Browse entries in the PDBbind-CN Database
HEADER 6N3L_COMPLEX COMPND 6N3L_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 75 SER ARG TYR PHE ILE GLU PHE GLU GLU LEU GLN LEU LEU SEQRES 2 A 75 GLY LYS GLY ALA PHE GLY ALA VAL ILE LYS VAL GLN ASN SEQRES 3 A 75 LYS LEU ASP GLY CYS CYS TYR ALA VAL LYS ARG ILE PRO SEQRES 4 A 75 ILE ASN PRO ALA SER ARG GLN PHE ARG ARG ILE LYS GLY SEQRES 5 A 75 GLU VAL THR LEU LEU SER ARG LEU HIS HIS GLU ASN ILE SEQRES 6 A 75 VAL ARG TYR TYR ASN ALA TRP ILE GLU ASN SEQRES 1 A 73 VAL HIS TYR LEU TYR ILE GLN MET GLU TYR CYS GLU ALA SEQRES 2 A 73 SER THR LEU ARG ASP THR ILE ASP GLN GLY LEU TYR ARG SEQRES 3 A 73 ASP THR VAL ARG LEU TRP ARG LEU PHE ARG GLU ILE LEU SEQRES 4 A 73 ASP GLY LEU ALA TYR ILE HIS GLU LYS GLY MET ILE HIS SEQRES 5 A 73 ARG ASN LEU LYS PRO VAL ASN ILE PHE LEU ASP SER ASP SEQRES 6 A 73 ASP HIS VAL LYS ILE GLY ASP PHE SEQRES 1 A 8 ALA ALA LEU TYR VAL SER PRO GLU SEQRES 1 A 38 TYR ASN GLN LYS VAL ASP LEU PHE SER LEU GLY ILE ILE SEQRES 2 A 38 PHE PHE GLU MET SER TYR HIS PRO MET VAL THR ALA SER SEQRES 3 A 38 GLU ARG ILE PHE VAL LEU ASN GLN LEU ARG ASP PRO SEQRES 1 A 5 PHE PRO GLU ASP PHE SEQRES 1 A 32 HIS ALA LYS GLN LYS SER VAL ILE SER TRP LEU LEU ASN SEQRES 2 A 32 HIS ASP PRO ALA LYS ARG PRO THR ALA THR GLU LEU LEU SEQRES 3 A 32 LYS SER GLU LEU LEU PRO HET KAV A 259 53 ATOM 1 N SER A 584 -5.679 128.821 4.488 1.00105.16 N ATOM 2 CA SER A 584 -5.722 127.467 3.860 1.00104.68 C ATOM 3 C SER A 584 -4.519 126.661 4.370 1.00102.34 C ATOM 4 O SER A 584 -4.247 126.691 5.600 1.00111.27 O ATOM 5 CB SER A 584 -5.770 127.589 2.338 1.00103.81 C ATOM 6 OG SER A 584 -5.024 126.569 1.682 1.00 92.28 O ATOM 7 HG SER A 584 -5.088 126.694 0.702 1.00 0.00 H ATOM 8 HN3 SER A 584 -4.793 129.296 4.224 1.00 0.00 H ATOM 9 HN2 SER A 584 -5.727 128.724 5.522 1.00 0.00 H ATOM 10 HN1 SER A 584 -6.488 129.383 4.154 1.00 0.00 H ATOM 11 N ARG A 585 -3.794 126.019 3.451 1.00 88.10 N ATOM 12 CA ARG A 585 -2.564 125.220 3.692 1.00 75.00 C ATOM 13 C ARG A 585 -1.674 125.856 4.769 1.00 69.99 C ATOM 14 O ARG A 585 -1.145 125.100 5.609 1.00 69.40 O ATOM 15 CB ARG A 585 -1.852 125.114 2.346 1.00 71.79 C ATOM 16 CG ARG A 585 -0.588 124.278 2.336 1.00 67.78 C ATOM 17 CD ARG A 585 -0.169 124.151 0.887 1.00 65.44 C ATOM 18 NE ARG A 