.00 0.00 H ATOM 1262 N ALA A 635 11.876 11.818 17.324 1.00 39.03 N ATOM 1263 CA ALA A 635 12.606 11.485 16.089 1.00 38.76 C ATOM 1264 C ALA A 635 12.347 10.044 15.653 1.00 34.72 C ATOM 1265 O ALA A 635 12.168 9.785 14.467 1.00 41.22 O ATOM 1266 CB ALA A 635 14.092 11.726 16.250 1.00 40.16 C ATOM 1267 H ALA A 635 12.407 12.082 18.179 1.00 0.00 H ATOM 1268 N ALA A 636 12.307 9.127 16.614 1.00 33.94 N ATOM 1269 CA ALA A 636 11.998 7.716 16.342 1.00 41.78 C ATOM 1270 C ALA A 636 10.618 7.542 15.737 1.00 40.05 C ATOM 1271 O ALA A 636 10.432 6.739 14.836 1.00 43.08 O ATOM 1272 CB ALA A 636 12.112 6.888 17.614 1.00 44.76 C ATOM 1273 H ALA A 636 12.501 9.418 17.593 1.00 0.00 H ATOM 1274 N GLY A 637 9.647 8.307 16.228 1.00 42.69 N ATOM 1275 CA GLY A 637 8.327 8.324 15.619 1.00 39.54 C ATOM 1276 C GLY A 637 8.368 8.812 14.180 1.00 36.80 C ATOM 1277 O GLY A 637 7.734 8.224 13.307 1.00 35.98 O ATOM 1278 H GLY A 637 9.835 8.902 17.060 1.00 0.00 H ATOM 1279 N MET A 638 9.114 9.889 13.936 1.00 39.10 N ATOM 1280 CA MET A 638 9.245 10.450 12.583 1.00 36.82 C ATOM 1281 C MET A 638 10.048 9.547 11.646 1.00 35.68 C ATOM 1282 O MET A 638 9.773 9.523 10.462 1.00 38.96 O ATOM 1283 CB MET A 638 9.846 11.859 12.606 1.00 41.89 C ATOM 1284 CG MET A 638 8.989 12.923 13.277 1.00 42.46 C ATOM 1285 SD MET A 638 7.280 12.976 12.703 1.00 45.36 S ATOM 1286 CE MET A 638 7.497 13.376 10.973 1.00 41.78 C ATOM 1287 H MET A 638 9.617 10.345 14.724 1.00 0.00 H ATOM 1288 N VAL A 639 11.015 8.798 12.170 1.00 39.40 N ATOM 1289 CA VAL A 639 11.686 7.755 11.363 1.00 45.36 C ATOM 1290 C VAL A 639 10.645 6.752 10.840 1.00 49.31 C ATOM 1291 O VAL A 639 10.603 6.450 9.646 1.00 48.44 O ATOM 1292 CB VAL A 639 12.784 7.021 12.166 1.00 46.89 C ATOM 1293 CG1 VAL A 639 13.328 5.802 11.412 1.00 51.33 C ATOM 1294 CG2 VAL A 639 13.932 7.962 12.484 1.00 46.51 C ATOM 1295 H VAL A 639 11.302 8.947 13.158 1.00 0.00 H ATOM 1296 N TYR A 640 9.785 6.266 11.732 1.00 42.91 N ATOM 1297 CA TYR A 640 8.771 5.285 11.352 1.00 42.04 C ATOM 1298 C TYR A 640 7.833 5.828 10.287 1.00 38.51 C ATOM 1299 O TYR A 640 7.593 5.156 9.291 1.00 43.87 O ATOM 1300 CB TYR A 640 7.996 4.799 12.586 1.00 44.58 C ATOM 1301 CG TYR A 640 6.838 3.880 12.272 1.00 49.68 C ATOM 1302 CD1 TYR A 640 7.042 2.522 12.013 1.00 52.48 C ATOM 1303 CD2 TYR A 640 5.533 4.367 12.240 1.00 51.97 C ATOM 1304 CE1 TYR A 640 5.973 1.680 11.732 1.00 51.47 C ATOM 1305 CE2 TYR A 640 4.466 3.539 11.954 1.00 50.17 C ATOM 1306 CZ TYR A 640 4.683 2.201 11.715 1.00 49.27 C ATOM 1307 OH TYR A 640 3.598 1.410 11.442 1.00 61.72 O ATOM 1308 HH TYR A 640 2.971 1.436 12.208 1.00 0.00 H ATOM 1309 H TYR A 640 9.836 6.591 12.719 1.00 0.00 H ATOM 1310 N LEU A 641 7.323 7.048 10.469 1.00 38.36 N ATOM 1311 CA LEU A 641 6.449 7.665 9.457 1.00 39.14 C ATOM 1312 C LEU A 641 7.163 7.907 8.125 1.00 48.25 C ATOM 1313 O LEU A 641 6.598 7.644 7.061 1.00 40.91 O ATOM 1314 CB LEU A 641 5.835 8.974 9.965 1.00 46.30 C ATOM 1315 CG LEU A 641 4.973 8.885 11.233 1.00 44.41 C ATOM 1316 CD1 LEU A 641 4.453 10.268 11.589 1.00 42.04 C ATOM 1317 CD2 LEU A 641 3.815 7.909 11.074 1.00 48.05 C ATOM 1318 H LEU A 641 7.546 7.571 11.340 1.00 0.00 H ATOM 1319 N ALA A 642 8.402 8.402 8.191 1.00 48.16 N ATOM 1320 CA ALA A 642 9.256 8.555 6.996 1.00 51.71 C ATOM 1321 C ALA A 642 9.433 7.222 6.266 1.00 46.93 C ATOM 1322 O ALA A 642 9.258 7.158 5.058 1.00 46.84 O ATOM 1323 CB ALA A 642 10.613 9.115 7.374 1.00 52.08 C ATOM 1324 H ALA A 642 8.778 8.690 9.117 1.00 0.00 H ATOM 1325 N GLY A 643 9.745 6.173 7.027 1.00 52.28 N ATOM 1326 CA GLY A 643 9.789 4.788 6.525 1.00 53.00 C ATOM 1327 C GLY A 643 8.557 4.349 5.738 1.00 61.31 C ATOM 1328 O GLY A 643 8.682 3.776 4.654 1.00 56.87 O ATOM 1329 H GLY A 643 9.969 6.341 8.029 1.00 0.00 H ATOM 1330 N LEU A 644 7.371 4.645 6.273 1.00 62.01 N ATOM 1331 CA LEU A 644 6.085 4.378 5.591 1.00 56.84 C ATOM 1332 C LEU A 644 5.690 5.405 4.526 1.00 45.74 C ATOM 1333 O LEU A 644 4.632 5.282 3.909 1.00 55.25 O ATOM 1334 CB LEU A 644 4.951 4.289 6.617 1.00 56.68 C ATOM 1335 CG LEU A 644 4.990 3.154 7.641 1.00 65.17 C ATOM 1336 CD1 LEU A 644 3.767 3.283 8.537 1.00 65.64 C ATOM 1337 CD2 LEU A 644 5.015 1.776 6.988 1.00 64.40 C ATOM 1338 H LEU A 644 7.349 5.085 7.215 1.00 0.00 H ATOM 1339 N HIS A 645 6.525 6.420 4.332 1.00 49.13 N ATOM 1340 CA HIS A 645 6.327 7.491 3.347 1.00 42.96 C ATOM 1341 C HIS A 645 5.103 8.362 3.616 1.00 47.96 C ATOM 1342 O HIS A 645 4.511 8.938 2.695 1.00 44.87 O ATOM 1343 CB HIS A 645 6.368 6.926 1.921 1.00 55.20 C ATOM 1344 CG HIS A 645 7.532 6.013 1.696 1.00 50.70 C ATOM 1345 ND1 HIS A 645 8.824 6.478 1.566 1.00 56.09 N ATOM 1346 CD2 HIS A 645 7.610 4.662 1.657 1.00 52.98 C ATOM 1347 CE1 HIS A 645 9.645 5.453 1.424 1.00 67.21 C ATOM 1348 NE2 HIS A 645 8.933 4.339 1.475 1.00 55.57 N ATOM 1349 H HIS A 645 7.381 6.459 4.921 1.00 0.00 H ATOM 1350 N PHE A 646 4.779 8.501 4.904 1.00 45.37 N ATOM 1351 CA PHE A 646 3.695 9.364 5.373 1.00 49.41 C ATOM 1352 C PHE A 646 4.238 10.765 5.708 1.00 39.67 C ATOM 1353 O PHE A 646 5.261 10.882 6.364 1.00 41.87 O ATOM 1354 CB PHE A 646 3.069 8.737 6.624 1.00 50.31 C ATOM 1355 CG PHE A 646 1.899 9.498 7.164 1.00 47.93 C ATOM 1356 CD1 PHE A 646 0.636 9.321 6.617 1.00 45.76 C ATOM 1357 CD2 PHE A 646 2.053 10.388 8.230 1.00 51.13 C ATOM 1358 CE1 PHE A 646 -0.454 10.024 7.112 1.00 55.10 C ATOM 1359 CE2 PHE A 646 0.965 11.095 8.723 1.00 45.20 C ATOM 1360 CZ PHE A 646 -0.291 10.913 8.165 1.00 50.50 C ATOM 1361 H PHE A 646 5.326 7.968 5.610 1.00 0.00 H ATOM 1362 N VAL A 647 3.538 11.807 5.267 1.00 40.13 N ATOM 1363 CA VAL A 647 3.874 13.204 5.566 1.00 39.67 C ATOM 1364 C VAL A 647 2.885 13.719 6.617 1.00 39.76 C ATOM 1365 O VAL A 647 1.689 13.787 6.348 1.00 36.85 O ATOM 1366 CB VAL A 647 3.767 14.092 4.309 1.00 40.79 C ATOM 1367 CG1 VAL A 647 4.270 15.501 4.591 1.00 49.00 C ATOM 1368 CG2 VAL A 647 4.555 13.486 3.149 1.00 49.96 C ATOM 1369 H VAL A 647 2.703 11.620 4.675 1.00 0.00 H ATOM 1370 N HIS A 648 3.387 14.065 7.806 1.00 44.25 N ATOM 1371 CA HIS A 648 2.547 14.551 8.910 1.00 41.36 C ATOM 1372 C HIS A 648 1.891 15.897 8.591 1.00 38.84 C ATOM 1373 O HIS A 648 0.670 16.019 8.683 1.00 38.77 O ATOM 1374 CB HIS A 648 3.374 14.633 10.205 1.00 41.47 C ATOM 1375 CG HIS A 648 2.552 14.730 11.458 1.00 37.20 C ATOM 1376 ND1 HIS A 648 1.746 15.810 11.749 1.00 36.58 N ATOM 1377 CD2 HIS A 648 2.424 13.883 12.504 1.00 39.05 C ATOM 1378 CE1 HIS A 648 1.154 15.623 12.913 1.00 41.66 C ATOM 1379 NE2 HIS A 648 1.554 14.464 13.395 1.00 35.48 N ATOM 1380 H HIS A 648 4.413 13.987 7.956 1.00 0.00 H ATOM 1381 N ARG A 649 2.706 16.901 8.252 1.00 43.40 N ATOM 1382 CA ARG A 649 2.264 18.284 7.902 1.00 38.77 C ATOM 1383 C ARG A 649 1.943 19.249 9.064 1.00 38.91 C ATOM 1384 O ARG A 649 1.737 20.441 8.846 1.00 39.89 O ATOM 1385 CB ARG A 649 1.089 18.298 6.912 1.00 46.46 C ATOM 1386 CG ARG A 649 1.279 17.449 5.658 1.00 44.69 C ATOM 1387 CD ARG A 649 -0.026 17.344 4.885 1.00 52.83 C ATOM 1388 NE ARG A 649 -0.518 18.648 4.421 1.00 58.78 N ATOM 1389 CZ ARG A 649 -0.714 19.020 3.144 1.00 60.74 C ATOM 1390 NH1 ARG A 649 -0.465 18.204 2.119 1.00 57.19 N ATOM 1391 NH2 ARG A 649 -1.174 20.244 2.883 1.00 56.79 N ATOM 1392 HE ARG A 649 -0.736 19.354 5.153 1.00 0.00 H ATOM 1393 HH12 ARG A 649 -0.629 18.528 1.145 1.00 0.00 H ATOM 1394 HH11 ARG A 649 -0.107 17.244 2.294 1.00 0.00 H ATOM 1395 HH22 ARG A 649 -1.329 20.542 1.899 1.00 0.00 H ATOM 1396 HH21 ARG A 649 -1.378 20.900 3.664 1.00 0.00 H ATOM 1397 H ARG A 649 3.727 16.704 8.230 1.00 0.00 H ATOM 1398 N ASP A 650 1.940 18.749 10.288 1.00 40.66 N ATOM 1399 CA ASP A 650 1.629 19.552 11.487 1.00 40.76 C ATOM 1400 C ASP A 650 2.357 18.992 12.711 1.00 37.13 C ATOM 1401 O ASP A 650 1.788 18.909 13.801 1.00 32.78 O ATOM 1402 CB ASP A 650 0.104 19.639 11.738 1.00 34.78 C ATOM 1403 CG ASP A 650 -0.279 20.751 12.752 1.00 36.22 C ATOM 1404 OD1 ASP A 650 0.548 21.637 13.089 1.00 36.75 O ATOM 1405 OD2 ASP A 650 -1.417 20.729 13.255 1.00 37.60 O ATOM 1406 H ASP A 650 2.168 17.742 10.412 1.00 0.00 H ATOM 1407 N LEU A 651 3.621 18.616 12.522 1.00 32.24 N ATOM 1408 CA LEU A 651 4.468 18.185 13.622 1.00 37.21 C ATOM 1409 C LEU A 651 4.844 19.390 14.509 1.00 33.91 C ATOM 1410 O LEU A 651 5.397 20.377 14.040 1.00 31.03 O ATOM 1411 CB LEU A 651 5.730 17.510 13.103 1.00 37.85 C ATOM 1412 CG LEU A 651 6.684 16.964 14.171 1.00 40.19 C ATOM 1413 CD1 LEU A 651 6.075 15.772 14.894 1.00 42.12 C ATOM 1414 CD2 LEU A 651 8.024 16.597 13.543 1.00 49.12 C ATOM 1415 H LEU A 651 4.013 18.631 11.559 1.00 0.00 H ATOM 1416 N ALA A 652 4.514 19.280 15.783 1.00 30.44 N ATOM 1417 CA ALA A 652 4.801 20.283 16.800 1.00 28.61 C ATOM 1418 C ALA A 652 4.604 19.573 18.128 1.00 31.43 C ATOM 1419 O ALA A 652 3.945 18.527 18.160 1.00 32.93 O ATOM 1420 CB ALA A 652 3.835 21.451 16.681 1.00 29.85 C ATOM 1421 H ALA A 652 4.015 18.418 16.081 1.00 0.00 H ATOM 1422 N THR A 653 5.125 20.146 19.210 1.00 28.81 N ATOM 1423 CA THR A 653 5.004 19.530 20.553 1.00 32.22 C ATOM 1424 C THR A 653 3.542 19.416 21.040 1.00 31.76 C ATOM 1425 O THR A 653 3.193 18.466 21.740 1.00 30.17 O ATOM 1426 CB THR A 653 5.886 20.212 21.624 1.00 29.42 C ATOM 1427 OG1 THR A 653 5.490 21.572 21.815 1.00 29.30 O ATOM 1428 CG2 THR A 653 7.380 20.139 21.231 1.00 30.93 C ATOM 1429 HG1 THR A 653 5.584 22.065 20.962 1.00 0.00 H ATOM 1430 H THR A 653 5.630 21.050 19.111 1.00 0.00 H ATOM 1431 N ARG A 654 2.695 20.355 20.631 1.00 30.38 N ATOM 1432 CA ARG A 654 1.259 20.279 20.898 1.00 31.82 C ATOM 1433 C ARG A 654 0.590 19.004 20.349 1.00 30.82 C ATOM 1434 O ARG A 654 -0.405 18.567 20.892 1.00 30.45 O ATOM 1435 CB ARG A 654 0.534 21.522 20.373 1.00 31.21 C ATOM 1436 CG ARG A 654 0.543 21.678 18.858 1.00 28.78 C ATOM 1437 CD ARG A 654 -0.215 22.915 18.424 1.00 34.12 C ATOM 1438 NE ARG A 654 -0.052 23.055 16.985 1.00 33.86 N ATOM 1439 CZ ARG A 654 1.017 23.567 16.374 1.00 38.26 C ATOM 1440 NH1 ARG A 654 2.040 24.057 17.069 1.00 34.57 N ATOM 1441 NH2 ARG A 654 1.068 23.594 15.042 1.00 39.61 N ATOM 1442 HE ARG A 654 -0.834 22.729 16.383 1.00 0.00 H ATOM 1443 HH12 ARG A 654 2.864 24.452 16.573 1.00 0.00 H ATOM 1444 HH11 ARG A 654 2.016 24.045 18.109 1.00 0.00 H ATOM 1445 HH22 ARG A 654 1.900 23.992 14.561 1.00 0.00 H ATOM 1446 HH21 ARG A 654 0.276 23.217 14.484 1.00 0.00 H ATOM 1447 H ARG A 654 3.066 21.171 20.103 1.00 0.00 H ATOM 1448 N ASN A 655 1.148 18.426 19.288 1.00 31.40 N ATOM 1449 CA ASN A 655 0.655 17.177 18.705 1.00 32.03 C ATOM 1450 C ASN A 655 1.412 15.916 19.146 1.00 35.65 C ATOM 1451 O ASN A 655 1.304 14.865 18.504 1.00 31.28 O ATOM 1452 CB ASN A 655 0.628 17.311 17.175 1.00 31.73 C ATOM 1453 CG ASN A 655 -0.519 18.170 16.690 1.00 33.55 C ATOM 1454 OD1 ASN A 655 -1.602 18.168 17.270 1.00 37.97 O ATOM 1455 ND2 ASN A 655 -0.299 18.895 15.606 1.00 38.11 N ATOM 1456 HD22 ASN A 655 0.632 18.870 15.144 1.00 0.00 H ATOM 1457 HD21 ASN A 655 -1.057 19.491 15.216 1.00 0.00 H ATOM 1458 H ASN A 655 1.974 18.884 18.852 1.00 0.00 H ATOM 1459 N CYS A 656 2.153 16.022 20.249 1.00 28.96 N ATOM 1460 CA CYS A 656 2.796 14.887 20.886 1.00 31.76 C ATOM 1461 C CYS A 656 2.197 14.724 22.277 1.00 31.06 C ATOM 1462 O CYS A 656 1.863 15.715 22.913 1.00 33.69 O ATOM 1463 CB CYS A 656 4.311 15.108 20.984 1.00 32.70 C ATOM 1464 SG CYS A 656 5.115 15.235 19.364 1.00 34.50 S ATOM 1465 H CYS A 656 2.276 16.963 20.674 1.00 0.00 H ATOM 1466 N LEU A 657 2.056 13.479 22.730 1.00 29.11 N ATOM 1467 CA LEU A 657 1.594 13.170 24.093 1.00 31.26 C ATOM 1468 C LEU A 657 2.677 12.545 24.946 1.00 29.69 C ATOM 1469 O LEU A 657 3.558 11.848 24.437 1.00 30.47 O ATOM 1470 CB LEU A 657 0.417 12.193 24.070 1.00 36.67 C ATOM 1471 CG LEU A 657 -0.819 12.691 23.358 1.00 35.36 C ATOM 1472 CD1 LEU A 657 -1.848 11.575 23.213 1.00 47.06 C ATOM 1473 CD2 LEU A 657 -1.429 13.904 24.039 1.00 37.24 C ATOM 1474 H LEU A 657 2.283 12.690 22.092 1.00 0.00 H ATOM 1475 N VAL A 658 2.547 12.744 26.256 1.00 29.36 N ATOM 1476 CA VAL A 658 3.508 12.273 27.227 1.00 31.91 C ATOM 1477 C VAL A 658 2.780 11.424 28.269 1.00 36.05 C ATOM 1478 O VAL A 658 1.841 11.888 28.926 1.00 32.88 O ATOM 1479 CB VAL A 658 4.231 13.433 27.941 1.00 34.11 C ATOM 1480 CG1 VAL A 658 5.380 12.895 28.776 1.00 35.05 C ATOM 1481 CG2 VAL A 658 4.749 14.464 26.942 1.00 35.86 C ATOM 1482 H VAL A 