585 1.264 124.002 0.802 1.00 66.19 N ATOM 19 CZ ARG A 585 1.926 123.860 -0.334 1.00 67.86 C ATOM 20 NH1 ARG A 585 1.257 123.861 -1.475 1.00 68.78 N ATOM 21 NH2 ARG A 585 3.247 123.723 -0.327 1.00 68.48 N ATOM 22 HE ARG A 585 1.809 124.007 1.688 1.00 0.00 H ATOM 23 HH12 ARG A 585 1.765 123.750 -2.376 1.00 0.00 H ATOM 24 HH11 ARG A 585 0.223 123.973 -1.471 1.00 0.00 H ATOM 25 HH22 ARG A 585 3.763 123.612 -1.223 1.00 0.00 H ATOM 26 HH21 ARG A 585 3.765 123.727 0.575 1.00 0.00 H ATOM 27 H ARG A 585 -4.123 126.085 2.467 1.00 0.00 H ATOM 28 N TYR A 586 -1.482 127.180 4.732 1.00 68.68 N ATOM 29 CA TYR A 586 -0.574 127.931 5.641 1.00 68.20 C ATOM 30 C TYR A 586 -1.085 127.875 7.082 1.00 74.29 C ATOM 31 O TYR A 586 -0.259 127.699 7.991 1.00 79.09 O ATOM 32 CB TYR A 586 -0.442 129.388 5.199 1.00 66.42 C ATOM 33 CG TYR A 586 0.323 130.312 6.118 1.00 62.51 C ATOM 34 CD1 TYR A 586 1.699 130.406 6.046 1.00 58.74 C ATOM 35 CD2 TYR A 586 -0.333 131.140 7.019 1.00 62.67 C ATOM 36 CE1 TYR A 586 2.404 131.287 6.847 1.00 58.53 C ATOM 37 CE2 TYR A 586 0.358 132.018 7.838 1.00 61.38 C ATOM 38 CZ TYR A 586 1.733 132.103 7.738 1.00 59.34 C ATOM 39 OH TYR A 586 2.449 132.973 8.508 1.00 61.39 O ATOM 40 HH TYR A 586 2.150 133.898 8.323 1.00 0.00 H ATOM 41 H TYR A 586 -2.005 127.723 4.016 1.00 0.00 H ATOM 42 N PHE A 587 -2.388 128.060 7.294 1.00 82.99 N ATOM 43 CA PHE A 587 -2.992 128.091 8.653 1.00 88.06 C ATOM 44 C PHE A 587 -3.099 126.653 9.175 1.00 86.45 C ATOM 45 O PHE A 587 -2.903 126.482 10.389 1.00 87.50 O ATOM 46 CB PHE A 587 -4.281 128.921 8.653 1.00 92.77 C ATOM 47 CG PHE A 587 -4.004 130.398 8.510 1.00102.31 C ATOM 48 CD1 PHE A 587 -3.445 131.118 9.561 1.00106.90 C ATOM 49 CD2 PHE A 587 -4.237 131.066 7.312 1.00105.36 C ATOM 50 CE1 PHE A 587 -3.151 132.470 9.427 1.00108.01 C ATOM 51 CE2 PHE A 587 -3.946 132.419 7.183 1.00107.40 C ATOM 52 CZ PHE A 587 -3.402 133.120 8.239 1.00106.38 C ATOM 53 H PHE A 587 -3.011 128.189 6.471 1.00 0.00 H ATOM 54 N ILE A 588 -3.310 125.667 8.289 1.00 82.90 N ATOM 55 CA ILE A 588 -3.397 124.215 8.647 1.00 82.31 C ATOM 56 C ILE A 588 -1.993 123.674 8.957 1.00 79.16 C ATOM 57 O ILE A 588 -1.787 123.124 10.057 1.00 76.68 O ATOM 58 CB ILE A 588 -4.078 123.390 7.531 1.00 83.51 C ATOM 59 CG1 ILE A 588 -5.595 123.599 7.524 1.00 89.64 C ATOM 60 CG2 ILE A 588 -3.712 121.909 7.622 1.00 78.41 C ATOM 61 CD1 ILE A 588 -6.293 123.041 6.298 1.00 92.99 C ATOM 62 H ILE A 588 -3.420 125.928 7.288 1.00 0.00 H ATOM 63 N GLU A 589 -1.067 123.796 8.012 1.00 74.86 N ATOM 64 CA GLU A 589 0.195 123.022 8.033 1.00 69.95 C ATOM 65 C GLU A 589 1.263 123.737 8.856 1.00 64.42 C ATOM 66 O GLU A 589 2.204 123.054 9.238 1.00 65.34 O ATOM 67 CB GLU A 589 0.646 122.753 6.600 1.00 70.45 C ATOM 68 CG GLU A 589 -0.248 121.756 5.891 1.00 69.93 C ATOM 69 CD GLU A 589 0.388 121.144 4.651 1.00 70.55 C ATOM 70 OE1 GLU A 589 1.503 121.628 4.217 1.00 63.84 O ATOM 71 OE2 GLU A 589 -0.229 120.196 4.110 1.00 67.32 O ATOM 72 H GLU A 589 -1.235 124.459 7.229 1.00 0.00 H ATOM 73 N PHE A 590 1.138 125.035 9.124 1.00 64.35 N ATOM 74 CA PHE A 590 2.170 125.815 9.862 1.00 65.39 C ATOM 75 C PHE A 590 1.582 126.488 11.106 1.00 67.98 C ATOM 76 O PHE A 590 0.351 126.691 11.187 1.00 74.88 O ATOM 77 CB PHE A 590 2.822 126.876 8.976 1.00 62.45 C ATOM 78 CG PHE A 590 3.544 126.336 7.769 1.00 58.81 C ATOM 79 CD1 PHE A 590 2.848 125.961 6.629 1.00 60.81 C ATOM 80 CD2 PHE A 590 4.923 126.250 7.756 1.00 55.38 C ATOM 81 CE1 PHE A 590 3.514 125.492 5.510 1.00 56.63 C ATOM 82 CE2 PHE A 590 5.592 125.769 6.642 1.00 55.22 C ATOM 83 CZ PHE A 590 4.887 125.393 5.523 1.00 58.12 C ATOM 84 H PHE A 590 0.280 125.527 8.803 1.00 0.00 H ATOM 85 N GLU A 591 2.466 126.816 12.049 1.00 67.96 N ATOM 86 CA GLU A 591 2.186 127.695 13.212 1.00 72.89 C ATOM 87 C GLU A 591 3.096 128.913 13.063 1.00 70.92 C ATOM 88 O GLU A 591 4.334 128.698 12.963 1.00 68.88 O ATOM 89 CB GLU A 591 2.427 126.967 14.541 1.00 78.73 C ATOM 90 CG GLU A 591 1.155 126.647 15.325 1.00 88.71 C ATOM 91 CD GLU A 591 1.221 126.898 16.830 1.00 96.55 C ATOM 92 OE1 GLU A 591 2.020 127.768 17.277 1.00 94.38 O ATOM 93 OE2 GLU A 591 0.465 126.225 17.562 1.00102.67 O ATOM 94 H GLU A 591 3.426 126.426 11.963 1.00 0.00 H ATOM 95 N GLU A 592 2.492 130.109 12.999 1.00 68.90 N ATOM 96 CA GLU A 592 3.166 131.431 12.916 1.00 68.06 C ATOM 97 C GLU A 592 3.951 131.620 14.210 1.00 64.35 C ATOM 98 O GLU A 592 3.495 131.130 15.226 1.00 64.38 O ATOM 99 CB GLU A 592 2.136 132.559 12.750 1.00 74.18 C ATOM 100 CG GLU A 592 1.894 132.999 11.317 1.00 76.38 C ATOM 101 CD GLU A 592 1.146 