658 1.713 13.264 26.597 1.00 0.00 H ATOM 1483 N GLY A 659 3.229 10.185 28.413 1.00 33.76 N ATOM 1484 CA GLY A 659 2.621 9.230 29.336 1.00 38.92 C ATOM 1485 C GLY A 659 3.523 8.911 30.512 1.00 40.57 C ATOM 1486 O GLY A 659 4.581 9.522 30.700 1.00 35.55 O ATOM 1487 H GLY A 659 4.046 9.881 27.846 1.00 0.00 H ATOM 1488 N GLN A 660 3.082 7.935 31.298 1.00 42.60 N ATOM 1489 CA GLN A 660 3.810 7.459 32.475 1.00 43.87 C ATOM 1490 C GLN A 660 5.229 7.035 32.099 1.00 38.55 C ATOM 1491 O GLN A 660 5.439 6.437 31.055 1.00 42.62 O ATOM 1492 CB GLN A 660 3.071 6.276 33.100 1.00 50.36 C ATOM 1493 CG GLN A 660 3.358 6.058 34.576 1.00 60.72 C ATOM 1494 CD GLN A 660 2.352 5.105 35.193 1.00 67.18 C ATOM 1495 OE1 GLN A 660 2.181 3.985 34.707 1.00 69.52 O ATOM 1496 NE2 GLN A 660 1.668 5.543 36.255 1.00 65.08 N ATOM 1497 HE22 GLN A 660 1.846 6.496 36.631 1.00 0.00 H ATOM 1498 HE21 GLN A 660 0.958 4.931 36.705 1.00 0.00 H ATOM 1499 H GLN A 660 2.173 7.486 31.065 1.00 0.00 H ATOM 1500 N GLY A 661 6.193 7.359 32.954 1.00 43.17 N ATOM 1501 CA GLY A 661 7.621 7.136 32.676 1.00 42.62 C ATOM 1502 C GLY A 661 8.164 8.010 31.555 1.00 44.99 C ATOM 1503 O GLY A 661 9.175 7.680 30.950 1.00 43.91 O ATOM 1504 H GLY A 661 5.926 7.790 33.862 1.00 0.00 H ATOM 1505 N LEU A 662 7.487 9.130 31.297 1.00 49.12 N ATOM 1506 CA LEU A 662 7.831 10.067 30.229 1.00 43.52 C ATOM 1507 C LEU A 662 8.013 9.414 28.868 1.00 43.73 C ATOM 1508 O LEU A 662 8.948 9.723 28.141 1.00 40.75 O ATOM 1509 CB LEU A 662 9.075 10.874 30.616 1.00 47.87 C ATOM 1510 CG LEU A 662 9.060 11.556 31.985 1.00 52.80 C ATOM 1511 CD1 LEU A 662 10.262 12.490 32.079 1.00 51.17 C ATOM 1512 CD2 LEU A 662 7.773 12.319 32.278 1.00 47.59 C ATOM 1513 H LEU A 662 6.663 9.350 31.893 1.00 0.00 H ATOM 1514 N VAL A 663 7.108 8.498 28.536 1.00 35.87 N ATOM 1515 CA VAL A 663 7.033 7.938 27.203 1.00 34.86 C ATOM 1516 C VAL A 663 6.359 9.009 26.350 1.00 36.36 C ATOM 1517 O VAL A 663 5.365 9.587 26.760 1.00 35.90 O ATOM 1518 CB VAL A 663 6.244 6.608 27.194 1.00 37.42 C ATOM 1519 CG1 VAL A 663 6.061 6.071 25.785 1.00 36.02 C ATOM 1520 CG2 VAL A 663 6.975 5.576 28.035 1.00 46.68 C ATOM 1521 H VAL A 663 6.432 8.173 29.257 1.00 0.00 H ATOM 1522 N VAL A 664 6.910 9.265 25.169 1.00 36.06 N ATOM 1523 CA VAL A 664 6.464 10.363 24.311 1.00 36.32 C ATOM 1524 C VAL A 664 6.049 9.789 22.965 1.00 33.30 C ATOM 1525 O VAL A 664 6.804 9.045 22.345 1.00 40.04 O ATOM 1526 CB VAL A 664 7.566 11.428 24.114 1.00 36.28 C ATOM 1527 CG1 VAL A 664 7.095 12.536 23.179 1.00 39.79 C ATOM 1528 CG2 VAL A 664 7.963 12.029 25.449 1.00 34.49 C ATOM 1529 H VAL A 664 7.690 8.661 24.841 1.00 0.00 H ATOM 1530 N LYS A 665 4.862 10.166 22.508 1.00 32.00 N ATOM 1531 CA LYS A 665 4.283 9.624 21.277 1.00 37.33 C ATOM 1532 C LYS A 665 3.649 10.702 20.426 1.00 30.95 C ATOM 1533 O LYS A 665 2.984 11.599 20.947 1.00 32.74 O ATOM 1534 CB LYS A 665 3.219 8.571 21.597 1.00 33.85 C ATOM 1535 CG LYS A 665 3.737 7.415 22.422 1.00 36.49 C ATOM 1536 CD LYS A 665 2.715 6.300 22.588 1.00 36.82 C ATOM 1537 CE LYS A 665 3.255 5.274 23.576 1.00 36.47 C ATOM 1538 NZ LYS A 665 2.445 4.044 23.600 1.00 38.45 N ATOM 1539 HZ1 LYS A 665 1.470 4.278 23.877 1.00 0.00 H ATOM 1540 HZ2 LYS A 665 2.444 3.613 22.654 1.00 0.00 H ATOM 1541 HZ3 LYS A 665 2.851 3.376 24.286 1.00 0.00 H ATOM 1542 H LYS A 665 4.322 10.874 23.045 1.00 0.00 H ATOM 1543 N ILE A 666 3.816 10.553 19.112 1.00 31.67 N ATOM 1544 CA ILE A 666 3.293 11.489 18.134 1.00 31.67 C ATOM 1545 C ILE A 666 1.846 11.173 17.816 1.00 35.09 C ATOM 1546 O ILE A 666 1.487 10.012 17.648 1.00 35.08 O ATOM 1547 CB ILE A 666 4.081 11.416 16.806 1.00 31.93 C ATOM 1548 CG1 ILE A 666 5.547 11.776 17.047 1.00 41.85 C ATOM 1549 CG2 ILE A 666 3.499 12.373 15.756 1.00 35.20 C ATOM 1550 CD1 ILE A 666 6.438 11.527 15.849 1.00 39.10 C ATOM 1551 H ILE A 666 4.347 9.726 18.771 1.00 0.00 H ATOM 1552 N GLY A 667 1.048 12.228 17.702 1.00 34.16 N ATOM 1553 CA GLY A 667 -0.306 12.173 17.156 1.00 35.08 C ATOM 1554 C GLY A 667 -0.591 13.389 16.277 1.00 35.93 C ATOM 1555 O GLY A 667 0.321 14.094 15.840 1.00 31.26 O ATOM 1556 H GLY A 667 1.409 13.150 18.021 1.00 0.00 H ATOM 1557 N ASP A 668 -1.875 13.614 16.012 1.00 35.85 N ATOM 1558 CA ASP A 668 -2.347 14.761 15.244 1.00 37.44 C ATOM 1559 C ASP A 668 -3.762 15.075 15.732 1.00 41.80 C ATOM 1560 O ASP A 668 -4.734 14.458 15.295 1.00 39.75 O ATOM 1561 CB ASP A 668 -2.325 14.447 13.732 1.00 45.20 C ATOM 1562 CG ASP A 668 -2.428 15.700 12.855 1.00 50.71 C ATOM 1563 OD1 ASP A 668 -2.609 16.815 13.382 1.00 50.58 O ATOM 1564 OD2 ASP A 668 -2.327 15.570 11.614 1.00 52.78 O ATOM 1565 H ASP A 668 -2.579 12.937 16.371 1.00 0.00 H ATOM 1566 N PHE A 669 -3.858 16.012 16.664 1.00 37.39 N ATOM 1567 CA PHE A 669 -5.122 16.299 17.332 1.00 51.87 C ATOM 1568 C PHE A 669 -5.806 17.435 16.630 1.00 55.66 C ATOM 1569 O PHE A 669 -5.300 18.558 16.635 1.00 58.73 O ATOM 1570 CB PHE A 669 -4.909 16.621 18.816 1.00 53.27 C ATOM 1571 CG PHE A 669 -3.831 15.803 19.447 1.00 44.16 C ATOM 1572 CD1 PHE A 669 -3.732 14.452 19.167 1.00 54.43 C ATOM 1573 CD2 PHE A 669 -2.902 16.387 20.299 1.00 58.37 C ATOM 1574 CE1 PHE A 669 -2.727 13.689 19.720 1.00 57.80 C ATOM 1575 CE2 PHE A 669 -1.896 15.630 20.869 1.00 50.97 C ATOM 1576 CZ PHE A 669 -1.813 14.279 20.572 1.00 57.00 C ATOM 1577 H PHE A 669 -3.011 16.556 16.925 1.00 0.00 H ATOM 1578 N GLY A 670 -6.962 17.144 16.032 1.00 63.52 N ATOM 1579 CA GLY A 670 -7.793 18.163 15.380 1.00 67.67 C ATOM 1580 C GLY A 670 -8.042 19.318 16.332 1.00 74.12 C ATOM 1581 O GLY A 670 -8.082 20.486 15.934 1.00 97.77 O ATOM 1582 H GLY A 670 -7.287 16.156 16.028 1.00 0.00 H ATOM 1583 N MET A 671 -8.089 19.015 17.515 1.00 76.80 N ATOM 1584 CA MET A 671 -8.297 19.848 18.697 1.00 71.74 C ATOM 1585 C MET A 671 -7.224 20.902 19.027 1.00 68.76 C ATOM 1586 O MET A 671 -7.445 21.755 19.893 1.00 68.23 O ATOM 1587 CB MET A 671 -8.461 18.925 19.904 1.00 61.46 C ATOM 1588 CG MET A 671 -9.662 18.011 19.785 1.00 61.29 C ATOM 1589 SD MET A 671 -9.828 16.955 21.231 1.00 46.24 S ATOM 1590 CE MET A 671 -8.591 15.708 20.874 1.00 44.89 C ATOM 1591 H MET A 671 -7.960 18.002 17.712 1.00 0.00 H ATOM 1592 N SER A 672 -6.015 20.691 18.408 1.00 60.26 N ATOM 1593 CA SER A 672 -4.836 21.562 18.585 1.00 56.26 C ATOM 1594 C SER A 672 -5.144 22.939 18.021 1.00 50.02 C ATOM 1595 O SER A 672 -4.656 23.950 18.516 1.00 60.99 O ATOM 1596 CB SER A 672 -3.623 20.975 17.856 1.00 55.06 C ATOM 1597 OG SER A 672 -3.075 19.888 18.580 1.00 58.88 O ATOM 1598 HG SER A 672 -2.294 19.527 18.090 1.00 0.00 H ATOM 1599 H SER A 672 -5.925 19.869 17.777 1.00 0.00 H ATOM 1600 N ARG A 673 -5.990 22.959 16.998 1.00 62.25 N ATOM 1601 CA ARG A 673 -6.476 24.191 16.385 1.00 57.11 C ATOM 1602 C ARG A 673 -7.308 25.072 17.331 1.00 61.78 C ATOM 1603 O ARG A 673 -7.584 26.226 17.006 1.00 63.39 O ATOM 1604 CB ARG A 673 -7.302 23.854 15.142 1.00 55.50 C ATOM 1605 CG ARG A 673 -6.472 23.565 13.911 1.00 64.28 C ATOM 1606 CD ARG A 673 -5.879 22.160 13.877 1.00 69.61 C ATOM 1607 NE ARG A 673 -4.874 22.055 12.822 1.00 69.89 N ATOM 1608 CZ ARG A 673 -5.130 22.109 11.512 1.00 69.52 C ATOM 1609 NH1 ARG A 673 -6.374 22.252 11.059 1.00 64.69 N ATOM 1610 NH2 ARG A 673 -4.131 22.018 10.636 1.00 59.65 N ATOM 1611 HE ARG A 673 -3.884 21.929 13.113 1.00 0.00 H ATOM 1612 HH12 ARG A 673 -6.553 22.292 10.035 1.00 0.00 H ATOM 1613 HH11 ARG A 673 -7.166 22.324 11.729 1.00 0.00 H ATOM 1614 HH22 ARG A 673 -4.329 22.060 9.616 1.00 0.00 H ATOM 1615 HH21 ARG A 673 -3.153 21.905 10.972 1.00 0.00 H ATOM 1616 H ARG A 673 -6.323 22.051 16.614 1.00 0.00 H ATOM 1617 N ASP A 674 -7.702 24.531 18.487 1.00 65.61 N ATOM 1618 CA ASP A 674 -8.526 25.244 19.468 1.00 71.58 C ATOM 1619 C ASP A 674 -7.762 25.767 20.674 1.00 66.96 C ATOM 1620 O ASP A 674 -7.860 26.947 21.004 1.00 68.97 O ATOM 1621 CB ASP A 674 -9.648 24.332 19.937 1.00 68.37 C ATOM 1622 CG ASP A 674 -10.589 23.981 18.819 1.00 77.13 C ATOM 1623 OD1 ASP A 674 -11.288 24.898 18.336 1.00 74.25 O ATOM 1624 OD2 ASP A 674 -10.611 22.805 18.403 1.00 75.81 O ATOM 1625 H ASP A 674 -7.410 23.556 18.702 1.00 0.00 H ATOM 1626 N ILE A 675 -7.021 24.886 21.336 1.00 63.97 N ATOM 1627 CA ILE A 675 -6.214 25.282 22.504 1.00 59.91 C ATOM 1628 C ILE A 675 -5.047 26.146 22.047 1.00 54.26 C ATOM 1629 O ILE A 675 -4.658 27.099 22.724 1.00 55.08 O ATOM 1630 CB ILE A 675 -5.625 24.069 23.269 1.00 60.66 C ATOM 1631 CG1 ILE A 675 -6.703 23.018 23.576 1.00 63.62 C ATOM 1632 CG2 ILE A 675 -4.936 24.525 24.557 1.00 57.87 C ATOM 1633 CD1 ILE A 675 -7.928 23.552 24.237 1.00 48.19 C ATOM 1634 H ILE A 675 -7.010 23.894 21.023 1.00 0.00 H ATOM 1635 N TYR A 676 -4.488 25.778 20.899 1.00 48.86 N ATOM 1636 CA TYR A 676 -3.308 26.433 20.341 1.00 47.21 C ATOM 1637 C TYR A 676 -3.677 27.145 19.052 1.00 42.51 C ATOM 1638 O TYR A 676 -3.056 26.949 18.025 1.00 40.37 O ATOM 1639 CB TYR A 676 -2.219 25.396 20.102 1.00 48.93 C ATOM 1640 CG TYR A 676 -1.843 24.638 21.348 1.00 45.15 C ATOM 1641 CD1 TYR A 676 -0.978 25.192 22.272 1.00 40.05 C ATOM 1642 CD2 TYR A 676 -2.360 23.369 21.604 1.00 52.68 C ATOM 1643 CE1 TYR A 676 -0.625 24.517 23.416 1.00 52.52 C ATOM 1644 CE2 TYR A 676 -2.014 22.678 22.753 1.00 48.51 C ATOM 1645 CZ TYR A 676 -1.146 23.258 23.661 1.00 49.27 C ATOM 1646 OH TYR A 676 -0.781 22.607 24.819 1.00 43.42 O ATOM 1647 HH TYR A 676 -0.334 21.754 24.590 1.00 0.00 H ATOM 1648 H TYR A 676 -4.911 24.986 20.373 1.00 0.00 H HETATM 1649 N SEP A 677 -4.709 27.970 19.128 1.00 39.99 N HETATM 1650 CA SEP A 677 -5.214 28.713 17.975 1.00 45.71 C HETATM 1651 C SEP A 677 -4.165 29.677 17.440 1.00 44.93 C HETATM 1652 O SEP A 677 -4.022 29.811 16.226 1.00 38.97 O HETATM 1653 CB SEP A 677 -6.553 29.360 18.348 1.00 46.92 C HETATM 1654 OG SEP A 677 -6.640 30.673 17.831 1.00 72.58 O HETATM 1655 P SEP A 677 -7.145 31.926 18.709 1.00 94.90 P HETATM 1656 O3P SEP A 677 -6.600 31.742 20.107 1.00 86.81 O HETATM 1657 O2P SEP A 677 -8.652 31.800 18.606 1.00 74.62 O HETATM 1658 O1P SEP A 677 -6.511 33.093 17.979 1.00 72.53 O HETATM 1659 H SEP A 677 -5.180 28.095 20.047 1.00 0.00 H ATOM 1660 N THR A 678 -3.385 30.303 18.323 1.00 37.59 N ATOM 1661 CA THR A 678 -2.353 31.273 17.889 1.00 39.58 C ATOM 1662 C THR A 678 -1.135 30.621 17.213 1.00 39.32 C ATOM 1663 O THR A 678 -0.288 31.319 16.668 1.00 36.67 O ATOM 1664 CB THR A 678 -1.858 32.159 19.044 1.00 43.87 C ATOM 1665 OG1 THR A 678 -1.236 31.351 20.047 1.00 48.07 O ATOM 1666 CG2 THR A 678 -3.022 32.941 19.665 1.00 53.01 C ATOM 1667 HG1 THR A 678 -0.921 31.929 20.786 1.00 0.00 H ATOM 1668 H THR A 678 -3.504 30.106 19.337 1.00 0.00 H ATOM 1669 N ASP A 679 -1.042 29.294 17.279 1.00 35.93 N ATOM 1670 CA ASP A 679 -0.052 28.524 16.530 1.00 35.84 C ATOM 1671 C ASP A 679 -0.421 28.308 15.056 1.00 34.94 C ATOM 1672 O ASP A 679 0.318 27.644 14.340 1.00 30.90 O ATOM 1673 CB ASP A 679 0.160 27.157 17.196 1.00 32.31 C ATOM 1674 CG ASP A 679 0.934 27.250 18.507 1.00 39.30 C ATOM 1675 OD1 ASP A 679 1.475 28.328 18.835 1.00 32.95 O ATOM 1676 OD2 ASP A 679 1.014 26.222 19.204 1.00 35.45 O ATOM 1677 H ASP A 679 -1.706 28.781 17.893 1.00 0.00 H ATOM 1678 N TYR A 680 -1.560 28.838 14.622 1.00 34.44 N ATOM 1679 CA TYR A 680 -1.990 28.723 13.243 1.00 39.93 C ATOM 1680 C TYR A 680 -2.311 30.079 12.666 1.00 38.96 C ATOM 1681 O TYR A 680 -2.766 30.982 13.373 1.00 37.75 O ATOM 1682 CB TYR A 680 -3.208 27.799 13.125 1.00 39.06 C ATOM 1683 CG TYR A 680 -2.928 26.402 13.610 1.00 34.79 C ATOM 1684 CD1 TYR A 680 -3.017 26.097 14.967 1.00 36.46 C ATOM 1685 CD2 TYR A 680 -2.525 25.400 12.735 1.00 36.35 C ATOM 1686 CE1 TYR A 680 -2.747 24.828 15.438 1.00 37.74 C ATOM 1687 CE2 TYR A 680 -2.260 24.115 13.195 1.00 32.15 C ATOM 1688 CZ TYR A 680 -2.370 23.839 14.549 1.00 34.24 C ATOM 1689 OH TYR A 680 -2.101 22.584 15.038 1.00 33.17 O ATOM 1690 HH TYR A 680 -1.164 22.343 14.828 1.00 0.00 H ATOM 1691 H TYR A 680 -2.163 29.353 15.295 1.00 0.00 H ATOM 1692 N TYR A 681 -2.058 30.199 11.365 1.00 40.01 N ATOM 1693 CA TYR A 681 -2.432 31.372 10.586 1.00 39.19 C ATOM 1694 C TYR A 681 -3.628 30.976 9.714 1.00 35.72 C ATOM 1695 O TYR A 681 -3.534 30.048 8.910 1.00 34.74 O ATOM 1696 CB TYR A 681 -1.235 31.836 9.753 1.00 40.38 C ATOM 1697 CG TYR A 681 -1.536 32.963 8.788 1.00 42.62 C ATOM 1698 CD1 TYR A 681 -1.964 34.214 9.241 1.00 44.97 C ATOM 1699 CD2 TYR A 681 -1.381 32.780 7.411 1.00 45.07 C ATOM 1700 CE1 TYR A 681 -2.233 35.248 8.344 1.00 42.34 C ATOM 1701 CE2 TYR A 681 -1.644 33.806 6.515 1.00 45.96 C ATOM 1702 CZ TYR A 681 -2.073 35.026 6.984 1.00 39.85 C ATOM 1703 OH TYR A 681 -2.330 36.017 6.074 1.00 48.29 O ATOM 1704 HH TYR A 681 -2.628 36.832 6.551 1.00 0.00 H ATOM 1705 H TYR A 681 -1.570 29.418 10.881 1.00 0.00 H ATOM 1706 N ARG A 682 -4.750 31.663 9.922 1.00 41.36 N ATOM 1707 CA ARG A 682 -6.016 31.351 9.268 1.00 52.75 C ATOM 1708 C ARG A 682 -6.068 32.033 7.915 1.00 51.71 C ATOM 1709 O ARG A 682 -5.896 33.249 7.839 1.00 52.09 O ATOM 1710 CB ARG A 682 -7.203 31.836 10.113 1.00 55.11 C ATOM 1711 CG ARG A 682 -7.550 30.924 11.278 1.00 70.66 C ATOM 1712 CD ARG A 682 -8.520 31.535 12.248 1.00 52.52 C ATOM 1713 NE ARG A 682 -7.850 32.459 13.162 1.00 50.42 N ATOM 1714 CZ ARG A 682 -7.087 32.094 14.194 1.00 51.16 C ATOM 1715 NH1 ARG A 682 -6.869 30.810 14.461 1.00 49.97 N ATOM 1716 NH2 ARG A 682 -6.526 33.023 14.959 1.00 51.10 N ATOM 1717 HE ARG A 682 -7.978 33.478 12.995 1.00 0.00 H ATOM 1718 HH12 ARG A 682 -6.272 30.541 15.269 1.00 0.00 H ATOM 1719 HH11 ARG A 682 -7.296 30.075 13.862 1.00 0.00 H ATOM 1720 HH22 ARG A 682 -5.931 32.743 15.764 1.00 0.00 H ATOM 1721 HH21 ARG A 682 -6.682 34.030 14.753 1.00 0.00 H ATOM 1722 H ARG A 682 -4.722 32.464 10.585 1.00 0.00 H ATOM 1723 N VAL A 683 -6.333 31.250 6.874 1.00 52.49 N ATOM 1724 CA VAL A 683 -6.452 31.750 5.492 1.00 58.92 C ATOM 1725 C VAL A 683 -7.771 31.307 4.865 1.00 60.22 C ATOM 1726 O VAL A 683 -8.690 32.114 4.720 1.00 69.05 O ATOM 1727 CB VAL A 683 -5.269 31.306 4.595 1.00 46.40 C ATOM 1728 CG1 VAL A 683 -4.010 32.038 5.004 1.00 48.14 C ATOM 1729 CG2 VAL A 683 -5.059 29.797 4.621 1.00 50.30 C ATOM 1730 H VAL A 683 -6.463 30.232 7.043 1.00 0.00 H TER 1731 VAL A 683 ATOM 1732 N THR A 687 -9.203 27.184 6.387 1.00 66.89 N ATOM 1733 CA THR A 687 -7.881 26.552 6.459 1.00 56.14 C ATOM 1734 C THR A 687 -6.993 27.217 7.526 1.00 52.60 C ATOM 1735 O THR A 687 -7.036 28.433 7.722 1.00 57.19 O ATOM 1736 CB THR A 687 -7.173 26.589 5.089 1.00 64.93 C ATOM 1737 OG1 THR A 687 -8.050 26.059 4.087 1.00 60.17 O ATOM 1738 CG2 THR A 687 -5.860 25.773 5.103 1.00 61.11 C ATOM 1739 HG1 THR A 687 -7.596 26.082 3.207 1.00 0.00 H ATOM 1740 HN3 THR A 687 -9.093 28.189 6.143 1.00 0.00 H ATOM 1741 HN2 THR A 687 -9.677 27.099 7.309 1.00 0.00 H ATOM 1742 HN1 THR A 687 -9.773 26.710 5.658 1.00 0.00 H ATOM 1743 N MET A 688 -6.180 26.404 8.194 1.00 47.24 N ATOM 1744 CA MET A 688 -5.280 26.875 9.240 1.00 43.76 C ATOM 1745 C MET A 688 -3.894 26.291 9.019 1.00 38.76 C ATOM 1746 O MET A 688 -3.723 25.074 9.011 1.00 47.44 O ATOM 1747 CB MET A 688 -5.831 26.510 10.618 1.00 51.94 C ATOM 1748 CG MET A 688 -6.783 27.565 11.152 1.00 55.62 C ATOM 1749 SD MET A 688 -7.718 27.023 12.583 1.00 73.38 S ATOM 1750 CE MET A 688 -6.539 27.285 13.902 1.00 67.97 C ATOM 1751 H MET A 688 -6.186 25.391 7.961 1.00 0.00 H ATOM 1752 N LEU A 689 -2.914 27.174 8.824 1.00 34.95 N ATOM 1753 CA LEU A 689 -1.540 26.770 8.532 1.00 37.52 C ATOM 1754 C LEU A 689 -0.617 26.977 9.740 1.00 31.74 C ATOM 1755 O LEU A 689 -0.590 28.066 10.301 1.00 34.61 O ATOM 1756 CB LEU A 689 -1.013 27.570 7.350 1.00 39.35 C ATOM 1757 CG LEU A 689 -1.742 27.365 6.014 1.00 47.53 C ATOM 1758 CD1 LEU A 689 -1.252 28.399 5.021 1.00 52.48 C ATOM 1759 CD2 LEU A 689 -1.555 25.958 5.459 1.00 45.45 C ATOM 1760 H LEU A 689 -3.136 28.188 8.882 1.00 0.00 H ATOM 1761 N PRO A 690 0.179 25.951 10.109 1.00 34.07 N ATOM 1762 CA PRO A 690 1.129 26.089 11.205 1.00 33.14 C ATOM 1763 C PRO A 690 2.428 26.733 10.705 1.00 32.97 C ATOM 1764 O PRO A 690 3.485 26.106 10.695 1.00 31.72 O ATOM 1765 CB PRO A 690 1.321 24.641 11.658 1.00 33.87 C ATOM 1766 CG PRO A 690 1.217 23.858 10.395 1.00 36.19 C ATOM 1767 CD PRO A 690 0.202 24.579 9.549 1.00 40.49 C ATOM 1768 N ILE A 691 2.307 27.990 10.299 1.00 31.62 N ATOM 1769 CA ILE A 691 3.363 28.774 9.627 1.00 37.75 C ATOM 1770 C ILE A 691 4.713 28.735 10.331 1.00 34.51 C ATOM 1771 O ILE A 691 5.762 28.569 9.701 1.00 32.72 O ATOM 1772 CB ILE A 691 2.888 30.256 9.505 1.00 42.93 C ATOM 1773 CG1 ILE A 691 1.797 30.390 8.433 1.00 42.38 C ATOM 1774 CG2 ILE A 691 4.028 31.234 9.236 1.00 59.26 C ATOM 1775 CD1 ILE A 691 2.181 29.951 7.038 1.00 51.17 C ATOM 1776 H ILE A 691 1.395 28.461 10.467 1.00 0.00 H ATOM 1777 N ARG A 692 4.684 28.876 11.645 1.00 32.72 N ATOM 1778 CA ARG A 692 5.918 28.920 12.431 1.00 35.02 C ATOM 1779 C ARG A 692 6.720 27.631 12.379 1.00 32.98 C ATOM 1780 O ARG A 692 7.920 27.655 12.605 1.00 34.03 O ATOM 1781 CB ARG A 692 5.608 29.332 13.876 1.00 33.77 C ATOM 1782 CG ARG A 692 5.075 30.753 13.969 1.00 36.58 C ATOM 1783 CD ARG A 692 4.295 31.026 15.245 1.00 31.97 C ATOM 1784 NE ARG A 692 3.513 32.250 15.114 1.00 34.09 N ATOM 1785 CZ ARG A 692 3.949 33.494 15.312 1.00 39.23 C ATOM 1786 NH1 ARG A 692 5.209 33.734 15.680 1.00 37.99 N ATOM 1787 NH2 ARG A 692 3.107 34.521 15.138 1.00 32.09 N ATOM 1788 HE ARG A 692 2.516 32.141 14.839 1.00 0.00 H ATOM 1789 HH12 ARG A 692 5.530 34.712 15.829 1.00 0.00 H ATOM 1790 HH11 ARG A 692 5.870 32.943 15.817 1.00 0.00 H ATOM 1791 HH22 ARG A 692 3.437 35.495 15.290 1.00 0.00 H ATOM 1792 HH21 ARG A 692 2.123 34.344 14.851 1.00 0.00 H ATOM 1793 H ARG A 692 3.767 28.957 12.129 1.00 0.00 H ATOM 1794 N TRP A 693 6.059 26.517 12.068 1.00 29.16 N ATOM 1795 CA TRP A 693 6.696 25.214 11.922 1.00 30.42 C ATOM 1796 C TRP A 693 7.026 24.826 10.479 1.00 35.31 C ATOM 1797 O TRP A 693 7.567 23.753 10.247 1.00 30.83 O ATOM 1798 CB TRP A 693 5.791 24.138 12.554 1.00 32.33 C ATOM 1799 CG TRP A 693 5.839 24.173 14.048 1.00 29.28 C ATOM 1800 CD1 TRP A 693 6.604 23.379 14.855 1.00 34.21 C ATOM 1801 CD2 TRP A 693 5.135 25.061 14.909 1.00 28.37 C ATOM 1802 NE1 TRP A 693 6.411 23.708 16.160 1.00 31.98 N ATOM 1803 CE2 TRP A 693 5.519 24.747 16.231 1.00 29.26 C ATOM 1804 CE3 TRP A 693 4.213 26.103 14.700 1.00 32.62 C ATOM 1805 CZ2 TRP A 693 5.006 25.422 17.341 1.00 29.22 C ATOM 1806 CZ3 TRP A 693 3.707 26.787 15.807 1.00 27.96 C ATOM 1807 CH2 TRP A 693 4.115 26.448 17.110 1.00 32.41 C ATOM 1808 HE1 TRP A 693 6.866 23.246 16.973 1.00 0.00 H ATOM 1809 H TRP A 693 5.031 26.580 11.921 1.00 0.00 H ATOM 1810 N MET A 694 6.699 25.683 9.513 1.00 38.82 N ATOM 1811 CA MET A 694 6.769 25.311 8.093 1.00 35.17 C ATOM 1812 C MET A 694 8.053 25.843 7.411 1.00 33.94 C ATOM 1813 O MET A 694 8.481 26.960 7.689 1.00 33.40 O ATOM 1814 CB MET A 694 5.530 25.829 7.373 1.00 35.30 C ATOM 1815 CG MET A 694 4.262 25.033 7.647 1.00 34.87 C ATOM 1816 SD MET A 694 2.773 25.935 7.180 1.00 39.79 S ATOM 1817 CE MET A 694 2.974 26.025 5.394 1.00 40.68 C ATOM 1818 H MET A 694 6.386 26.641 9.771 1.00 0.00 H ATOM 1819 N PRO A 695 8.657 25.042 6.506 1.00 35.45 N ATOM 1820 CA PRO A 695 9.796 25.522 5.728 1.00 40.62 C ATOM 1821 C PRO A 695 9.390 26.495 4.610 1.00 45.91 C ATOM 1822 O PRO A 695 8.205 26.586 4.285 1.00 37.86 O ATOM 1823 CB PRO A 695 10.349 24.247 5.123 1.00 36.69 C ATOM 1824 CG PRO A 695 9.153 23.425 4.902 1.00 39.53 C ATOM 1825 CD PRO A 695 8.304 23.662 6.123 1.00 33.85 C ATOM 1826 N PRO A 696 10.373 27.216 4.017 1.00 47.29 N ATOM 1827 CA PRO A 696 10.060 28.185 2.950 1.00 45.19 C ATOM 1828 C PRO A 696 9.308 27.586 1.754 1.00 37.07 C ATOM 1829 O PRO A 696 8.412 28.240 1.223 1.00 44.24 O ATOM 1830 CB PRO A 696 11.444 28.704 2.525 1.00 49.45 C ATOM 1831 CG PRO A 696 12.309 28.471 3.708 1.00 43.21 C ATOM 1832 CD PRO A 696 11.814 27.194 4.315 1.00 39.35 C ATOM 1833 N GLU A 697 9.638 26.354 1.365 1.00 42.72 N ATOM 1834 CA GLU A 697 8.938 25.697 0.237 1.00 46.65 C ATOM 1835 C GLU A 697 7.458 25.385 0.501 1.00 48.90 C ATOM 1836 O GLU A 697 6.668 25.304 -0.439 1.00 42.79 O ATOM 1837 CB GLU A 697 9.680 24.444 -0.268 1.00 50.40 C ATOM 1838 CG GLU A 697 9.513 23.159 0.542 1.00 52.38 C ATOM 1839 CD GLU A 697 10.496 23.022 1.688 1.00 46.05 C ATOM 1840 OE1 GLU A 697 11.232 23.987 1.995 1.00 38.64 O ATOM 1841 OE2 GLU A 697 10.539 21.924 2.280 1.00 45.06 O ATOM 1842 H GLU A 697 10.398 25.847 1.861 1.00 0.00 H ATOM 1843 N SER A 698 7.093 25.190 1.768 1.00 40.56 N ATOM 1844 CA SER A 698 5.700 24.953 2.136 1.00 39.54 C ATOM 1845 C SER A 698 4.926 26.264 2.183 1.00 36.78 C ATOM 1846 O SER A 698 3.785 26.329 1.746 1.00 42.59 O ATOM 1847 CB SER A 698 5.605 24.230 3.474 1.00 36.29 C ATOM 1848 OG SER A 698 6.321 23.010 3.440 1.00 33.93 O ATOM 1849 HG SER A 698 5.944 22.427 2.735 1.00 0.00 H ATOM 1850 H SER A 698 7.818 25.207 2.513 1.00 0.00 H ATOM 1851 N ILE A 699 5.538 27.309 2.719 1.00 32.61 N ATOM 1852 CA ILE A 699 4.911 28.634 2.726 1.00 33.71 C ATOM 1853 C ILE A 699 4.803 29.210 1.302 1.00 35.99 C ATOM 1854 O ILE A 699 3.760 29.732 0.929 1.00 40.92 O ATOM 1855 CB ILE A 699 5.680 29.626 3.635 1.00 36.01 C ATOM 1856 CG1 ILE A 699 5.607 29.179 5.108 1.00 34.91 C ATOM 1857 CG2 ILE A 699 5.109 31.029 3.510 1.00 34.86 C ATOM 1858 CD1 ILE A 699 6.513 29.973 6.045 1.00 40.91 C ATOM 1859 H ILE A 699 6.480 27.187 3.142 1.00 0.00 H ATOM 1860 N LEU A 700 5.875 29.120 0.524 1.00 39.36 N ATOM 1861 CA LEU A 700 5.924 29.782 -0.792 1.00 44.12 C ATOM 1862 C LEU A 700 5.200 28.986 -1.863 1.00 40.22 C ATOM 1863 O LEU A 700 4.374 29.526 -2.590 1.00 49.09 O ATOM 1864 CB LEU A 700 7.373 30.021 -1.227 1.00 40.30 C ATOM 1865 CG LEU A 700 8.151 31.123 -0.502 1.00 45.80 C ATOM 1866 CD1 LEU A 700 9.626 31.050 -0.869 1.00 51.59 C ATOM 1867 CD2 LEU A 700 7.609 32.506 -0.831 1.00 45.22 C ATOM 1868 H LEU A 700 6.696 28.572 0.850 1.00 0.00 H ATOM 1869 N TYR A 701 5.534 27.705 -1.961 1.00 43.13 N ATOM 1870 CA TYR A 701 5.064 26.850 -3.051 1.00 40.96 C ATOM 1871 C TYR A 701 3.974 25.856 -2.659 1.00 48.21 C ATOM 1872 O TYR A 701 3.467 25.139 -3.519 1.00 42.09 O ATOM 1873 CB TYR A 701 6.235 26.067 -3.652 1.00 45.18 C ATOM 1874 CG TYR A 701 7.521 26.839 -3.826 1.00 40.87 C ATOM 1875 CD1 TYR A 701 7.527 28.165 -4.276 1.00 48.74 C ATOM 1876 CD2 TYR A 701 8.749 26.233 -3.556 1.00 50.90 C ATOM 1877 CE1 TYR A 701 8.720 28.863 -4.432 1.00 49.14 C ATOM 1878 CE2 TYR A 701 9.939 26.919 -3.715 1.00 43.69 C ATOM 1879 CZ TYR A 701 9.924 28.226 -4.152 1.00 49.03 C ATOM 1880 OH TYR A 701 11.122 28.882 -4.299 1.00 54.24 O ATOM 1881 HH TYR A 701 10.955 29.805 -4.617 1.00 0.00 H ATOM 1882 H TYR A 701 6.154 27.293 -1.235 1.00 0.00 H ATOM 1883 N ARG A 702 3.642 25.787 -1.369 1.00 53.90 N ATOM 1884 CA ARG A 702 2.608 24.871 -0.855 1.00 45.22 C ATOM 1885 C ARG A 702 2.922 23.412 -1.163 1.00 41.14 C ATOM 1886 O ARG A 702 2.051 22.639 -1.533 1.00 50.86 O ATOM 1887 CB ARG A 702 1.219 25.320 -1.340 1.00 55.58 C ATOM 1888 CG ARG A 702 0.957 26.761 -0.921 1.00 50.12 C ATOM 1889 CD ARG A 702 -0.213 27.439 -1.596 1.00 52.80 C ATOM 1890 NE ARG A 702 0.043 28.883 -1.733 1.00 61.92 N ATOM 1891 CZ ARG A 702 -0.880 29.851 -1.721 1.00 67.61 C ATOM 1892 NH1 ARG A 702 -2.184 29.579 -1.560 1.00 55.50 N ATOM 1893 NH2 ARG A 702 -0.486 31.122 -1.858 1.00 60.25 N ATOM 1894 HE ARG A 702 1.034 29.177 -1.850 1.00 0.00 H ATOM 1895 HH12 ARG A 702 -2.880 30.352 -1.555 1.00 0.00 H ATOM 1896 HH11 ARG A 702 -2.499 28.595 -1.440 1.00 0.00 H ATOM 1897 HH22 ARG A 702 -1.189 31.888 -1.851 1.00 0.00 H ATOM 1898 HH21 ARG A 702 0.524 31.344 -1.971 1.00 0.00 H ATOM 1899 H ARG A 702 4.135 26.407 -0.696 1.00 0.00 H ATOM 1900 N LYS A 703 4.194 23.057 -0.999 1.00 43.97 N ATOM 1901 CA LYS A 703 4.662 21.679 -1.116 1.00 45.22 C ATOM 1902 C LYS A 703 5.034 21.122 0.264 1.00 46.12 C ATOM 1903 O LYS A 703 5.807 21.746 0.997 1.00 42.43 O ATOM 1904 CB LYS A 703 5.875 21.609 -2.043 1.00 52.88 C ATOM 1905 CG LYS A 703 5.552 21.977 -3.482 1.00 58.36 C ATOM 1906 CD LYS A 703 6.780 21.895 -4.378 1.00 64.84 C ATOM 1907 CE LYS A 703 6.478 22.481 -5.751 1.00 69.57 C ATOM 1908 NZ LYS A 703 7.643 22.379 -6.668 1.00 71.78 N ATOM 1909 HZ1 LYS A 703 8.448 22.898 -6.263 1.00 0.00 H ATOM 1910 HZ2 LYS A 703 7.900 21.379 -6.790 1.00 0.00 H ATOM 1911 HZ3 LYS A 703 7.394 22.789 -7.590 1.00 0.00 H ATOM 1912 H LYS A 703 4.889 23.798 -0.776 1.00 0.00 H ATOM 1913 N PHE A 704 4.492 19.948 0.589 1.00 38.53 N ATOM 1914 CA PHE A 704 4.742 19.266 1.860 1.00 45.72 C ATOM 1915 C PHE A 704 5.295 17.885 1.561 1.00 44.97 C ATOM 1916 O PHE A 704 4.680 17.117 0.818 1.00 49.58 O ATOM 1917 CB PHE A 704 3.450 19.116 2.674 1.00 46.60 C ATOM 1918 