134.322 11.183 1.00 81.01 C ATOM 102 OE1 GLU A 592 0.482 134.733 12.158 1.00 82.76 O ATOM 103 OE2 GLU A 592 1.216 134.940 10.100 1.00 78.84 O ATOM 104 H GLU A 592 1.452 130.111 13.008 1.00 0.00 H ATOM 105 N LEU A 593 5.129 132.230 14.167 1.00 64.88 N ATOM 106 CA LEU A 593 5.977 132.369 15.377 1.00 66.24 C ATOM 107 C LEU A 593 6.282 133.843 15.617 1.00 65.92 C ATOM 108 O LEU A 593 5.988 134.357 16.698 1.00 74.67 O ATOM 109 CB LEU A 593 7.258 131.548 15.194 1.00 66.35 C ATOM 110 CG LEU A 593 7.081 130.034 15.325 1.00 67.22 C ATOM 111 CD1 LEU A 593 8.358 129.295 14.930 1.00 64.87 C ATOM 112 CD2 LEU A 593 6.648 129.655 16.737 1.00 67.61 C ATOM 113 H LEU A 593 5.466 132.620 13.264 1.00 0.00 H ATOM 114 N GLN A 594 6.889 134.484 14.643 1.00 66.03 N ATOM 115 CA GLN A 594 7.424 135.852 14.789 1.00 73.39 C ATOM 116 C GLN A 594 7.256 136.553 13.432 1.00 72.79 C ATOM 117 O GLN A 594 7.564 135.915 12.394 1.00 70.85 O ATOM 118 CB GLN A 594 8.869 135.719 15.280 1.00 76.39 C ATOM 119 CG GLN A 594 9.422 136.997 15.881 1.00 87.35 C ATOM 120 CD GLN A 594 10.902 136.938 16.177 1.00 91.68 C ATOM 121 OE1 GLN A 594 11.700 136.352 15.431 1.00 81.21 O ATOM 122 NE2 GLN A 594 11.278 137.592 17.270 1.00 92.87 N ATOM 123 HE22 GLN A 594 10.567 138.067 17.862 1.00 0.00 H ATOM 124 HE21 GLN A 594 12.283 137.629 17.534 1.00 0.00 H ATOM 125 H GLN A 594 6.997 134.005 13.726 1.00 0.00 H ATOM 126 N LEU A 595 6.743 137.784 13.409 1.00 67.63 N ATOM 127 CA LEU A 595 6.863 138.637 12.200 1.00 66.06 C ATOM 128 C LEU A 595 8.337 139.034 12.073 1.00 62.61 C ATOM 129 O LEU A 595 8.897 139.519 13.072 1.00 63.83 O ATOM 130 CB LEU A 595 5.976 139.879 12.297 1.00 69.12 C ATOM 131 CG LEU A 595 5.884 140.695 11.006 1.00 67.64 C ATOM 132 CD1 LEU A 595 5.210 139.883 9.908 1.00 66.61 C ATOM 133 CD2 LEU A 595 5.174 142.014 11.235 1.00 74.12 C ATOM 134 H LEU A 595 6.252 138.151 14.249 1.00 0.00 H ATOM 135 N LEU A 596 8.946 138.789 10.909 1.00 59.29 N ATOM 136 CA LEU A 596 10.368 139.114 10.644 1.00 59.08 C ATOM 137 C LEU A 596 10.466 140.438 9.877 1.00 61.88 C ATOM 138 O LEU A 596 11.489 141.106 10.055 1.00 64.51 O ATOM 139 CB LEU A 596 11.033 137.969 9.869 1.00 58.84 C ATOM 140 CG LEU A 596 11.260 136.664 10.634 1.00 58.00 C ATOM 141 CD1 LEU A 596 12.102 135.713 9.804 1.00 55.75 C ATOM 142 