CG PHE A 704 2.853 20.422 3.116 1.00 44.06 C ATOM 1919 CD1 PHE A 704 2.037 21.154 2.261 1.00 49.80 C ATOM 1920 CD2 PHE A 704 3.084 20.910 4.390 1.00 48.38 C ATOM 1921 CE1 PHE A 704 1.477 22.357 2.665 1.00 51.94 C ATOM 1922 CE2 PHE A 704 2.531 22.110 4.803 1.00 43.96 C ATOM 1923 CZ PHE A 704 1.721 22.835 3.942 1.00 50.53 C ATOM 1924 H PHE A 704 3.857 19.492 -0.097 1.00 0.00 H ATOM 1925 N THR A 705 6.445 17.577 2.151 1.00 43.47 N ATOM 1926 CA THR A 705 7.163 16.329 1.902 1.00 39.48 C ATOM 1927 C THR A 705 7.750 15.805 3.199 1.00 39.32 C ATOM 1928 O THR A 705 7.628 16.432 4.254 1.00 44.91 O ATOM 1929 CB THR A 705 8.320 16.560 0.905 1.00 44.91 C ATOM 1930 OG1 THR A 705 9.196 17.566 1.425 1.00 45.52 O ATOM 1931 CG2 THR A 705 7.792 17.010 -0.462 1.00 46.37 C ATOM 1932 HG1 THR A 705 9.939 17.716 0.788 1.00 0.00 H ATOM 1933 H THR A 705 6.854 18.257 2.823 1.00 0.00 H ATOM 1934 N THR A 706 8.411 14.656 3.106 1.00 40.38 N ATOM 1935 CA THR A 706 9.279 14.148 4.163 1.00 46.37 C ATOM 1936 C THR A 706 10.276 15.217 4.628 1.00 48.37 C ATOM 1937 O THR A 706 10.560 15.332 5.817 1.00 43.76 O ATOM 1938 CB THR A 706 10.064 12.919 3.665 1.00 55.68 C ATOM 1939 OG1 THR A 706 9.166 11.997 3.040 1.00 59.38 O ATOM 1940 CG2 THR A 706 10.771 12.217 4.808 1.00 67.31 C ATOM 1941 HG1 THR A 706 9.673 11.209 2.721 1.00 0.00 H ATOM 1942 H THR A 706 8.305 14.092 2.239 1.00 0.00 H ATOM 1943 N GLU A 707 10.786 15.998 3.682 1.00 44.44 N ATOM 1944 CA GLU A 707 11.796 17.015 3.959 1.00 43.15 C ATOM 1945 C GLU A 707 11.223 18.213 4.704 1.00 39.80 C ATOM 1946 O GLU A 707 11.923 18.823 5.520 1.00 37.95 O ATOM 1947 CB GLU A 707 12.485 17.468 2.661 1.00 45.11 C ATOM 1948 CG GLU A 707 13.473 16.450 2.086 1.00 42.97 C ATOM 1949 CD GLU A 707 12.814 15.184 1.558 1.00 47.68 C ATOM 1950 OE1 GLU A 707 11.754 15.277 0.903 1.00 57.92 O ATOM 1951 OE2 GLU A 707 13.339 14.082 1.802 1.00 60.76 O ATOM 1952 H GLU A 707 10.452 15.880 2.704 1.00 0.00 H ATOM 1953 N SER A 708 9.970 18.571 4.418 1.00 34.77 N ATOM 1954 CA SER A 708 9.301 19.612 5.188 1.00 39.78 C ATOM 1955 C SER A 708 8.999 19.155 6.621 1.00 36.40 C ATOM 1956 O SER A 708 8.954 19.980 7.522 1.00 34.04 O ATOM 1957 CB SER A 708 8.022 20.105 4.492 1.00 40.55 C ATOM 1958 OG SER A 708 7.055 19.078 4.390 1.00 42.81 O ATOM 1959 HG SER A 708 6.815 18.761 5.297 1.00 0.00 H ATOM 1960 H SER A 708 9.466 18.103 3.638 1.00 0.00 H ATOM 1961 N ASP A 709 8.791 17.851 6.814 1.00 41.98 N ATOM 1962 CA ASP A 709 8.673 17.263 8.154 1.00 39.63 C ATOM 1963 C ASP A 709 9.973 17.322 8.974 1.00 39.43 C ATOM 1964 O ASP A 709 9.895 17.569 10.175 1.00 37.99 O ATOM 1965 CB ASP A 709 8.132 15.826 8.112 1.00 37.48 C ATOM 1966 CG ASP A 709 6.591 15.751 8.024 1.00 38.60 C ATOM 1967 OD1 ASP A 709 5.867 16.767 8.134 1.00 40.88 O ATOM 1968 OD2 ASP A 709 6.088 14.640 7.835 1.00 34.70 O ATOM 1969 H ASP A 709 8.710 17.229 5.985 1.00 0.00 H ATOM 1970 N VAL A 710 11.138 17.109 8.349 1.00 34.39 N ATOM 1971 CA VAL A 710 12.412 17.237 9.088 1.00 37.99 C ATOM 1972 C VAL A 710 12.656 18.680 9.512 1.00 31.81 C ATOM 1973 O VAL A 710 13.200 18.904 10.587 1.00 33.54 O ATOM 1974 CB VAL A 710 13.682 16.692 8.364 1.00 44.87 C ATOM 1975 CG1 VAL A 710 13.367 15.474 7.530 1.00 49.34 C ATOM 1976 CG2 VAL A 710 14.371 17.753 7.522 1.00 36.09 C ATOM 1977 H VAL A 710 11.147 16.853 7.341 1.00 0.00 H ATOM 1978 N TRP A 711 12.233 19.641 8.685 1.00 33.56 N ATOM 1979 CA TRP A 711 12.289 21.068 9.031 1.00 35.16 C ATOM 1980 C TRP A 711 11.446 21.286 10.275 1.00 36.01 C ATOM 1981 O TRP A 711 11.926 21.845 11.262 1.00 34.72 O ATOM 1982 CB TRP A 711 11.769 21.971 7.892 1.00 39.45 C ATOM 1983 CG TRP A 711 11.740 23.452 8.267 1.00 37.42 C ATOM 1984 CD1 TRP A 711 10.857 24.070 9.108 1.00 37.29 C ATOM 1985 CD2 TRP A 711 12.629 24.476 7.807 1.00 39.24 C ATOM 1986 NE1 TRP A 711 11.154 25.402 9.215 1.00 40.46 N ATOM 1987 CE2 TRP A 711 12.235 25.683 8.427 1.00 39.24 C ATOM 1988 CE3 TRP A 711 13.715 24.495 6.917 1.00 44.11 C ATOM 1989 CZ2 TRP A 711 12.886 26.900 8.192 1.00 43.94 C ATOM 1990 CZ3 TRP A 711 14.382 25.710 6.696 1.00 38.80 C ATOM 1991 CH2 TRP A 711 13.960 26.891 7.332 1.00 37.63 C ATOM 1992 HE1 TRP A 711 10.640 26.090 9.802 1.00 0.00 H ATOM 1993 H TRP A 711 11.848 19.367 7.758 1.00 0.00 H ATOM 1994 N SER A 712 10.198 20.821 10.213 1.00 32.64 N ATOM 1995 CA SER A 712 9.281 20.889 11.347 1.00 35.86 C ATOM 1996 C SER A 712 9.838 20.222 12.587 1.00 31.43 C ATOM 1997 O SER A 712 9.690 20.778 13.664 1.00 32.99 O ATOM 1998 CB SER A 712 7.923 20.291 10.996 1.00 32.59 C ATOM 1999 OG SER A 712 7.249 21.149 10.119 1.00 37.13 O ATOM 2000 HG SER A 712 7.121 22.029 10.554 1.00 0.00 H ATOM 2001 H SER A 712 9.866 20.394 9.325 1.00 0.00 H ATOM 2002 N PHE A 713 10.510 19.072 12.428 1.00 31.32 N ATOM 2003 CA PHE A 713 11.172 18.435 13.561 1.00 32.93 C ATOM 2004 C PHE A 713 12.279 19.312 14.148 1.00 33.56 C ATOM 2005 O PHE A 713 12.440 19.384 15.365 1.00 31.70 O ATOM 2006 CB PHE A 713 11.754 17.067 13.231 1.00 30.62 C ATOM 2007 CG PHE A 713 12.460 16.451 14.408 1.00 35.47 C ATOM 2008 CD1 PHE A 713 11.724 15.854 15.438 1.00 38.27 C ATOM 2009 CD2 PHE A 713 13.849 16.552 14.553 1.00 41.17 C ATOM 2010 CE1 PHE A 713 12.360 15.327 16.553 1.00 35.36 C ATOM 2011 CE2 PHE A 713 14.487 16.017 15.666 1.00 40.08 C ATOM 2012 CZ PHE A 713 13.742 15.406 16.666 1.00 35.12 C ATOM 2013 H PHE A 713 10.559 18.630 11.488 1.00 0.00 H ATOM 2014 N GLY A 714 13.054 19.956 13.283 1.00 38.44 N ATOM 2015 CA GLY A 714 14.002 20.976 13.722 1.00 35.24 C ATOM 2016 C GLY A 714 13.365 21.979 14.659 1.00 33.42 C ATOM 2017 O GLY A 714 13.901 22.268 15.728 1.00 31.82 O ATOM 2018 H GLY A 714 12.984 19.729 12.271 1.00 0.00 H ATOM 2019 N VAL A 715 12.182 22.468 14.286 1.00 32.73 N ATOM 2020 CA VAL A 715 11.449 23.419 15.127 1.00 33.33 C ATOM 2021 C VAL A 715 10.989 22.756 16.448 1.00 33.83 C ATOM 2022 O VAL A 715 11.028 23.394 17.505 1.00 32.57 O ATOM 2023 CB VAL A 715 10.252 24.079 14.389 1.00 34.53 C ATOM 2024 CG1 VAL A 715 9.643 25.186 15.233 1.00 32.66 C ATOM 2025 CG2 VAL A 715 10.679 24.700 13.068 1.00 39.00 C ATOM 2026 H VAL A 715 11.771 22.168 13.379 1.00 0.00 H ATOM 2027 N VAL A 716 10.545 21.497 16.380 1.00 30.73 N ATOM 2028 CA VAL A 716 10.191 20.726 17.583 1.00 34.01 C ATOM 2029 C VAL A 716 11.375 20.649 18.562 1.00 34.08 C ATOM 2030 O VAL A 716 11.209 20.854 19.761 1.00 29.71 O ATOM 2031 CB VAL A 716 9.675 19.307 17.218 1.00 35.91 C ATOM 2032 CG1 VAL A 716 9.603 18.382 18.432 1.00 36.36 C ATOM 2033 CG2 VAL A 716 8.298 19.417 16.588 1.00 41.18 C ATOM 2034 H VAL A 716 10.446 21.048 15.447 1.00 0.00 H ATOM 2035 N LEU A 717 12.555 20.358 18.030 1.00 32.96 N ATOM 2036 CA LEU A 717 13.781 20.329 18.814 1.00 34.90 C ATOM 2037 C LEU A 717 14.005 21.676 19.516 1.00 31.33 C ATOM 2038 O LEU A 717 14.280 21.713 20.720 1.00 34.13 O ATOM 2039 CB LEU A 717 14.973 19.924 17.934 1.00 38.86 C ATOM 2040 CG LEU A 717 16.254 19.430 18.613 1.00 43.19 C ATOM 2041 CD1 LEU A 717 16.013 18.199 19.480 1.00 42.93 C ATOM 2042 CD2 LEU A 717 17.278 19.107 17.541 1.00 44.30 C ATOM 2043 H LEU A 717 12.606 20.142 17.014 1.00 0.00 H ATOM 2044 N TRP A 718 13.788 22.772 18.788 1.00 32.87 N ATOM 2045 CA TRP A 718 13.824 24.123 19.359 1.00 33.89 C ATOM 2046 C TRP A 718 12.783 24.335 20.467 1.00 35.64 C ATOM 2047 O TRP A 718 13.102 24.896 21.519 1.00 32.19 O ATOM 2048 CB TRP A 718 13.643 25.178 18.256 1.00 31.35 C ATOM 2049 CG TRP A 718 13.934 26.595 18.688 1.00 31.49 C ATOM 2050 CD1 TRP A 718 15.145 27.239 18.625 1.00 33.32 C ATOM 2051 CD2 TRP A 718 13.011 27.540 19.224 1.00 36.16 C ATOM 2052 NE1 TRP A 718 15.028 28.520 19.081 1.00 32.00 N ATOM 2053 CE2 TRP A 718 13.731 28.741 19.459 1.00 36.21 C ATOM 2054 CE3 TRP A 718 11.641 27.503 19.524 1.00 35.90 C ATOM 2055 CZ2 TRP A 718 13.129 29.888 19.987 1.00 37.37 C ATOM 2056 CZ3 TRP A 718 11.048 28.636 20.062 1.00 32.86 C ATOM 2057 CH2 TRP A 718 11.791 29.819 20.286 1.00 34.23 C ATOM 2058 HE1 TRP A 718 15.799 29.216 19.133 1.00 0.00 H ATOM 2059 H TRP A 718 13.585 22.665 17.774 1.00 0.00 H ATOM 2060 N GLU A 719 11.544 23.886 20.231 1.00 32.05 N ATOM 2061 CA GLU A 719 10.505 23.928 21.267 1.00 33.56 C ATOM 2062 C GLU A 719 10.942 23.212 22.540 1.00 27.22 C ATOM 2063 O GLU A 719 10.795 23.753 23.629 1.00 32.21 O ATOM 2064 CB GLU A 719 9.198 23.278 20.792 1.00 31.32 C ATOM 2065 CG GLU A 719 8.429 24.028 19.743 1.00 28.95 C ATOM 2066 CD GLU A 719 7.106 23.332 19.480 1.00 36.48 C ATOM 2067 OE1 GLU A 719 7.063 22.462 18.595 1.00 30.08 O ATOM 2068 OE2 GLU A 719 6.134 23.597 20.199 1.00 33.65 O ATOM 2069 H GLU A 719 11.313 23.499 19.294 1.00 0.00 H ATOM 2070 N ILE A 720 11.464 21.998 22.384 1.00 29.31 N ATOM 2071 CA ILE A 720 11.906 21.175 23.517 1.00 30.68 C ATOM 2072 C ILE A 720 12.962 21.926 24.347 1.00 36.29 C ATOM 2073 O ILE A 720 12.824 22.063 25.567 1.00 37.62 O ATOM 2074 CB ILE A 720 12.433 19.796 23.038 1.00 35.35 C ATOM 2075 CG1 ILE A 720 11.269 18.955 22.488 1.00 33.65 C ATOM 2076 CG2 ILE A 720 13.111 19.028 24.174 1.00 35.09 C ATOM 2077 CD1 ILE A 720 11.670 17.786 21.620 1.00 29.17 C ATOM 2078 H ILE A 720 11.563 21.617 21.421 1.00 0.00 H ATOM 2079 N PHE A 721 13.984 22.449 23.671 1.00 35.21 N ATOM 2080 CA PHE A 721 15.095 23.137 24.355 1.00 36.53 C ATOM 2081 C PHE A 721 14.807 24.563 24.814 1.00 37.98 C ATOM 2082 O PHE A 721 15.622 25.146 25.520 1.00 44.44 O ATOM 2083 CB PHE A 721 16.370 23.033 23.529 1.00 36.50 C ATOM 2084 CG PHE A 721 17.039 21.702 23.668 1.00 34.79 C ATOM 2085 CD1 PHE A 721 17.974 21.490 24.680 1.00 39.08 C ATOM 2086 CD2 PHE A 721 16.701 20.645 22.838 1.00 35.26 C ATOM 2087 CE1 PHE A 721 18.576 20.252 24.838 1.00 35.41 C ATOM 2088 CE2 PHE A 721 17.299 19.401 22.987 1.00 36.06 C ATOM 2089 CZ PHE A 721 18.241 19.207 23.988 1.00 33.77 C ATOM 2090 H PHE A 721 13.999 22.370 22.634 1.00 0.00 H ATOM 2091 N THR A 722 13.645 25.103 24.459 1.00 33.93 N ATOM 2092 CA THR A 722 13.124 26.350 25.047 1.00 34.91 C ATOM 2093 C THR A 722 11.979 26.106 26.041 1.00 31.73 C ATOM 2094 O THR A 722 11.277 27.037 26.423 1.00 34.92 O ATOM 2095 CB THR A 722 12.578 27.301 23.961 1.00 40.88 C ATOM 2096 OG1 THR A 722 11.501 26.665 23.269 1.00 41.00 O ATOM 2097 CG2 THR A 722 13.641 27.690 22.970 1.00 36.04 C ATOM 2098 HG1 THR A 722 11.829 25.832 22.845 1.00 0.00 H ATOM 2099 H THR A 722 13.077 24.623 23.732 1.00 0.00 H ATOM 2100 N TYR A 723 11.782 24.857 26.456 1.00 33.75 N ATOM 2101 CA TYR A 723 10.659 24.486 27.327 1.00 33.70 C ATOM 2102 C TYR A 723 9.287 24.933 26.797 1.00 31.51 C ATOM 2103 O TYR A 723 8.431 25.408 27.541 1.00 32.43 O ATOM 2104 CB TYR A 723 10.920 24.969 28.759 1.00 38.21 C ATOM 2105 CG TYR A 723 12.216 24.435 29.343 1.00 36.67 C ATOM 2106 CD1 TYR A 723 12.276 23.165 29.927 1.00 46.78 C ATOM 2107 CD2 TYR A 723 13.388 25.206 29.318 1.00 45.23 C ATOM 2108 CE1 TYR A 723 13.465 22.675 30.470 1.00 41.41 C ATOM 2109 CE2 TYR A 723 14.582 24.728 29.856 1.00 47.34 C ATOM 2110 CZ TYR A 723 14.613 23.466 30.434 1.00 52.34 C ATOM 2111 OH TYR A 723 15.787 22.990 30.952 1.00 59.34 O ATOM 2112 HH TYR A 723 15.639 22.084 31.323 1.00 0.00 H ATOM 2113 H TYR A 723 12.447 24.117 26.153 1.00 0.00 H ATOM 2114 N GLY A 724 9.086 24.745 25.494 1.00 33.08 N ATOM 2115 CA GLY A 724 7.776 24.919 24.866 1.00 32.19 C ATOM 2116 C GLY A 724 7.375 26.325 24.473 1.00 33.61 C ATOM 2117 O GLY A 724 6.195 26.579 24.256 1.00 32.49 O ATOM 2118 H GLY A 724 9.892 24.464 24.900 1.00 0.00 H ATOM 2119 N LYS A 725 8.338 27.241 24.371 1.00 33.43 N ATOM 2120 CA LYS A 725 8.078 28.582 23.820 1.00 36.90 C ATOM 2121 C LYS A 725 7.617 28.471 22.367 1.00 31.41 C ATOM 2122 O LYS A 725 7.993 27.539 21.661 1.00 28.01 O ATOM 2123 CB LYS A 725 9.330 29.479 23.881 1.00 35.78 C ATOM 2124 CG LYS A 725 9.688 29.967 25.275 1.00 45.47 C ATOM 2125 CD LYS A 725 10.906 30.877 25.239 1.00 37.90 C ATOM 2126 CE LYS A 725 11.349 31.253 26.643 1.00 37.01 C ATOM 2127 NZ LYS A 725 12.634 32.006 26.647 1.00 36.89 N ATOM 2128 HZ1 LYS A 725 13.379 31.420 26.219 1.00 0.00 H ATOM 2129 HZ2 LYS A 725 12.523 32.882 26.098 1.00 0.00 H ATOM 2130 HZ3 LYS A 725 12.894 32.240 27.626 1.00 0.00 H ATOM 2131 H LYS A 725 9.299 27.002 24.689 1.00 0.00 H ATOM 2132 N GLN A 726 6.813 29.435 21.929 1.00 31.46 N ATOM 2133 CA GLN A 726 6.373 29.481 20.541 1.00 34.26 C ATOM 2134 C GLN A 726 7.512 29.960 19.637 1.00 32.81 C ATOM 2135 O GLN A 726 8.115 30.989 19.925 1.00 37.86 O ATOM 2136 CB GLN A 726 5.166 30.392 20.365 1.00 31.94 C ATOM 2137 CG GLN A 726 4.574 30.335 18.960 1.00 36.68 C ATOM 2138 CD GLN A 726 3.578 31.445 18.720 1.00 38.25 C ATOM 2139 OE1 GLN A 726 3.942 32.610 18.762 1.00 40.82 O ATOM 2140 NE2 GLN A 726 2.314 31.094 18.486 1.00 38.06 N ATOM 2141 HE22 GLN A 726 2.050 30.088 18.459 1.00 0.00 H ATOM 2142 HE21 GLN A 726 1.592 31.826 18.330 1.00 0.00 H ATOM 2143 H GLN A 726 6.492 30.171 22.590 1.00 0.00 H ATOM 2144 N PRO A 727 7.804 29.223 18.542 1.00 34.10 N ATOM 2145 CA PRO A 727 8.780 29.726 17.577 1.00 35.36 C ATOM 2146 C PRO A 727 8.391 31.102 17.052 1.00 34.51 C ATOM 2147 O PRO A 727 7.225 31.346 16.779 1.00 29.48 O ATOM 2148 CB PRO A 727 8.745 28.699 16.450 1.00 38.22 C ATOM 2149 CG PRO A 727 8.089 27.502 17.002 1.00 38.44 C ATOM 2150 CD PRO A 727 7.189 27.958 18.095 1.00 37.55 C ATOM 2151 N TRP A 728 9.368 32.003 16.965 1.00 36.66 N ATOM 2152 CA TRP A 728 9.139 33.384 16.513 1.00 32.63 C ATOM 2153 C TRP A 728 8.049 34.113 17.314 1.00 28.90 C ATOM 2154 O TRP A 728 7.304 34.932 16.761 1.00 30.46 O ATOM 2155 CB TRP A 728 8.822 33.410 15.000 1.00 30.76 C ATOM 2156 CG TRP A 728 9.841 32.725 14.150 1.00 35.29 C ATOM 2157 CD1 TRP A 728 9.685 31.562 13.465 1.00 34.90 C ATOM 2158 CD2 TRP A 728 11.186 33.155 13.905 1.00 35.49 C ATOM 2159 NE1 TRP A 728 10.840 31.238 12.807 1.00 35.14 N ATOM 2160 CE2 TRP A 728 11.779 32.200 13.058 1.00 35.84 C ATOM 2161 CE3 TRP A 728 11.945 34.253 14.325 1.00 44.35 C ATOM 2162 CZ2 TRP A 728 13.098 32.309 12.610 1.00 41.02 C ATOM 2163 CZ3 TRP A 728 13.268 34.360 13.884 1.00 40.76 C ATOM 2164 CH2 TRP A 728 13.822 33.393 13.028 1.00 38.01 C ATOM 2165 HE1 TRP A 728 10.981 30.397 12.212 1.00 0.00 H ATOM 2166 H TRP A 728 10.333 31.718 17.228 1.00 0.00 H ATOM 2167 N TYR A 729 7.972 33.848 18.626 1.00 31.83 N ATOM 2168 CA TYR A 729 6.946 34.470 19.499 1.00 35.79 C ATOM 2169 C TYR A 729 6.930 35.997 19.451 1.00 35.90 C ATOM 2170 O TYR A 729 5.879 36.615 19.567 1.00 34.44 O ATOM 2171 CB TYR A 729 7.086 34.016 20.966 1.00 42.92 C ATOM 2172 CG TYR A 729 8.347 34.485 21.665 1.00 46.86 C ATOM 2173 CD1 TYR A 729 9.524 33.730 21.625 1.00 45.99 C ATOM 2174 CD2 TYR A 729 8.360 35.682 22.383 1.00 55.74 C ATOM 2175 CE1 TYR A 729 10.648 34.155 22.307 1.00 41.56 C ATOM 2176 CE2 TYR A 729 9.467 36.120 23.053 1.00 44.17 C ATOM 2177 CZ TYR A 729 10.623 35.357 23.009 1.00 42.85 C ATOM 2178 OH TYR A 729 11.754 35.793 23.665 1.00 43.12 O ATOM 2179 HH TYR A 729 12.484 35.137 23.534 1.00 0.00 H ATOM 2180 H TYR A 729 8.654 33.184 19.046 1.00 0.00 H ATOM 2181 N GLN A 730 8.106 36.594 19.274 1.00 35.12 N ATOM 2182 CA GLN A 730 8.232 38.048 19.077 1.00 41.74 C ATOM 2183 C GLN A 730 7.604 38.618 17.773 1.00 43.20 C ATOM 2184 O GLN A 730 7.506 39.840 17.620 1.00 38.33 O ATOM 2185 CB GLN A 730 9.718 38.478 19.215 1.00 38.87 C ATOM 2186 CG GLN A 730 10.664 38.070 18.084 1.00 40.52 C ATOM 2187 CD GLN A 730 11.178 36.640 18.177 1.00 49.11 C ATOM 2188 OE1 GLN A 730 10.575 35.785 18.837 1.00 42.88 O ATOM 2189 NE2 GLN A 730 12.292 36.369 17.509 1.00 48.74 N ATOM 2190 HE22 GLN A 730 12.768 37.118 16.966 1.00 0.00 H ATOM 2191 HE21 GLN A 730 12.689 35.408 17.528 1.00 0.00 H ATOM 2192 H GLN A 730 8.968 36.012 19.275 1.00 0.00 H ATOM 2193 N LEU A 731 7.194 37.744 16.850 1.00 36.32 N ATOM 2194 CA LEU A 731 6.693 38.136 15.532 1.00 34.78 C ATOM 2195 C LEU A 731 5.209 37.847 15.346 1.00 37.27 C ATOM 2196 O LEU A 731 4.713 36.811 15.768 1.00 35.60 O ATOM 2197 CB LEU A 731 7.471 37.393 14.446 1.00 33.23 C ATOM 2198 CG LEU A 731 9.003 37.537 14.425 1.00 36.86 C ATOM 2199 CD1 LEU A 731 9.563 36.838 13.201 1.00 37.22 C ATOM 2200 CD2 LEU A 731 9.463 38.992 14.420 1.00 38.30 C ATOM 2201 H LEU A 731 7.233 36.731 17.080 1.00 0.00 H ATOM 2202 N SER A 732 4.512 38.761 14.681 1.00 38.13 N ATOM 2203 CA SER A 732 3.191 38.478 14.113 1.00 37.95 C ATOM 2204 C SER A 732 3.288 37.392 13.036 1.00 35.31 C ATOM 2205 O SER A 732 4.386 36.994 12.615 1.00 33.67 O ATOM 2206 CB SER A 732 2.608 39.743 13.485 1.00 43.05 C ATOM 2207 OG SER A 732 3.327 40.072 12.300 1.00 42.00 O ATOM 2208 HG SER A 732 4.278 40.227 12.525 1.00 0.00 H ATOM 2209 H SER A 732 4.918 39.711 14.559 1.00 0.00 H ATOM 2210 N ASN A 733 2.133 36.904 12.601 1.00 32.31 N ATOM 2211 CA ASN A 733 2.079 35.850 11.584 1.00 36.42 C ATOM 2212 C ASN A 733 2.729 36.238 10.255 1.00 35.25 C ATOM 2213 O ASN A 733 3.476 35.449 9.670 1.00 35.78 O ATOM 2214 CB ASN A 733 0.630 35.417 11.340 1.00 40.18 C ATOM 2215 CG ASN A 733 0.058 34.628 12.502 1.00 42.96 C ATOM 2216 OD1 ASN A 733 0.761 33.827 13.116 1.00 41.13 O ATOM 2217 ND2 ASN A 733 -1.220 34.854 12.815 1.00 38.22 N ATOM 2218 HD22 ASN A 733 -1.776 35.541 12.267 1.00 0.00 H ATOM 2219 HD21 ASN A 733 -1.660 34.343 13.607 1.00 0.00 H ATOM 2220 H ASN A 733 1.245 37.279 12.991 1.00 0.00 H ATOM 2221 N THR A 734 2.450 37.462 9.805 1.00 34.78 N ATOM 2222 CA THR A 734 3.002 37.990 8.556 1.00 35.83 C ATOM 2223 C THR A 734 4.507 38.239 8.671 1.00 35.88 C ATOM 2224 O THR A 734 5.268 37.847 7.782 1.00 36.65 O ATOM 2225 CB THR A 734 2.253 39.250 8.077 1.00 37.82 C ATOM 2226 OG1 THR A 734 2.286 40.269 9.083 1.00 39.93 O ATOM 2227 CG2 THR A 734 0.794 38.897 7.769 1.00 44.65 C ATOM 2228 HG1 THR A 734 1.801 41.068 8.757 1.00 0.00 H ATOM 2229 H THR A 734 1.814 38.066 10.364 1.00 0.00 H ATOM 2230 N GLU A 735 4.931 38.847 9.777 1.00 39.29 N ATOM 2231 CA GLU A 735 6.365 39.012 10.077 1.00 38.28 C ATOM 2232 C GLU A 735 7.090 37.656 10.105 1.00 33.06 C ATOM 2233 O GLU A 735 8.197 37.521 9.579 1.00 38.52 O ATOM 2234 CB GLU A 735 6.564 39.759 11.403 1.00 40.55 C ATOM 2235 CG GLU A 735 6.153 41.231 11.370 1.00 41.20 C ATOM 2236 CD GLU A 735 6.155 41.896 12.742 1.00 47.06 C ATOM 2237 OE1 GLU A 735 6.234 41.185 13.776 1.00 39.15 O ATOM 2238 OE2 GLU A 735 6.062 43.146 12.792 1.00 48.35 O ATOM 2239 H GLU A 735 4.229 39.217 10.450 1.00 0.00 H ATOM 2240 N ALA A 736 6.452 36.640 10.684 1.00 34.73 N ATOM 2241 CA ALA A 736 7.024 35.288 10.697 1.00 35.06 C ATOM 2242 C ALA A 736 7.185 34.672 9.289 1.00 35.18 C ATOM 2243 O ALA A 736 8.192 34.006 9.003 1.00 32.42 O ATOM 2244 CB ALA A 736 6.207 34.373 11.599 1.00 37.03 C ATOM 2245 H ALA A 736 5.530 36.808 11.136 1.00 0.00 H ATOM 2246 N ILE A 737 6.191 34.880 8.428 1.00 33.66 N ATOM 2247 CA ILE A 737 6.277 34.436 7.020 1.00 36.69 C ATOM 2248 C ILE A 737 7.471 35.123 6.346 1.00 32.41 C ATOM 2249 O ILE A 737 8.291 34.467 5.724 1.00 34.92 O ATOM 2250 CB ILE A 737 4.974 34.733 6.238 1.00 38.81 C ATOM 2251 CG1 ILE A 737 3.856 33.794 6.710 1.00 38.99 C ATOM 2252 CG2 ILE A 737 5.172 34.578 4.728 1.00 37.85 C ATOM 2253 CD1 ILE A 737 2.461 34.310 6.437 1.00 40.88 C ATOM 2254 H ILE A 737 5.332 35.367 8.754 1.00 0.00 H ATOM 2255 N ASP A 738 7.569 36.436 6.519 1.00 38.49 N ATOM 2256 CA ASP A 738 8.677 37.199 5.950 1.00 39.39 C ATOM 2257 C ASP A 738 10.013 36.641 6.414 1.00 38.02 C ATOM 2258 O ASP A 738 10.905 36.411 5.604 1.00 42.47 O ATOM 2259 CB ASP A 738 8.584 38.670 6.340 1.00 37.47 C ATOM 2260 CG ASP A 738 7.410 39.374 5.713 1.00 41.66 C ATOM 2261 OD1 ASP A 738 6.803 38.833 4.769 1.00 48.01 O ATOM 2262 OD2 ASP A 738 7.097 40.490 6.168 1.00 47.66 O ATOM 2263 H ASP A 738 6.841 36.932 7.072 1.00 0.00 H ATOM 2264 N CYS A 739 10.142 36.415 7.719 1.00 36.19 N ATOM 2265 CA CYS A 739 11.371 35.879 8.296 1.00 31.54 C ATOM 2266 C CYS A 739 11.765 34.541 7.762 1.00 35.56 C ATOM 2267 O CYS A 739 12.910 34.345 7.390 1.00 39.07 O ATOM 2268 CB CYS A 739 11.283 35.783 9.819 1.00 38.71 C ATOM 2269 SG CYS A 739 11.610 37.364 10.592 1.00 47.46 S ATOM 2270 H CYS A 739 9.341 36.627 8.348 1.00 0.00 H ATOM 2271 N ILE A 740 10.821 33.613 7.744 1.00 33.41 N ATOM 2272 CA ILE A 740 11.101 32.272 7.267 1.00 33.00 C ATOM 2273 C ILE A 740 11.424 32.269 5.779 1.00 37.20 C ATOM 2274 O ILE A 740 12.362 31.599 5.349 1.00 37.11 O ATOM 2275 CB ILE A 740 9.922 31.315 7.544 1.00 42.45 C ATOM 2276 CG1 ILE A 740 9.722 31.142 9.055 1.00 44.30 C ATOM 2277 CG2 ILE A 740 10.170 29.960 6.898 1.00 44.68 C ATOM 2278 CD1 ILE A 740 8.411 30.482 9.430 1.00 42.32 C ATOM 2279 H ILE A 740 9.864 33.849 8.077 1.00 0.00 H ATOM 2280 N THR A 741 10.643 33.004 4.998 1.00 37.34 N ATOM 2281 CA THR A 741 10.865 33.051 3.539 1.00 41.73 C ATOM 2282 C THR A 741 12.187 33.722 3.151 1.00 41.39 C ATOM 2283 O THR A 741 12.770 33.380 2.128 1.00 51.51 O ATOM 2284 CB THR A 741 9.703 33.731 2.790 1.00 36.58 C ATOM 2285 OG1 THR A 741 9.478 35.045 3.306 1.00 42.58 O ATOM 2286 CG2 THR A 741 8.438 32.905 2.925 1.00 44.51 C ATOM 2287 HG1 THR A 741 9.252 34.986 4.268 1.00 0.00 H ATOM 2288 H THR A 741 9.866 33.553 5.418 1.00 0.00 H ATOM 2289 N GLN A 742 12.652 34.661 3.976 1.00 44.22 N ATOM 2290 CA GLN A 742 13.927 35.360 3.744 1.00 42.77 C ATOM 2291 C GLN A 742 15.159 34.683 4.330 1.00 43.47 C ATOM 2292 O GLN A 742 16.270 35.161 4.117 1.00 49.79 O ATOM 2293 CB GLN A 742 13.830 36.792 4.252 1.00 38.37 C ATOM 2294 CG GLN A 742 12.906 37.638 3.394 1.00 48.94 C ATOM 2295 CD GLN A 742 12.476 38.896 4.104 1.00 51.43 C ATOM 2296 OE1 GLN A 742 13.271 39.502 4.821 1.00 69.91 O ATOM 2297 NE2 GLN A 742 11.217 39.302 3.920 1.00 58.87 N ATOM 2298 HE22 GLN A 742 10.580 38.757 3.304 1.00 0.00 H ATOM 2299 HE21 GLN A 742 10.874 40.163 4.392 1.00 0.00 H ATOM 2300 H GLN A 742 12.092 34.909 4.816 1.00 0.00 H ATOM 2301 N GLY A 743 14.977 33.571 5.040 1.00 51.49 N ATOM 2302 CA GLY A 743 16.099 32.778 5.541 1.00 38.75 C ATOM 2303 C GLY A 743 16.575 33.022 6.964 1.00 40.32 C ATOM 2304 O GLY A 743 17.642 32.539 7.323 1.00 46.93 O ATOM 2305 H GLY A 743 14.007 33.257 5.244 1.00 0.00 H ATOM 2306 N ARG A 744 15.809 33.752 7.775 1.00 43.22 N ATOM 2307 CA ARG A 744 16.158 33.946 9.189 1.00 42.70 C ATOM 2308 C ARG A 744 16.066 32.614 9.900 1.00 49.15 C ATOM 2309 O ARG A 744 15.185 31.824 9.594 1.00 45.08 O ATOM 2310 CB ARG A 744 15.200 34.910 9.876 1.00 45.75 C ATOM 2311 CG ARG A 744 15.477 36.374 9.631 1.00 59.65 C ATOM 2312 CD ARG A 744 16.638 36.873 10.490 1.00 60.01 C ATOM 2313 NE ARG A 744 16.363 36.806 11.929 1.00 54.65 N ATOM 2314 CZ ARG A 744 15.667 37.701 12.635 1.00 51.80 C ATOM 2315 NH1 ARG A 744 15.135 38.762 12.062 1.00 62.42 N ATOM 2316 NH2 ARG A 744 15.496 37.533 13.938 1.00 56.87 N ATOM 2317 HE ARG A 744 16.744 35.988 12.446 1.00 0.00 H ATOM 2318 HH12 ARG A 744 14.597 39.446 12.632 1.00 0.00 H ATOM 2319 HH11 ARG A 744 15.253 38.915 11.040 1.00 0.00 H ATOM 2320 HH22 ARG A 744 14.954 38.231 14.486 1.00 0.00 H ATOM 2321 HH21 ARG A 744 15.904 36.703 14.413 1.00 0.00 H ATOM 2322 H ARG A 744 14.946 34.194 7.399 1.00 0.00 H ATOM 2323 N GLU A 745 16.965 32.364 10.846 1.00 42.02 N ATOM 2324 CA GLU A 745 16.939 31.106 11.590 1.00 41.67 C ATOM 2325 C GLU A 745 16.739 31.359 13.068 1.00 45.79 C ATOM 2326 O GLU A 745 17.239 32.343 13.601 1.00 38.74 O ATOM 2327 CB GLU A 745 18.207 30.294 11.356 1.00 49.46 C ATOM 2328 CG GLU A 745 18.141 29.445 10.101 1.00 59.91 C ATOM 2329 CD GLU A 745 19.262 28.430 10.002 1.00 72.40 C ATOM 2330 OE1 GLU A 745 20.110 28.353 10.923 1.00 66.22 O ATOM 2331 OE2 GLU A 745 19.291 27.702 8.987 1.00 70.87 O ATOM 2332 H GLU A 745 17.696 33.072 11.060 1.00 0.00 H ATOM 2333 N LEU A 746 16.008 30.459 13.725 1.00 38.60 N ATOM 2334 CA LEU A 746 15.750 30.597 15.154 1.00 38.58 C ATOM 2335 C LEU A 746 17.077 30.535 15.920 1.00 34.30 C ATOM 2336 O LEU A 746 17.946 29.735 15.584 1.00 38.89 O ATOM 2337 CB LEU A 746 14.795 29.500 15.638 1.00 37.38 C ATOM 2338 CG LEU A 746 13.358 29.531 15.090 1.00 38.00 C ATOM 2339 CD1 LEU A 746 12.715 28.147 15.173 1.00 39.63 C ATOM 2340 CD2 LEU A 746 12.505 30.543 15.831 1.00 38.19 C ATOM 2341 H LEU A 746 15.615 29.645 13.210 1.00 0.00 H ATOM 2342 N GLU A 747 17.223 31.394 16.926 1.00 38.77 N ATOM 2343 CA GLU A 747 18.438 31.451 17.755 1.00 42.62 C ATOM 2344 C GLU A 747 18.633 30.186 18.589 1.00 46.95 C ATOM 2345 O GLU A 747 17.673 29.480 18.893 1.00 43.39 O ATOM 2346 CB GLU A 747 18.393 32.659 18.697 1.00 49.09 C ATOM 2347 CG GLU A 747 18.229 34.028 18.081 1.00 41.34 C ATOM 2348 CD GLU A 747 19.358 34.411 17.137 1.00 41.95 C ATOM 2349 OE1 GLU A 747 20.502 33.941 17.321 1.00 43.43 O ATOM 2350 OE2 GLU A 747 19.101 35.206 16.206 1.00 42.10 O ATOM 2351 H GLU A 747 16.446 32.053 17.135 1.00 0.00 H ATOM 2352 N ARG A 748 19.882 29.902 18.952 1.00 