CD2 LEU A 596 11.910 136.892 11.996 1.00 57.97 C ATOM 143 H LEU A 596 8.392 138.346 10.148 1.00 0.00 H ATOM 144 N GLY A 597 9.460 140.805 9.071 1.00 63.74 N ATOM 145 CA GLY A 597 9.492 142.015 8.222 1.00 64.12 C ATOM 146 C GLY A 597 8.140 142.314 7.599 1.00 67.52 C ATOM 147 O GLY A 597 7.337 141.381 7.435 1.00 65.82 O ATOM 148 H GLY A 597 8.610 140.206 9.041 1.00 0.00 H ATOM 149 N LYS A 598 7.898 143.577 7.257 1.00 74.16 N ATOM 150 CA LYS A 598 6.568 144.098 6.842 1.00 81.13 C ATOM 151 C LYS A 598 6.789 145.250 5.854 1.00 80.17 C ATOM 152 O LYS A 598 7.621 146.124 6.169 1.00 78.56 O ATOM 153 CB LYS A 598 5.815 144.546 8.100 1.00 91.43 C ATOM 154 CG LYS A 598 4.321 144.797 7.943 1.00102.55 C ATOM 155 CD LYS A 598 3.464 143.551 7.846 1.00103.57 C ATOM 156 CE LYS A 598 2.019 143.819 8.219 1.00110.60 C ATOM 157 NZ LYS A 598 1.132 142.749 7.712 1.00112.86 N ATOM 158 HZ1 LYS A 598 1.206 142.701 6.676 1.00 0.00 H ATOM 159 HZ2 LYS A 598 1.419 141.838 8.124 1.00 0.00 H ATOM 160 HZ3 LYS A 598 0.150 142.958 7.982 1.00 0.00 H ATOM 161 H LYS A 598 8.694 144.246 7.282 1.00 0.00 H ATOM 162 N GLY A 599 6.090 145.260 4.711 1.00 81.39 N ATOM 163 CA GLY A 599 6.275 146.297 3.672 1.00 85.74 C ATOM 164 C GLY A 599 5.266 146.215 2.539 1.00 91.50 C ATOM 165 O GLY A 599 4.193 145.603 2.737 1.00 98.46 O ATOM 166 H GLY A 599 5.389 144.509 4.548 1.00 0.00 H ATOM 167 N ALA A 600 5.585 146.848 1.403 1.00 96.41 N ATOM 168 CA ALA A 600 4.826 146.775 0.128 1.00 97.53 C ATOM 169 C ALA A 600 4.948 145.360 -0.451 1.00 97.89 C ATOM 170 O ALA A 600 3.923 144.828 -0.932 1.00 92.96 O ATOM 171 CB ALA A 600 5.341 147.806 -0.845 1.00 96.14 C ATOM 172 H ALA A 600 6.438 147.442 1.414 1.00 0.00 H ATOM 173 N PHE A 601 6.154 144.777 -0.370 1.00 97.34 N ATOM 174 CA PHE A 601 6.482 143.377 -0.769 1.00 97.85 C ATOM 175 C PHE A 601 5.548 142.375 -0.061 1.00 98.57 C ATOM 176 O PHE A 601 5.484 141.226 -0.536 1.00106.31 O ATOM 177 CB PHE A 601 7.968 143.049 -0.532 1.00 92.20 C ATOM 178 CG PHE A 601 8.437 143.097 0.903 1.00 91.73 C ATOM 179 CD1 PHE A 601 8.135 142.071 1.793 1.00 83.92 C ATOM 180 CD2 PHE A 601 9.212 144.157 1.360 1.00 94.61 C ATOM 181 CE1 PHE A 601 8.552 142.127 3.115 1.00 80.98 C ATOM 182 CE2 PHE A 601 9.637 144.208 2.682 1.00 92.80 C ATOM 183 CZ PHE A 601 9.297 143.198 3.561 1.00 88.14 C ATOM 184 H PHE A 601 6.933 145.355 0.006 1.00 0.00 H ATOM 185 N GLY A 602 4.863 142.780 1.019 1.00 95.75 N ATOM 186 CA GLY A 602 3.964 141.929 1.832 1.00 93.60 C ATOM 187 C GLY A 602 4.498 141.723 3.247 1.00 85.61 C ATOM 188 O GLY A 602 4.632 142.730 3.980 1.00 85.43 O ATOM 189 H GLY A 602 4.972 143.773 1.309 1.00 0.00 H ATOM 190 N ALA A 603 4.809 140.478 3.625 1.00 74.89 N ATOM 191 CA ALA A 603 5.431 140.141 4.926 1.00 70.74 C ATOM 192 C ALA A 603 6.317 138.887 4.820 1.00 66.48 C ATOM 193 O ALA A 603 6.039 138.014 3.986 1.00 72.61 O ATOM 194 CB ALA A 603 4.355 139.960 5.957 1.00 70.33 C ATOM 195 H ALA A 603 4.602 139.701 2.966 1.00 0.00 H ATOM 196 N VAL A 604 7.366 138.831 5.639 1.00 60.96 N ATOM 197 CA VAL A 604 8.173 137.614 5.947 1.00 56.58 C ATOM 198 C VAL A 604 7.861 137.219 7.393 1.00 60.94 C ATOM 199 O VAL A 604 8.014 138.099 8.279 1.00 61.77 O ATOM 200 CB VAL A 604 9.675 137.871 5.746 1.00 50.23 C ATOM 201 CG1 VAL A 604 10.516 136.672 6.121 1.00 44.50 C ATOM 202 CG2 VAL A 604 9.976 138.328 4.325 1.00 48.25 C ATOM 203 H VAL A 604 7.648 139.716 6.106 1.00 0.00 H ATOM 204 N ILE A 605 7.419 135.968 7.603 1.00 62.22 N ATOM 205 CA ILE A 605 7.036 135.381 8.927 1.00 62.04 C ATOM 206 C ILE A 605 7.904 134.140 9.202 1.00 59.80 C ATOM 207 O ILE A 605 7.977 133.245 8.344 1.00 54.08 O ATOM 208 CB ILE A 605 5.539 135.012 8.952 1.00 65.66 C ATOM 209 CG1 ILE A 605 4.649 136.146 8.438 1.00 69.41 C ATOM 210 CG2 ILE A 605 5.102 134.541 10.332 1.00 70.34 C ATOM 211 CD1 ILE A 605 3.990 135.822 7.117 1.00 70.30 C ATOM 212 H ILE A 605 7.335 135.351 6.770 1.00 0.00 H ATOM 213 N LYS A 606 8.560 134.087 10.359 1.00 62.00 N ATOM 214 CA LYS A 606 9.136 132.827 10.897 1.00 59.86 C ATOM 215 C LYS A 606 7.951 131.922 11.259 1.00 62.74 C ATOM 216 O LYS A 606 7.025 132.373 11.986 1.00 66.48 O ATOM 217 CB LYS A 606 10.069 133.076 12.089 1.00 60.41 C ATOM 218 CG LYS A 606 10.619 131.819 12.763 1.00 57.80 C ATOM 219 CD LYS A 606 11.413 132.094 14.006 1.00 57.17 C ATOM 220 CE LYS A 606 11.995 130.841 14.614 1.00 57.80 C ATOM 221 NZ LYS A 606 12.658 131.107 15.914 1.00 58.85 N ATOM 222 HZ1 LYS A 606 13.431 131.789 15.775 1.00 0.00 H ATOM 223 HZ2 LYS A 606 11.964 131.499 16.582 1.00 0.00 H ATOM 224 HZ3 LYS A 606 13.042 130.218 16.294 1.00 