41.17 N ATOM 2353 CA ARG A 748 20.184 28.797 19.853 1.00 44.52 C ATOM 2354 C ARG A 748 19.535 29.073 21.203 1.00 43.87 C ATOM 2355 O ARG A 748 19.770 30.134 21.780 1.00 41.01 O ATOM 2356 CB ARG A 748 21.686 28.619 20.042 1.00 45.51 C ATOM 2357 CG ARG A 748 22.039 27.364 20.834 1.00 47.29 C ATOM 2358 CD ARG A 748 23.526 27.033 20.746 1.00 53.33 C ATOM 2359 NE ARG A 748 24.336 28.091 21.348 1.00 53.93 N ATOM 2360 CZ ARG A 748 24.494 28.299 22.660 1.00 61.80 C ATOM 2361 NH1 ARG A 748 23.910 27.519 23.569 1.00 53.83 N ATOM 2362 NH2 ARG A 748 25.257 29.308 23.074 1.00 58.81 N ATOM 2363 HE ARG A 748 24.832 28.737 20.701 1.00 0.00 H ATOM 2364 HH12 ARG A 748 24.051 27.706 24.582 1.00 0.00 H ATOM 2365 HH11 ARG A 748 23.313 26.724 23.265 1.00 0.00 H ATOM 2366 HH22 ARG A 748 25.386 29.478 24.092 1.00 0.00 H ATOM 2367 HH21 ARG A 748 25.724 29.926 22.380 1.00 0.00 H ATOM 2368 H ARG A 748 20.662 30.483 18.583 1.00 0.00 H ATOM 2369 N PRO A 749 18.682 28.144 21.696 1.00 40.56 N ATOM 2370 CA PRO A 749 18.138 28.324 23.046 1.00 42.51 C ATOM 2371 C PRO A 749 19.239 28.288 24.102 1.00 36.48 C ATOM 2372 O PRO A 749 20.239 27.602 23.901 1.00 39.38 O ATOM 2373 CB PRO A 749 17.213 27.105 23.225 1.00 38.77 C ATOM 2374 CG PRO A 749 16.900 26.651 21.852 1.00 39.16 C ATOM 2375 CD PRO A 749 18.110 26.958 21.033 1.00 37.32 C ATOM 2376 N ARG A 750 19.034 28.993 25.212 1.00 42.26 N ATOM 2377 CA ARG A 750 19.984 28.999 26.337 1.00 49.06 C ATOM 2378 C ARG A 750 20.387 27.574 26.771 1.00 57.73 C ATOM 2379 O ARG A 750 21.572 27.242 26.846 1.00 52.18 O ATOM 2380 CB ARG A 750 19.379 29.760 27.516 1.00 54.98 C ATOM 2381 CG ARG A 750 20.347 30.018 28.663 1.00 63.70 C ATOM 2382 CD ARG A 750 19.710 30.897 29.728 1.00 68.77 C ATOM 2383 NE ARG A 750 20.599 31.117 30.876 1.00 80.59 N ATOM 2384 CZ ARG A 750 20.274 31.797 31.982 1.00 73.04 C ATOM 2385 NH1 ARG A 750 19.068 32.349 32.123 1.00 79.94 N ATOM 2386 NH2 ARG A 750 21.162 31.926 32.964 1.00 82.43 N ATOM 2387 HE ARG A 750 21.556 30.713 30.826 1.00 0.00 H ATOM 2388 HH12 ARG A 750 18.834 32.874 32.990 1.00 0.00 H ATOM 2389 HH11 ARG A 750 18.361 32.255 31.366 1.00 0.00 H ATOM 2390 HH22 ARG A 750 20.913 32.454 33.825 1.00 0.00 H ATOM 2391 HH21 ARG A 750 22.106 31.499 32.871 1.00 0.00 H ATOM 2392 H ARG A 750 18.167 29.563 25.288 1.00 0.00 H ATOM 2393 N ALA A 751 19.385 26.731 27.007 1.00 49.58 N ATOM 2394 CA ALA A 751 19.593 25.340 27.443 1.00 38.86 C ATOM 2395 C ALA A 751 20.174 24.383 26.403 1.00 42.75 C ATOM 2396 O ALA A 751 20.547 23.260 26.739 1.00 51.00 O ATOM 2397 CB ALA A 751 18.282 24.771 27.974 1.00 50.61 C ATOM 2398 H ALA A 751 18.410 27.070 26.878 1.00 0.00 H ATOM 2399 N CYS A 752 20.227 24.801 25.144 1.00 45.21 N ATOM 2400 CA CYS A 752 20.674 23.952 24.045 1.00 46.66 C ATOM 2401 C CYS A 752 22.198 24.019 23.919 1.00 53.73 C ATOM 2402 O CYS A 752 22.736 25.114 23.740 1.00 47.64 O ATOM 2403 CB CYS A 752 20.031 24.455 22.749 1.00 39.97 C ATOM 2404 SG CYS A 752 20.372 23.481 21.281 1.00 42.75 S ATOM 2405 H CYS A 752 19.937 25.777 24.932 1.00 0.00 H ATOM 2406 N PRO A 753 22.901 22.863 24.007 1.00 52.02 N ATOM 2407 CA PRO A 753 24.340 22.906 23.717 1.00 50.35 C ATOM 2408 C PRO A 753 24.595 23.101 22.222 1.00 57.88 C ATOM 2409 O PRO A 753 23.709 22.785 21.408 1.00 48.37 O ATOM 2410 CB PRO A 753 24.838 21.519 24.161 1.00 51.68 C ATOM 2411 CG PRO A 753 23.732 20.936 24.969 1.00 48.58 C ATOM 2412 CD PRO A 753 22.486 21.496 24.367 1.00 44.55 C ATOM 2413 N PRO A 754 25.793 23.614 21.848 1.00 53.74 N ATOM 2414 CA PRO A 754 26.064 23.801 20.414 1.00 50.91 C ATOM 2415 C PRO A 754 25.923 22.551 19.550 1.00 46.14 C ATOM 2416 O PRO A 754 25.520 22.667 18.398 1.00 45.75 O ATOM 2417 CB PRO A 754 27.521 24.292 20.391 1.00 52.70 C ATOM 2418 CG PRO A 754 27.696 24.963 21.708 1.00 52.25 C ATOM 2419 CD PRO A 754 26.920 24.101 22.670 1.00 54.25 C ATOM 2420 N GLU A 755 26.249 21.383 20.100 1.00 45.54 N ATOM 2421 CA GLU A 755 26.109 20.106 19.387 1.00 43.89 C ATOM 2422 C GLU A 755 24.658 19.850 18.926 1.00 48.13 C ATOM 2423 O GLU A 755 24.420 19.345 17.831 1.00 48.20 O ATOM 2424 CB GLU A 755 26.564 18.937 20.279 1.00 55.30 C ATOM 2425 CG GLU A 755 28.080 18.721 20.361 1.00 75.90 C ATOM 2426 CD GLU A 755 28.798 19.583 21.405 1.00 84.73 C ATOM 2427 OE1 GLU A 755 28.173 20.478 22.036 1.00 69.19 O ATOM 2428 OE2 GLU A 755 30.016 19.361 21.587 1.00 81.20 O ATOM 2429 H GLU A 755 26.617 21.374 21.073 1.00 0.00 H ATOM 2430 N VAL A 756 23.700 20.216 19.770 1.00 43.33 N ATOM 2431 CA VAL A 756 22.276 20.023 19.465 1.00 43.66 C ATOM 2432 C VAL A 756 21.773 21.107 18.510 1.00 42.82 C ATOM 2433 O VAL A 756 20.999 20.816 17.597 1.00 42.61 O ATOM 2434 CB VAL A 756 21.431 19.980 20.752 1.00 46.35 C ATOM 2435 CG1 VAL A 756 19.950 19.792 20.428 1.00 56.21 C ATOM 2436 CG2 VAL A 756 21.914 18.841 21.639 1.00 45.51 C ATOM 2437 H VAL A 756 23.966 20.653 20.675 1.00 0.00 H ATOM 2438 N TYR A 757 22.230 22.346 18.700 1.00 45.72 N ATOM 2439 CA TYR A 757 21.918 23.416 17.761 1.00 39.85 C ATOM 2440 C TYR A 757 22.398 23.108 16.347 1.00 43.21 C ATOM 2441 O TYR A 757 21.781 23.537 15.373 1.00 43.26 O ATOM 2442 CB TYR A 757 22.497 24.742 18.224 1.00 46.56 C ATOM 2443 CG TYR A 757 21.993 25.922 17.423 1.00 48.88 C ATOM 2444 CD1 TYR A 757 20.624 26.186 17.318 1.00 46.40 C ATOM 2445 CD2 TYR A 757 22.876 26.779 16.771 1.00 45.11 C ATOM 2446 CE1 TYR A 757 20.153 27.267 16.591 1.00 46.50 C ATOM 2447 CE2 TYR A 757 22.413 27.866 16.040 1.00 49.63 C ATOM 2448 CZ TYR A 757 21.049 28.104 15.953 1.00 45.90 C ATOM 2449 OH TYR A 757 20.574 29.177 15.241 1.00 41.10 O ATOM 2450 HH TYR A 757 19.585 29.191 15.287 1.00 0.00 H ATOM 2451 H TYR A 757 22.819 22.552 19.532 1.00 0.00 H ATOM 2452 N ALA A 758 23.490 22.360 16.247 1.00 43.91 N ATOM 2453 CA ALA A 758 23.980 21.866 14.957 1.00 46.83 C ATOM 2454 C ALA A 758 22.989 20.896 14.303 1.00 47.91 C ATOM 2455 O ALA A 758 22.806 20.911 13.084 1.00 47.85 O ATOM 2456 CB ALA A 758 25.338 21.198 15.129 1.00 44.94 C ATOM 2457 H ALA A 758 24.015 22.117 17.111 1.00 0.00 H ATOM 2458 N ILE A 759 22.354 20.057 15.115 1.00 50.34 N ATOM 2459 CA ILE A 759 21.323 19.141 14.612 1.00 45.74 C ATOM 2460 C ILE A 759 20.092 19.936 14.142 1.00 36.26 C ATOM 2461 O ILE A 759 19.508 19.604 13.107 1.00 43.05 O ATOM 2462 CB ILE A 759 20.937 18.055 15.646 1.00 48.04 C ATOM 2463 CG1 ILE A 759 22.172 17.244 16.046 1.00 46.30 C ATOM 2464 CG2 ILE A 759 19.885 17.107 15.063 1.00 43.25 C ATOM 2465 CD1 ILE A 759 21.984 16.332 17.243 1.00 53.79 C ATOM 2466 H ILE A 759 22.592 20.049 16.127 1.00 0.00 H ATOM 2467 N MET A 760 19.713 20.987 14.874 1.00 42.65 N ATOM 2468 CA MET A 760 18.628 21.883 14.417 1.00 42.38 C ATOM 2469 C MET A 760 18.948 22.528 13.074 1.00 43.16 C ATOM 2470 O MET A 760 18.092 22.558 12.186 1.00 42.66 O ATOM 2471 CB MET A 760 18.334 23.006 15.408 1.00 42.05 C ATOM 2472 CG MET A 760 17.758 22.588 16.733 1.00 41.92 C ATOM 2473 SD MET A 760 17.418 24.074 17.668 1.00 44.52 S ATOM 2474 CE MET A 760 17.469 23.435 19.333 1.00 46.75 C ATOM 2475 H MET A 760 20.188 21.178 15.779 1.00 0.00 H ATOM 2476 N ARG A 761 20.166 23.061 12.934 1.00 39.35 N ATOM 2477 CA ARG A 761 20.602 23.688 11.674 1.00 36.68 C ATOM 2478 C ARG A 761 20.642 22.721 10.499 1.00 38.96 C ATOM 2479 O ARG A 761 20.329 23.105 9.371 1.00 49.26 O ATOM 2480 CB ARG A 761 21.969 24.381 11.835 1.00 42.57 C ATOM 2481 CG ARG A 761 21.891 25.703 12.581 1.00 46.99 C ATOM 2482 CD ARG A 761 23.260 26.285 12.920 1.00 49.38 C ATOM 2483 NE ARG A 761 24.102 26.515 11.745 1.00 65.82 N ATOM 2484 CZ ARG A 761 25.301 27.110 11.773 1.00 49.18 C ATOM 2485 NH1 ARG A 761 25.849 27.508 12.921 1.00 49.98 N ATOM 2486 NH2 ARG A 761 25.975 27.290 10.641 1.00 49.69 N ATOM 2487 HE ARG A 761 23.744 26.193 10.823 1.00 0.00 H ATOM 2488 HH12 ARG A 761 26.782 27.968 12.920 1.00 0.00 H ATOM 2489 HH11 ARG A 761 25.344 27.358 13.818 1.00 0.00 H ATOM 2490 HH22 ARG A 761 26.907 27.752 10.658 1.00 0.00 H ATOM 2491 HH21 ARG A 761 25.570 26.969 9.738 1.00 0.00 H ATOM 2492 H ARG A 761 20.825 23.032 13.738 1.00 0.00 H ATOM 2493 N GLY A 762 21.006 21.473 10.759 1.00 38.69 N ATOM 2494 CA GLY A 762 20.937 20.415 9.749 1.00 42.57 C ATOM 2495 C GLY A 762 19.538 20.150 9.203 1.00 47.89 C ATOM 2496 O GLY A 762 19.384 19.740 8.052 1.00 46.75 O ATOM 2497 H GLY A 762 21.352 21.238 11.711 1.00 0.00 H ATOM 2498 N CYS A 763 18.528 20.366 10.044 1.00 43.58 N ATOM 2499 CA CYS A 763 17.115 20.326 9.635 1.00 46.10 C ATOM 2500 C CYS A 763 16.662 21.561 8.848 1.00 38.37 C ATOM 2501 O CYS A 763 15.725 21.482 8.060 1.00 41.55 O ATOM 2502 CB CYS A 763 16.217 20.168 10.874 1.00 38.55 C ATOM 2503 SG CYS A 763 16.468 18.614 11.746 1.00 41.56 S ATOM 2504 H CYS A 763 18.749 20.573 11.039 1.00 0.00 H ATOM 2505 N TRP A 764 17.305 22.702 9.081 1.00 40.24 N ATOM 2506 CA TRP A 764 16.894 23.962 8.468 1.00 37.27 C ATOM 2507 C TRP A 764 17.692 24.410 7.223 1.00 42.67 C ATOM 2508 O TRP A 764 17.668 25.590 6.874 1.00 41.29 O ATOM 2509 CB TRP A 764 16.879 25.077 9.513 1.00 44.37 C ATOM 2510 CG TRP A 764 16.027 24.784 10.727 1.00 40.94 C ATOM 2511 CD1 TRP A 764 14.904 24.008 10.784 1.00 46.37 C ATOM 2512 CD2 TRP A 764 16.217 25.313 12.039 1.00 39.82 C ATOM 2513 NE1 TRP A 764 14.402 23.993 12.065 1.00 44.99 N ATOM 2514 CE2 TRP A 764 15.184 24.795 12.854 1.00 44.54 C ATOM 2515 CE3 TRP A 764 17.162 26.178 12.611 1.00 40.60 C ATOM 2516 CZ2 TRP A 764 15.075 25.107 14.210 1.00 38.09 C ATOM 2517 CZ3 TRP A 764 17.060 26.482 13.966 1.00 35.84 C ATOM 2518 CH2 TRP A 764 16.016 25.955 14.746 1.00 39.29 C ATOM 2519 HE1 TRP A 764 13.567 23.461 12.382 1.00 0.00 H ATOM 2520 H TRP A 764 18.126 22.696 9.720 1.00 0.00 H ATOM 2521 N GLN A 765 18.366 23.480 6.544 1.00 44.22 N ATOM 2522 CA GLN A 765 19.004 23.782 5.252 1.00 48.27 C ATOM 2523 C GLN A 765 17.923 24.199 4.274 1.00 45.15 C ATOM 2524 O GLN A 765 16.875 23.553 4.195 1.00 47.81 O ATOM 2525 CB GLN A 765 19.767 22.568 4.710 1.00 45.69 C ATOM 2526 CG GLN A 765 20.981 22.158 5.542 1.00 46.31 C ATOM 2527 CD GLN A 765 22.035 23.262 5.638 1.00 59.32 C ATOM 2528 OE1 GLN A 765 22.406 23.872 4.632 1.00 57.96 O ATOM 2529 NE2 GLN A 765 22.515 23.528 6.850 1.00 62.48 N ATOM 2530 HE22 GLN A 765 22.176 22.990 7.673 1.00 0.00 H ATOM 2531 HE21 GLN A 765 23.229 24.274 6.974 1.00 0.00 H ATOM 2532 H GLN A 765 18.442 22.520 6.936 1.00 0.00 H ATOM 2533 N ARG A 766 18.150 25.299 3.563 1.00 47.65 N ATOM 2534 CA ARG A 766 17.075 25.922 2.790 1.00 49.93 C ATOM 2535 C ARG A 766 16.603 25.032 1.648 1.00 50.13 C ATOM 2536 O ARG A 766 15.408 25.001 1.331 1.00 45.02 O ATOM 2537 CB ARG A 766 17.490 27.294 2.258 1.00 55.36 C ATOM 2538 CG ARG A 766 16.293 28.182 1.960 1.00 54.88 C ATOM 2539 CD ARG A 766 16.622 29.309 1.004 1.00 64.63 C ATOM 2540 NE ARG A 766 15.410 29.914 0.444 1.00 67.18 N ATOM 2541 CZ ARG A 766 14.593 30.753 1.081 1.00 51.95 C ATOM 2542 NH1 ARG A 766 14.804 31.108 2.349 1.00 60.38 N ATOM 2543 NH2 ARG A 766 13.533 31.235 0.439 1.00 58.50 N ATOM 2544 HE ARG A 766 15.166 29.667 -0.536 1.00 0.00 H ATOM 2545 HH12 ARG A 766 14.150 31.765 2.821 1.00 0.00 H ATOM 2546 HH11 ARG A 766 15.623 30.728 2.866 1.00 0.00 H ATOM 2547 HH22 ARG A 766 12.886 31.891 0.922 1.00 0.00 H ATOM 2548 HH21 ARG A 766 13.351 30.956 -0.546 1.00 0.00 H ATOM 2549 H ARG A 766 19.101 25.721 3.556 1.00 0.00 H ATOM 2550 N GLU A 767 17.541 24.303 1.050 1.00 49.26 N ATOM 2551 CA GLU A 767 17.240 23.375 -0.026 1.00 54.31 C ATOM 2552 C GLU A 767 16.804 22.069 0.629 1.00 58.22 C ATOM 2553 O GLU A 767 17.575 21.511 1.419 1.00 49.02 O ATOM 2554 CB GLU A 767 18.471 23.138 -0.918 1.00 60.44 C ATOM 2555 CG GLU A 767 19.173 24.400 -1.420 1.00 74.90 C ATOM 2556 CD GLU A 767 18.238 25.405 -2.074 1.00 83.71 C ATOM 2557 OE1 GLU A 767 17.472 25.001 -2.978 1.00 68.90 O ATOM 2558 OE2 GLU A 767 18.278 26.598 -1.686 1.00 86.66 O ATOM 2559 H GLU A 767 18.527 24.401 1.365 1.00 0.00 H ATOM 2560 N PRO A 768 15.573 21.587 0.326 1.00 47.48 N ATOM 2561 CA PRO A 768 15.051 20.359 0.940 1.00 53.20 C ATOM 2562 C PRO A 768 16.005 19.170 0.875 1.00 52.24 C ATOM 2563 O PRO A 768 16.266 18.544 1.901 1.00 49.92 O ATOM 2564 CB PRO A 768 13.782 20.075 0.126 1.00 49.50 C ATOM 2565 CG PRO A 768 13.317 21.414 -0.307 1.00 50.05 C ATOM 2566 CD PRO A 768 14.565 22.215 -0.554 1.00 50.73 C ATOM 2567 N GLN A 769 16.545 18.906 -0.316 1.00 56.93 N ATOM 2568 CA GLN A 769 17.473 17.785 -0.551 1.00 56.31 C ATOM 2569 C GLN A 769 18.798 17.853 0.232 1.00 50.26 C ATOM 2570 O GLN A 769 19.454 16.827 0.415 1.00 65.07 O ATOM 2571 CB GLN A 769 17.739 17.587 -2.063 1.00 63.84 C ATOM 2572 CG GLN A 769 18.494 18.716 -2.772 1.00 61.77 C ATOM 2573 CD GLN A 769 17.593 19.732 -3.474 1.00 78.19 C ATOM 2574 OE1 GLN A 769 16.481 20.038 -3.010 1.00 61.26 O ATOM 2575 NE2 GLN A 769 18.079 20.277 -4.593 1.00 82.96 N ATOM 2576 HE22 GLN A 769 19.015 19.992 -4.946 1.00 0.00 H ATOM 2577 HE21 GLN A 769 17.522 20.986 -5.111 1.00 0.00 H ATOM 2578 H GLN A 769 16.299 19.521 -1.118 1.00 0.00 H ATOM 2579 N GLN A 770 19.179 19.050 0.685 1.00 56.23 N ATOM 2580 CA GLN A 770 20.359 19.254 1.546 1.00 51.22 C ATOM 2581 C GLN A 770 20.130 18.998 3.049 1.00 59.29 C ATOM 2582 O GLN A 770 21.094 18.972 3.823 1.00 47.59 O ATOM 2583 CB GLN A 770 20.886 20.689 1.371 1.00 58.81 C ATOM 2584 CG GLN A 770 21.378 21.006 -0.035 1.00 64.17 C ATOM 2585 CD GLN A 770 22.721 20.375 -0.331 1.00 63.56 C ATOM 2586 OE1 GLN A 770 22.799 19.295 -0.919 1.00 78.67 O ATOM 2587 NE2 GLN A 770 23.792 21.035 0.102 1.00 76.27 N ATOM 2588 HE22 GLN A 770 23.679 21.944 0.594 1.00 0.00 H ATOM 2589 HE21 GLN A 770 24.742 20.642 -0.051 1.00 0.00 H ATOM 2590 H GLN A 770 18.615 19.881 0.417 1.00 0.00 H ATOM 2591 N ARG A 771 18.876 18.844 3.476 1.00 50.73 N ATOM 2592 CA ARG A 771 18.584 18.588 4.894 1.00 45.68 C ATOM 2593 C ARG A 771 19.011 17.179 5.257 1.00 41.56 C ATOM 2594 O ARG A 771 18.922 16.264 4.435 1.00 49.94 O ATOM 2595 CB ARG A 771 17.097 18.780 5.192 1.00 46.29 C ATOM 2596 CG ARG A 771 16.688 20.235 5.166 1.00 41.47 C ATOM 2597 CD ARG A 771 15.198 20.430 5.003 1.00 40.99 C ATOM 2598 NE ARG A 771 14.920 21.773 4.493 1.00 43.34 N ATOM 2599 CZ ARG A 771 13.781 22.166 3.931 1.00 39.26 C ATOM 2600 NH1 ARG A 771 12.756 21.329 3.801 1.00 38.82 N ATOM 2601 NH2 ARG A 771 13.667 23.414 3.493 1.00 40.08 N ATOM 2602 HE ARG A 771 15.678 22.480 4.577 1.00 0.00 H ATOM 2603 HH12 ARG A 771 11.872 21.654 3.359 1.00 0.00 H ATOM 2604 HH11 ARG A 771 12.838 20.350 4.142 1.00 0.00 H ATOM 2605 HH22 ARG A 771 12.780 23.731 3.052 1.00 0.00 H ATOM 2606 HH21 ARG A 771 14.464 24.074 3.591 1.00 0.00 H ATOM 2607 H ARG A 771 18.092 18.906 2.795 1.00 0.00 H ATOM 2608 N HIS A 772 19.493 17.005 6.482 1.00 40.70 N ATOM 2609 CA HIS A 772 19.842 15.665 6.975 1.00 48.31 C ATOM 2610 C HIS A 772 18.590 14.794 7.081 1.00 53.74 C ATOM 2611 O HIS A 772 17.480 15.308 7.272 1.00 52.19 O ATOM 2612 CB HIS A 772 20.531 15.733 8.335 1.00 48.66 C ATOM 2613 CG HIS A 772 21.792 16.540 8.347 1.00 55.99 C ATOM 2614 ND1 HIS A 772 22.488 16.874 7.202 1.00 59.10 N ATOM 2615 CD2 HIS A 772 22.501 17.053 9.379 1.00 53.86 C ATOM 2616 CE1 HIS A 772 23.553 17.584 7.530 1.00 67.58 C ATOM 2617 NE2 HIS A 772 23.586 17.703 8.845 1.00 58.27 N ATOM 2618 H HIS A 772 19.626 17.829 7.102 1.00 0.00 H ATOM 2619 N SER A 773 18.768 13.484 6.926 1.00 52.00 N ATOM 2620 CA SER A 773 17.651 12.542 7.012 1.00 46.13 C ATOM 2621 C SER A 773 17.241 12.394 8.470 1.00 45.23 C ATOM 2622 O SER A 773 18.086 12.453 9.369 1.00 49.24 O ATOM 2623 CB SER A 773 18.045 11.171 6.464 1.00 55.04 C ATOM 2624 OG SER A 773 18.932 10.499 7.352 1.00 57.36 O ATOM 2625 HG SER A 773 18.488 10.375 8.228 1.00 0.00 H ATOM 2626 H SER A 773 19.724 13.121 6.739 1.00 0.00 H ATOM 2627 N ILE A 774 15.953 12.165 8.700 1.00 48.96 N ATOM 2628 CA ILE A 774 15.436 11.970 10.060 1.00 43.29 C ATOM 2629 C ILE A 774 16.124 10.789 10.765 1.00 39.72 C ATOM 2630 O ILE A 774 16.309 10.800 11.978 1.00 43.29 O ATOM 2631 CB ILE A 774 13.886 11.823 10.057 1.00 48.21 C ATOM 2632 CG1 ILE A 774 13.301 11.951 11.469 1.00 43.80 C ATOM 2633 CG2 ILE A 774 13.447 10.511 9.408 1.00 55.38 C ATOM 2634 CD1 ILE A 774 13.524 13.292 12.149 1.00 49.15 C ATOM 2635 H ILE A 774 15.294 12.123 7.896 1.00 0.00 H ATOM 2636 N LYS A 775 16.515 9.782 9.987 1.00 50.80 N ATOM 2637 CA LYS A 775 17.289 8.653 10.508 1.00 49.74 C ATOM 2638 C LYS A 775 18.619 9.117 11.104 1.00 54.91 C ATOM 2639 O LYS A 775 18.983 8.710 12.208 1.00 55.79 O ATOM 2640 CB LYS A 775 17.526 7.613 9.417 1.00 55.62 C ATOM 2641 CG LYS A 775 17.706 6.203 9.954 1.00 67.11 C ATOM 2642 CD LYS A 775 17.960 5.214 8.830 1.00 67.78 C ATOM 2643 CE LYS A 775 18.524 3.933 9.361 1.00 51.16 C ATOM 2644 NZ LYS A 775 18.485 2.851 8.341 1.00 50.84 N ATOM 2645 HZ1 LYS A 775 17.500 2.682 8.054 1.00 0.00 H ATOM 2646 HZ2 LYS A 775 19.044 3.137 7.512 1.00 0.00 H ATOM 2647 HZ3 LYS A 775 18.884 1.980 8.746 1.00 0.00 H ATOM 2648 H LYS A 775 16.263 9.797 8.978 1.00 0.00 H ATOM 2649 N ASP A 776 19.327 9.988 10.386 1.00 52.86 N ATOM 2650 CA ASP A 776 20.586 10.551 10.887 1.00 52.95 C ATOM 2651 C ASP A 776 20.351 11.418 12.107 1.00 45.70 C ATOM 2652 O ASP A 776 21.117 11.354 13.068 1.00 48.81 O ATOM 2653 CB ASP A 776 21.310 11.379 9.815 1.00 56.92 C ATOM 2654 CG ASP A 776 22.040 10.525 8.786 1.00 68.24 C ATOM 2655 OD1 ASP A 776 21.902 9.278 8.793 1.00 70.51 O ATOM 2656 OD2 ASP A 776 22.762 11.122 7.952 1.00 76.67 O ATOM 2657 H ASP A 776 18.979 10.275 9.449 1.00 0.00 H ATOM 2658 N VAL A 777 19.298 12.232 12.055 1.00 50.56 N ATOM 2659 CA VAL A 777 18.907 13.081 13.180 1.00 49.12 C ATOM 2660 C VAL A 777 18.617 12.226 14.424 1.00 39.60 C ATOM 2661 O VAL A 777 19.075 12.556 15.522 1.00 43.83 O ATOM 2662 CB VAL A 777 17.680 13.965 12.819 1.00 42.56 C ATOM 2663 CG1 VAL A 777 17.132 14.692 14.032 1.00 37.82 C ATOM 2664 CG2 VAL A 777 18.049 14.990 11.752 1.00 44.57 C ATOM 2665 H VAL A 777 18.733 12.265 11.182 1.00 0.00 H ATOM 2666 N HIS A 778 17.843 11.154 14.247 1.00 41.40 N ATOM 2667 CA HIS A 778 17.514 10.231 15.353 1.00 43.58 C ATOM 2668 C HIS A 778 18.773 9.578 15.929 1.00 47.57 C ATOM 2669 O HIS A 778 18.955 9.523 17.158 1.00 44.63 O ATOM 2670 CB HIS A 778 16.534 9.140 14.889 1.00 42.85 C ATOM 2671 CG HIS A 778 16.429 7.973 15.830 1.00 41.03 C ATOM 2672 ND1 HIS A 778 16.948 6.731 15.535 1.00 51.19 N ATOM 2673 CD2 HIS A 778 15.880 7.865 17.065 1.00 47.50 C ATOM 2674 CE1 HIS A 778 16.721 5.906 16.543 1.00 48.52 C ATOM 2675 NE2 HIS A 778 16.072 6.571 17.484 1.00 50.12 N ATOM 2676 H HIS A 778 17.459 10.962 13.300 1.00 0.00 H ATOM 2677 N ALA A 779 19.617 9.069 15.028 1.00 49.45 N ATOM 2678 CA ALA A 779 20.891 8.420 15.393 1.00 46.48 C ATOM 2679 C ALA A 779 21.762 9.288 16.293 1.00 42.55 C ATOM 2680 O ALA A 779 22.272 8.816 17.315 1.00 50.69 O ATOM 2681 CB ALA A 779 21.662 8.028 14.137 1.00 50.35 C ATOM 2682 H ALA A 779 19.364 9.133 14.021 1.00 0.00 H ATOM 2683 N ARG A 780 21.891 10.562 15.935 1.00 44.04 N ATOM 2684 CA ARG A 780 22.662 11.513 16.735 1.00 44.11 C ATOM 2685 C ARG A 780 22.030 11.850 18.080 1.00 49.19 C ATOM 2686 O ARG A 780 22.733 11.968 19.085 1.00 45.51 O ATOM 2687 CB ARG A 780 22.900 12.806 15.941 1.00 51.84 C ATOM 2688 CG ARG A 780 23.833 12.617 14.751 1.00 59.65 C ATOM 2689 CD ARG A 780 24.087 13.912 13.996 1.00 57.32 C ATOM 2690 NE ARG A 780 24.881 13.667 12.818 1.00 47.86 N ATOM 2691 CZ ARG A 780 25.217 14.580 11.916 1.00 46.14 C ATOM 2692 NH1 ARG A 780 24.840 15.846 12.051 1.00 43.66 N ATOM 2693 NH2 ARG A 780 25.945 14.221 10.869 1.00 46.27 N ATOM 2694 HE ARG A 780 25.218 12.695 12.663 1.00 0.00 H ATOM 2695 HH12 ARG A 780 25.112 16.549 11.334 1.00 0.00 H ATOM 2696 HH11 ARG A 780 24.273 16.135 12.873 1.00 0.00 H ATOM 2697 HH22 ARG A 780 26.214 14.928 10.156 1.00 0.00 H ATOM 2698 HH21 ARG A 780 26.247 13.232 10.760 1.00 0.00 H ATOM 2699 H ARG A 780 21.431 10.891 15.062 1.00 0.00 H ATOM 2700 N LEU A 781 20.710 12.038 18.095 1.00 48.16 N ATOM 2701 CA LEU A 781 20.016 12.419 19.331 1.00 38.74 C ATOM 2702 C LEU A 781 19.952 11.272 20.325 1.00 34.50 C ATOM 2703 O LEU A 781 20.055 11.504 21.535 1.00 42.04 O ATOM 2704 CB LEU A 781 18.595 12.919 19.026 1.00 44.38 C ATOM 2705 CG LEU A 781 18.484 14.267 18.315 1.00 37.15 C ATOM 2706 CD1 LEU A 781 17.083 14.449 17.734 1.00 44.05 C ATOM 2707 CD2 LEU A 781 18.818 15.397 19.267 1.00 38.87 C ATOM 2708 H LEU A 781 20.164 11.913 17.218 1.00 0.00 H ATOM 2709 N GLN A 782 19.747 10.051 19.823 1.00 42.15 N ATOM 2710 CA GLN A 782 19.696 8.853 20.675 1.00 53.72 C ATOM 2711 C GLN A 782 21.040 8.603 21.355 1.00 51.55 C ATOM 2712 O GLN A 782 21.094 8.329 22.560 1.00 49.94 O ATOM 2713 CB GLN A 782 19.310 7.617 19.853 1.00 52.19 C ATOM 2714 CG GLN A 782 19.091 6.363 20.691 1.00 51.41 C ATOM 2715 CD GLN A 782 18.863 5.114 19.850 1.00 50.56 C ATOM 2716 OE1 GLN A 782 19.808 4.509 19.347 1.00 69.69 O ATOM 2717 NE2 GLN A 782 17.612 4.712 19.712 1.00 57.81 N ATOM 2718 HE22 GLN A 782 16.841 5.252 20.153 1.00 0.00 H ATOM 2719 HE21 GLN A 782 17.399 3.856 19.162 1.00 0.00 H ATOM 2720 H GLN A 782 19.619 9.944 18.796 1.00 0.00 H ATOM 2721 N ALA A 783 22.108 8.670 20.561 1.00 51.22 N ATOM 2722 CA ALA A 783 23.481 8.562 21.067 1.00 46.40 C ATOM 2723 C ALA A 783 23.707 9.532 22.210 1.00 52.73 C ATOM 2724 O ALA A 783 24.208 9.142 23.260 1.00 51.76 O ATOM 2725 CB ALA A 783 24.462 8.843 19.952 1.00 55.99 C ATOM 2726 H ALA A 783 21.962 8.804 19.540 1.00 0.00 H ATOM 2727 N LEU A 784 23.294 10.784 21.999 1.00 51.55 N ATOM 2728 CA LEU A 784 23.354 11.824 23.032 1.00 46.50 C ATOM 2729 C LEU A 784 22.455 11.542 24.248 1.00 52.02 C ATOM 2730 O LEU A 784 22.894 11.679 25.389 1.00 46.48 O ATOM 2731 CB LEU A 784 23.015 13.193 22.431 1.00 43.94 C ATOM 2732 CG LEU A 784 24.043 13.827 21.490 1.00 54.20 C ATOM 2733 CD1 LEU A 784 23.459 15.058 20.810 1.00 46.78 C ATOM 2734 CD2 LEU A 784 25.312 14.216 22.227 1.00 55.81 C ATOM 2735 H LEU A 784 22.914 11.032 21.063 1.00 0.00 H ATOM 2736 N ALA A 785 21.205 11.146 24.014 1.00 46.79 N ATOM 2737 CA ALA A 785 20.302 10.743 25.108 1.00 41.09 C ATOM 2738 C ALA A 785 20.870 9.589 25.953 1.00 40.39 C ATOM 2739 O ALA A 785 20.738 9.592 27.184 1.00 39.05 O ATOM 2740 CB ALA A 785 18.942 10.336 24.549 1.00 41.58 C ATOM 2741 H ALA A 785 20.857 11.120 23.034 1.00 0.00 H ATOM 2742 N GLN A 786 21.477 8.611 25.272 1.00 43.12 N ATOM 2743 CA GLN A 786 22.083 7.433 25.911 1.00 41.27 C ATOM 2744 C GLN A 786 23.535 7.620 26.384 1.00 61.46 C ATOM 2745 O GLN A 786 24.109 6.699 26.974 1.00 55.91 O ATOM 2746 CB GLN A 786 22.052 6.266 24.929 1.00 54.29 C ATOM 2747 CG GLN A 786 20.656 5.758 24.634 1.00 62.22 C ATOM 2748 CD GLN A 786 20.635 4.698 23.556 1.00 65.28 C ATOM 2749 OE1 GLN A 786 21.678 4.224 23.105 1.00 74.67 O ATOM 2750 NE2 GLN A 786 19.438 4.320 23.135 1.00 69.12 N ATOM 2751 HE22 GLN A 786 18.583 4.748 23.545 1.00 0.00 H ATOM 2752 HE21 GLN A 786 19.352 3.595 22.394 1.00 0.00 H ATOM 2753 H GLN A 786 21.523 8.687 24.236 1.00 0.00 H ATOM 2754 N ALA A 787 24.134 8.779 26.105 1.00 56.63 N ATOM 2755 CA ALA A 787 25.531 9.057 26.469 1.00 45.75 C ATOM 2756 C ALA A 787 25.689 9.170 27.982 1.00 52.16 C ATOM 2757 O ALA A 787 24.783 9.664 28.664 1.00 55.25 O ATOM 2758 CB ALA A 787 26.004 10.347 25.807 1.00 48.62 C ATOM 2759 H ALA A 787 23.591 9.515 25.610 1.00 0.00 H ATOM 2760 N PRO A 788 26.854 8.753 28.518 1.00 50.23 N ATOM 2761 CA PRO A 788 27.041 8.810 29.966 1.00 44.90 C ATOM 2762 C PRO A 788 27.136 10.241 30.494 1.00 43.00 C ATOM 2763 O PRO A 788 27.523 11.129 29.734 1.00 49.66 O ATOM 2764 CB PRO A 788 28.364 8.071 30.182 1.00 49.10 C ATOM 2765 CG PRO A 788 29.092 8.199 28.902 1.00 44.61 C ATOM 2766 CD PRO A 788 28.064 8.283 27.816 1.00 47.15 C ATOM 2767 N PRO A 789 26.779 10.468 31.778 1.00 46.04 N ATOM 2768 CA PRO A 789 26.807 11.808 32.395 1.00 41.88 C ATOM 2769 C PRO A 789 28.149 12.533 32.299 1.00 53.79 C ATOM 2770 O PRO A 789 28.164 13.757 32.216 1.00 58.10 O ATOM 2771 CB PRO A 789 26.471 11.556 33.874 1.00 44.57 C ATOM 2772 CG PRO A 789 26.126 10.111 34.004 1.00 48.62 C ATOM 2773 CD PRO A 789 26.174 9.455 32.663 1.00 50.66 C ATOM 2774 N VAL A 790 29.254 11.786 32.334 1.00 50.71 N ATOM 2775 CA VAL A 790 30.589 12.359 32.139 1.00 45.27 C ATOM 2776 C VAL A 790 30.652 13.065 30.775 1.00 43.35 C ATOM 2777 O VAL A 790 31.098 14.205 30.688 1.00 45.35 O ATOM 2778 CB VAL A 790 31.681 11.266 32.305 1.00 44.06 C ATOM 2779 CG1 VAL A 790 33.056 11.731 31.840 1.00 52.72 C ATOM 2780 CG2 VAL A 790 31.761 10.850 33.765 1.00 46.53 C ATOM 2781 H VAL A 790 29.165 10.764 32.505 1.00 0.00 H ATOM 2782 N TYR A 791 30.172 12.396 29.728 1.00 36.38 N ATOM 2783 CA TYR A 791 30.110 13.001 28.395 1.00 41.57 C ATOM 2784 C TYR A 791 29.132 14.179 28.325 1.00 41.32 C