0.00 H ATOM 225 H LYS A 606 8.674 134.963 10.909 1.00 0.00 H ATOM 226 N VAL A 607 7.960 130.706 10.724 1.00 59.27 N ATOM 227 CA VAL A 607 6.862 129.726 10.912 1.00 54.46 C ATOM 228 C VAL A 607 7.517 128.417 11.362 1.00 52.98 C ATOM 229 O VAL A 607 8.757 128.370 11.429 1.00 48.12 O ATOM 230 CB VAL A 607 6.018 129.583 9.626 1.00 52.68 C ATOM 231 CG1 VAL A 607 5.363 130.901 9.220 1.00 51.26 C ATOM 232 CG2 VAL A 607 6.816 129.000 8.460 1.00 50.94 C ATOM 233 H VAL A 607 8.777 130.427 10.145 1.00 0.00 H ATOM 234 N GLN A 608 6.697 127.443 11.752 1.00 54.34 N ATOM 235 CA GLN A 608 7.109 126.058 12.056 1.00 52.44 C ATOM 236 C GLN A 608 6.151 125.148 11.287 1.00 50.45 C ATOM 237 O GLN A 608 4.933 125.318 11.464 1.00 50.12 O ATOM 238 CB GLN A 608 7.083 125.811 13.568 1.00 54.90 C ATOM 239 CG GLN A 608 7.582 124.421 13.978 1.00 56.56 C ATOM 240 CD GLN A 608 7.392 124.091 15.443 1.00 62.47 C ATOM 241 OE1 GLN A 608 8.217 124.446 16.275 1.00 67.11 O ATOM 242 NE2 GLN A 608 6.331 123.362 15.781 1.00 63.99 N ATOM 243 HE22 GLN A 608 5.645 123.074 15.054 1.00 0.00 H ATOM 244 HE21 GLN A 608 6.188 123.081 16.772 1.00 0.00 H ATOM 245 H GLN A 608 5.688 127.676 11.850 1.00 0.00 H ATOM 246 N ASN A 609 6.686 124.259 10.449 1.00 48.04 N ATOM 247 CA ASN A 609 5.875 123.227 9.759 1.00 50.90 C ATOM 248 C ASN A 609 5.440 122.224 10.820 1.00 51.12 C ATOM 249 O ASN A 609 6.311 121.743 11.557 1.00 49.92 O ATOM 250 CB ASN A 609 6.625 122.541 8.613 1.00 53.91 C ATOM 251 CG ASN A 609 5.757 121.512 7.915 1.00 57.16 C ATOM 252 OD1 ASN A 609 5.848 120.322 8.202 1.00 58.22 O ATOM 253 ND2 ASN A 609 4.869 121.964 7.043 1.00 56.87 N ATOM 254 HD22 ASN A 609 4.823 122.980 6.827 1.00 0.00 H ATOM 255 HD21 ASN A 609 4.217 121.303 6.574 1.00 0.00 H ATOM 256 H ASN A 609 7.710 124.291 10.273 1.00 0.00 H ATOM 257 N LYS A 610 4.142 121.959 10.932 1.00 52.82 N ATOM 258 CA LYS A 610 3.606 121.139 12.043 1.00 56.07 C ATOM 259 C LYS A 610 4.098 119.706 11.866 1.00 54.82 C ATOM 260 O LYS A 610 4.447 119.097 12.877 1.00 61.63 O ATOM 261 CB LYS A 610 2.085 121.247 12.115 1.00 59.63 C ATOM 262 CG LYS A 610 1.552 122.616 12.530 1.00 64.24 C ATOM 263 CD LYS A 610 0.044 122.587 12.760 1.00 71.46 C ATOM 264 CE LYS A 610 -0.615 123.940 12.924 1.00 73.03 C ATOM 265 NZ LYS A 610 -2.035 123.752 13.308 