ATOM 2785 O TYR A 791 29.483 15.244 27.823 1.00 36.73 O ATOM 2786 CB TYR A 791 29.727 11.962 27.356 1.00 39.56 C ATOM 2787 CG TYR A 791 29.910 12.408 25.925 1.00 37.63 C ATOM 2788 CD1 TYR A 791 31.142 12.284 25.294 1.00 41.43 C ATOM 2789 CD2 TYR A 791 28.846 12.922 25.188 1.00 46.18 C ATOM 2790 CE1 TYR A 791 31.322 12.669 23.984 1.00 41.91 C ATOM 2791 CE2 TYR A 791 29.019 13.309 23.871 1.00 46.64 C ATOM 2792 CZ TYR A 791 30.262 13.184 23.279 1.00 49.77 C ATOM 2793 OH TYR A 791 30.451 13.558 21.977 1.00 47.40 O ATOM 2794 HH TYR A 791 31.395 13.400 21.723 1.00 0.00 H ATOM 2795 H TYR A 791 29.833 11.422 29.860 1.00 0.00 H ATOM 2796 N LEU A 792 27.915 13.979 28.834 1.00 45.48 N ATOM 2797 CA LEU A 792 26.888 15.029 28.786 1.00 49.87 C ATOM 2798 C LEU A 792 27.221 16.270 29.588 1.00 45.20 C ATOM 2799 O LEU A 792 26.882 17.372 29.168 1.00 52.15 O ATOM 2800 CB LEU A 792 25.519 14.490 29.206 1.00 53.54 C ATOM 2801 CG LEU A 792 24.864 13.557 28.194 1.00 50.42 C ATOM 2802 CD1 LEU A 792 23.570 12.989 28.776 1.00 59.82 C ATOM 2803 CD2 LEU A 792 24.593 14.263 26.870 1.00 53.26 C ATOM 2804 H LEU A 792 27.689 13.063 29.273 1.00 0.00 H ATOM 2805 N ASP A 793 27.906 16.102 30.719 1.00 54.59 N ATOM 2806 CA ASP A 793 28.325 17.249 31.545 1.00 49.10 C ATOM 2807 C ASP A 793 29.290 18.206 30.868 1.00 41.78 C ATOM 2808 O ASP A 793 29.410 19.341 31.307 1.00 50.64 O ATOM 2809 CB ASP A 793 28.940 16.773 32.871 1.00 56.19 C ATOM 2810 CG ASP A 793 27.885 16.373 33.901 1.00 72.95 C ATOM 2811 OD1 ASP A 793 26.776 15.933 33.508 1.00 70.45 O ATOM 2812 OD2 ASP A 793 28.169 16.494 35.114 1.00 72.81 O ATOM 2813 H ASP A 793 28.151 15.139 31.026 1.00 0.00 H ATOM 2814 N VAL A 794 29.982 17.744 29.824 1.00 46.28 N ATOM 2815 CA VAL A 794 30.984 18.532 29.093 1.00 49.67 C ATOM 2816 C VAL A 794 30.426 19.346 27.914 1.00 54.00 C ATOM 2817 O VAL A 794 31.005 20.374 27.553 1.00 78.00 O ATOM 2818 CB VAL A 794 32.124 17.592 28.605 1.00 54.83 C ATOM 2819 CG1 VAL A 794 33.091 18.294 27.674 1.00 75.29 C ATOM 2820 CG2 VAL A 794 32.896 17.055 29.794 1.00 61.69 C ATOM 2821 H VAL A 794 29.801 16.769 29.510 1.00 0.00 H ATOM 2822 N LEU A 795 29.330 18.892 27.309 1.00 61.55 N ATOM 2823 CA LEU A 795 28.716 19.586 26.146 1.00 71.50 C ATOM 2824 C LEU A 795 28.446 21.078 26.389 1.00 66.09 C ATOM 2825 O LEU A 795 27.901 21.451 27.427 1.00 63.57 O ATOM 2826 CB LEU A 795 27.402 18.912 25.741 1.00 66.00 C ATOM 2827 CG LEU A 795 27.510 17.764 24.744 1.00 69.52 C ATOM 2828 CD1 LEU A 795 28.188 16.558 25.362 1.00 71.30 C ATOM 2829 CD2 LEU A 795 26.128 17.391 24.239 1.00 74.66 C ATOM 2830 H LEU A 795 28.887 18.020 27.663 1.00 0.00 H TER 2831 LEU A 795 HETATM 2832 O HOH 1 -5.107 13.814 32.427 1.00 52.42 O HETATM 2833 O HOH 2 10.292 19.521 37.673 1.00 54.99 O HETATM 2834 O HOH 3 5.366 18.931 6.326 1.00 40.91 O HETATM 2835 O HOH 4 -4.652 3.601 28.233 1.00 38.75 O HETATM 2836 O HOH 5 0.744 31.441 14.155 1.00 44.80 O HETATM 2837 O HOH 6 -15.673 -4.497 23.400 1.00 47.71 O HETATM 2838 O HOH 7 5.627 26.071 20.996 1.00 40.35 O HETATM 2839 O HOH 8 -11.892 19.320 17.484 1.00 71.08 O HETATM 2840 O HOH 9 0.690 24.407 26.332 1.00 47.36 O HETATM 2841 O HOH 10 -6.896 29.282 21.846 1.00 60.03 O HETATM 2842 O HOH 11 -20.472 7.179 32.432 1.00 43.47 O HETATM 2843 O HOH 12 7.995 4.544 16.970 1.00 60.24 O HETATM 2844 O HOH 13 2.788 3.155 21.088 1.00 51.10 O HETATM 2845 O HOH 14 2.234 29.254 13.344 1.00 41.19 O HETATM 2846 O HOH 15 4.616 28.990 29.712 1.00 57.26 O HETATM 2847 O HOH 16 11.771 4.383 14.765 1.00 47.06 O HETATM 2848 O HOH 17 -6.771 -4.814 13.007 1.00 60.36 O HETATM 2849 O HOH 18 2.073 24.988 21.391 1.00 43.53 O HETATM 2850 O HOH 19 16.570 27.416 26.729 1.00 45.81 O HETATM 2851 O HOH 20 -0.790 21.430 8.256 1.00 55.77 O HETATM 2852 O HOH 21 32.654 15.204 32.769 1.00 51.43 O HETATM 2853 O HOH 22 -22.608 -2.733 23.901 1.00 51.61 O HETATM 2854 O HOH 23 9.567 27.403 10.346 1.00 33.35 O HETATM 2855 O HOH 24 14.041 12.293 6.665 1.00 53.06 O HETATM 2856 O HOH 25 8.627 27.668 29.182 1.00 41.85 O HETATM 2857 O HOH 26 -21.708 5.316 21.293 1.00 51.14 O HETATM 2858 O HOH 27 2.065 28.934 21.531 1.00 47.06 O HETATM 2859 O HOH 28 3.349 23.208 19.805 1.00 33.01 O HETATM 2860 O HOH 29 0.845 3.163 18.028 1.00 49.04 O HETATM 2861 O HOH 30 1.956 17.972 32.034 1.00 52.50 O HETATM 2862 O HOH 31 -8.113 -0.469 15.172 1.00 38.55 O HETATM 2863 O HOH 32 -0.130 7.640 31.074 1.00 33.46 O HETATM 2864 O HOH 33 3.377 22.163 12.679 1.00 35.78 O HETATM 2865 O HOH 34 11.589 33.046 18.659 1.00 45.15 O HETATM 2866 O HOH 35 4.151 21.844 9.772 1.00 44.34 O HETATM 2867 O HOH 36 9.241 11.881 8.780 1.00 50.73 O HETATM 2868 O HOH 37 11.349 13.181 7.693 1.00 49.98 O HETATM 2869 O HOH 38 4.989 19.010 9.869 1.00 42.26 O HETATM 2870 O HOH 39 -0.021 37.400 14.593 1.00 55.19 O HETATM 2871 O HOH 40 -3.111 19.651 21.623 1.00 54.00 O HETATM 2872 O HOH 41 -24.087 1.532 13.270 1.00 59.72 O HETATM 2873 O HOH 42 2.603 18.678 -1.399 1.00 57.17 O HETATM 2874 O HOH 43 12.978 18.006 35.922 1.00 50.15 O HETATM 2875 O HOH 44 -5.527 2.051 34.273 1.00 55.26 O HETATM 2876 O HOH 45 -21.322 1.558 29.922 1.00 57.50 O HETATM 2877 O HOH 46 14.738 33.085 17.771 1.00 46.54 O HETATM 2878 O HOH 47 -20.603 5.635 29.813 1.00 30.60 O HETATM 2879 O HOH 48 14.608 28.137 12.135 1.00 40.53 O HETATM 2880 O HOH 49 -12.766 -5.987 15.605 1.00 35.69 O HETATM 2881 O HOH 50 0.000 8.150 38.218 1.00 54.44 O HETATM 2882 O HOH 51 5.326 31.532 24.008 1.00 38.56 O HETATM 2883 O HOH 52 15.732 29.929 25.356 1.00 42.78 O HETATM 2884 O HOH 53 1.311 6.245 43.041 1.00 45.34 O HETATM 2885 O HOH 54 26.096 16.549 16.615 1.00 61.17 O HETATM 2886 O HOH 55 3.122 17.565 34.453 1.00 56.07 O HETATM 2887 O HOH 56 1.161 0.547 19.195 1.00 56.11 O HETATM 2888 O HOH 57 -2.529 1.561 28.080 1.00 58.81 O HETATM 2889 C2 OOJ A 58 0.020 10.338 13.339 1.00 0.37 C HETATM 2890 C5 OOJ A 58 -1.360 10.757 12.891 1.00 0.03 C HETATM 2891 C6 OOJ A 58 -2.415 10.691 13.789 1.00 -0.01 C HETATM 2892 C7 OOJ A 58 -3.692 11.093 13.385 1.00 0.10 C HETATM 2893 C8 OOJ A 58 -3.901 11.560 12.084 1.00 -0.01 C HETATM 2894 C9 OOJ A 58 -2.845 11.628 11.198 1.00 -0.04 C HETATM 2895 C10 OOJ A 58 -1.580 11.233 11.600 1.00 -0.05 C HETATM 2896 H9 OOJ A 58 -0.752 11.295 10.903 1.00 0.07 H HETATM 2897 H8 OOJ A 58 -3.006 11.990 10.189 1.00 0.07 H HETATM 2898 H2 OOJ A 58 -4.892 11.868 11.771 1.00 0.08 H HETATM 2899 N11 OOJ A 58 -4.818 11.064 14.216 1.00 -0.21 N HETATM 2900 C12 OOJ A 58 -4.846 11.426 15.526 1.00 0.33 C HETATM 2901 O13 OOJ A 58 -3.854 11.788 16.140 1.00 -0.38 O HETATM 2902 N14 OOJ A 58 -6.045 11.362 16.134 1.00 -0.18 N HETATM 2903 C15 OOJ A 58 -6.302 11.711 17.451 1.00 0.22 C HETATM 2904 N16 OOJ A 58 -7.372 12.371 17.738 1.00 -0.28 N HETATM 2905 N17 OOJ A 58 -7.548 12.661 19.056 1.00 -0.28 N HETATM 2906 C18 OOJ A 58 -6.634 12.223 19.848 1.00 0.16 C HETATM 2907 S19 OOJ A 58 -6.768 12.540 21.573 1.00 -0.04 S HETATM 2908 C20 OOJ A 58 -5.803 11.284 22.448 1.00 0.05 C HETATM 2909 C21 OOJ A 58 -5.545 11.774 23.857 1.00 -0.02 C HETATM 2910 N22 OOJ A 58 -5.807 13.033 24.213 1.00 -0.33 N HETATM 2911 C23 OOJ A 58 -5.575 13.493 25.452 1.00 0.16 C HETATM 2912 C24 OOJ A 58 -5.881 14.834 25.781 1.00 -0.00 C HETATM 2913 C25 OOJ A 58 -5.635 15.289 27.051 1.00 -0.04 C HETATM 2914 C26 OOJ A 58 -5.074 14.424 28.014 1.00 0.01 C HETATM 2915 C27 OOJ A 58 -4.787 14.913 29.414 1.00 -0.03 C HETATM 2916 H4 OOJ A 58 -5.085 15.968 29.502 1.00 0.04 H HETATM 2917 H5 OOJ A 58 -3.711 14.817 29.622 1.00 0.04 H HETATM 2918 H6 OOJ A 58 -5.356 14.310 30.137 1.00 0.04 H HETATM 2919 C28 OOJ A 58 -4.784 13.144 27.678 1.00 0.12 C HETATM 2920 N29 OOJ A 58 -5.037 12.667 26.414 1.00 -0.14 N HETATM 2921 C30 OOJ A 58 -4.776 11.376 26.091 1.00 0.22 C HETATM 2922 C32 OOJ A 58 -5.025 10.899 24.795 1.00 -0.01 C HETATM 2923 H7 OOJ A 58 -4.814 9.863 24.533 1.00 0.02 H HETATM 2924 O31 OOJ A 58 -4.307 10.621 26.904 1.00 -0.41 O HETATM 2925 H15 OOJ A 58 -4.343 12.482 28.422 1.00 0.13 H HETATM 2926 H14 OOJ A 58 -5.873 16.318 27.316 1.00 0.07 H HETATM 2927 H3 OOJ A 58 -6.308 15.499 25.032 1.00 0.06 H HETATM 2928 H12 OOJ A 58 -6.366 10.339 22.480 1.00 0.06 H HETATM 2929 H13 OOJ A 58 -4.846 11.123 21.930 1.00 0.06 H HETATM 2930 S33 OOJ A 58 -5.381 11.365 18.922 1.00 0.07 S HETATM 2931 H11 OOJ A 58 -6.817 11.035 15.589 1.00 0.24 H HETATM 2932 H10 OOJ A 58 -5.676 10.750 13.811 1.00 0.23 H HETATM 2933 H1 OOJ A 58 -2.251 10.330 14.798 1.00 0.07 H HETATM 2934 F1 OOJ A 58 0.880 10.237 12.254 1.00 -0.22 F HETATM 2935 F3 OOJ A 58 0.026 9.131 14.035 1.00 -0.22 F HETATM 2936 F4 OOJ A 58 0.503 11.325 14.190 1.00 -0.22 F CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 476 477 483 484 485 CONECT 483 476 CONECT 484 476 CONECT 485 476 CONECT 1649 1637 1650 1659 CONECT 1650 1649 1651 1653 CONECT 1651 1650 1652 1660 CONECT 1652 1651 CONECT 1653 1650 1654 CONECT 1654 1653 1655 CONECT 1655 1654 1656 1657 1658 CONECT 1656 1655 CONECT 1657 1655 CONECT 1658 1655 CONECT 1659 1649 CONECT 1732 1733 1740 1741 1742 CONECT 1740 1732 CONECT 1741 1732 CONECT 1742 1732 CONECT 2889 2890 2934 2935 2936 CONECT 2890 2889 2891 2895 CONECT 2891 2890 2892 2933 CONECT 2892 2891 2893 2899 CONECT 2893 2892 2894 2898 CONECT 2894 2893 2895 2897 CONECT 2895 2890 2894 2896 CONECT 2896 2895 CONECT 2897 2894 CONECT 2898 2893 CONECT 2899 2892 2900 2932 CONECT 2900 2899 2901 2902 CONECT 2901 2900 CONECT 2902 2900 2903 2931 CONECT 2903 2902 2904 2930 CONECT 2904 2903 2905 CONECT 2905 2904 2906 CONECT 2906 2905 2907 2930 CONECT 2907 2906 2908 CONECT 2908 2907 2909 2928 2929 CONECT 2909 2908 2910 2922 CONECT 2910 2909 2911 CONECT 2911 2910 2912 2920 CONECT 2912 2911 2913 2927 CONECT 2913 2912 2914 2926 CONECT 2914 2913 2915 2919 CONECT 2915 2914 2916 2917 2918 CONECT 2916 2915 CONECT 2917 2915 CONECT 2918 2915 CONECT 2919 2914 2920 2925 CONECT 2920 2911 2919 2921 CONECT 2921 2920 2922 2924 CONECT 2922 2909 2921 2923 CONECT 2923 2922 CONECT 2924 2921 CONECT 2925 2919 CONECT 2926 2913 CONECT 2927 2912 CONECT 2928 2908 CONECT 2929 2908 CONECT 2930 2903 2906 CONECT 2931 2902 CONECT 2932 2899 CONECT 2933 2891 CONECT 2934 2889 CONECT 2935 2889 CONECT 2936 2889 MASTER 0 0 0 0 0 0 0 0 2933 3 71 24 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 6pl1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4pmm
RCSB PDB
PDBbind
291aa, >4PMM_1|Chain... at 98%
4pmp
RCSB PDB
PDBbind
291aa, >4PMP_1|Chain... at 98%
4pms
RCSB PDB
PDBbind
291aa, >4PMS_1|Chain... at 98%
4pmt
RCSB PDB
PDBbind
291aa, >4PMT_1|Chain... at 98%
4yne
RCSB PDB
PDBbind
303aa, >4YNE_1|Chain... at 97%
4yps
RCSB PDB
PDBbind
303aa, >4YPS_1|Chain... at 97%
5h3q
RCSB PDB
PDBbind
324aa, >5H3Q_1|Chain... *
5wr7
RCSB PDB
PDBbind
304aa, >5WR7_1|Chain... at 100%
6dkb
RCSB PDB
PDBbind
320aa, >6DKB_1|Chain... at 99%
6dkg
RCSB PDB
PDBbind
320aa, >6DKG_1|Chain... at 99%
6dki
RCSB PDB
PDBbind
320aa, >6DKI_1|Chain... at 99%
6pl3
RCSB PDB
PDBbind
311aa, >6PL3_1|Chain... at 100%
6pl2
RCSB PDB
PDBbind
311aa, >6PL2_1|Chain... at 100%
6nss
RCSB PDB
PDBbind
311aa, >6NSS_1|Chain... at 100%
6nsp
RCSB PDB
PDBbind
297aa, >6NSP_1|Chain... at 100%
6npt
RCSB PDB
PDBbind
305aa, >6NPT_1|Chain... at 100%
6j5l
RCSB PDB
PDBbind
303aa, >6J5L_1|Chain... at 97%
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
6pl1
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
hTrkA kinase domain enzyme
Ligand Name
OOJ
EC.Number
E.C.2.7.10.1
Resolution
2.03(Å)
Affinity (Kd/Ki/IC50)
Kd=22.2nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Bioorg.Med.Chem.Lett. Vol. 29: pp. 126680-126680
Ligand Properties
Formula
C
2
0
H
1
5
F
3
N
6
O
2
S
2
Molecular Weight
492.497
Exact Mass
492.065
No. of atoms
48
No. of bonds
51
Polar Surface Area
154.82
LOGP Value
2.61 (
Computed with XLOGP3
)
4.96 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 4
Canonical SMILES
O=C(Nc1nnc(s1)SCc1cc(=O)n2c(n1)ccc(c2)C)Nc1cccc(c1)C(F)(F)F
InChI String
InChI=1S/C20H15F3N6O2S2/c1-11-5-6-15-24-14(8-16(30)29(15)9-11)10-32-19-28-27-18(33-19)26-17(31)25-13-4-2-3-12(7-13)20(21,22)23/h2-9H,10H2,1H3,(H2,25,26,27,31)
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):
P04629
Entrez Gene ID
NCBI Entrez Gene ID:
4914
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝ｅ湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com
times since Nov 2007. 
娌叕缃戝畨澶囷細姝ｅ湪鐢宠涓