1.00 77.41 N ATOM 266 HZ1 LYS A 610 -2.525 123.214 12.565 1.00 0.00 H ATOM 267 HZ2 LYS A 610 -2.084 123.230 14.206 1.00 0.00 H ATOM 268 HZ3 LYS A 610 -2.488 124.681 13.421 1.00 0.00 H ATOM 269 H LYS A 610 3.485 122.338 10.220 1.00 0.00 H ATOM 270 N LEU A 611 4.187 119.209 10.635 1.00 53.57 N ATOM 271 CA LEU A 611 4.561 117.789 10.368 1.00 54.19 C ATOM 272 C LEU A 611 6.084 117.566 10.549 1.00 53.80 C ATOM 273 O LEU A 611 6.476 116.737 11.401 1.00 56.18 O ATOM 274 CB LEU A 611 4.062 117.424 8.967 1.00 50.76 C ATOM 275 CG LEU A 611 4.438 116.040 8.453 1.00 50.18 C ATOM 276 CD1 LEU A 611 3.875 114.935 9.327 1.00 49.97 C ATOM 277 CD2 LEU A 611 3.955 115.890 7.017 1.00 51.67 C ATOM 278 H LEU A 611 3.988 119.834 9.828 1.00 0.00 H ATOM 279 N ASP A 612 6.937 118.272 9.809 1.00 51.41 N ATOM 280 CA ASP A 612 8.398 118.016 9.847 1.00 50.71 C ATOM 281 C ASP A 612 8.992 118.707 11.080 1.00 48.72 C ATOM 282 O ASP A 612 10.168 118.423 11.406 1.00 56.06 O ATOM 283 CB ASP A 612 9.068 118.386 8.515 1.00 50.71 C ATOM 284 CG ASP A 612 9.264 119.865 8.259 1.00 51.55 C ATOM 285 OD1 ASP A 612 9.257 120.619 9.240 1.00 58.43 O ATOM 286 OD2 ASP A 612 9.438 120.248 7.076 1.00 55.15 O ATOM 287 H ASP A 612 6.570 119.022 9.189 1.00 0.00 H ATOM 288 N GLY A 613 8.237 119.593 11.729 1.00 44.44 N ATOM 289 CA GLY A 613 8.657 120.225 12.990 1.00 45.21 C ATOM 290 C GLY A 613 9.841 121.167 12.845 1.00 43.86 C ATOM 291 O GLY A 613 10.448 121.508 13.871 1.00 45.28 O ATOM 292 H GLY A 613 7.312 119.848 11.328 1.00 0.00 H ATOM 293 N CYS A 614 10.161 121.627 11.637 1.00 42.71 N ATOM 294 CA CYS A 614 11.285 122.567 11.408 1.00 42.42 C ATOM 295 C CYS A 614 10.752 124.007 11.367 1.00 45.04 C ATOM 296 O CYS A 614 9.537 124.209 11.198 1.00 43.43 O ATOM 297 CB CYS A 614 12.021 122.236 10.119 1.00 43.43 C ATOM 298 SG CYS A 614 12.986 120.703 10.178 1.00 48.64 S ATOM 299 H CYS A 614 9.599 121.314 10.820 1.00 0.00 H ATOM 300 N CYS A 615 11.650 124.978 11.530 1.00 47.88 N ATOM 301 CA CYS A 615 11.390 126.418 11.291 1.00 51.01 C ATOM 302 C CYS A 615 11.789 126.792 9.853 1.00 51.24 C ATOM 303 O CYS A 615 12.778 126.240 9.286 1.00 54.03 O ATOM 304 CB CYS A 615 12.118 127.300 12.302 1.00 52.98 C ATOM 305 SG CYS A 615 11.437 127.150 13.980 1.00 59.37 S ATOM 306 H CYS A 615 12.602 124.706 11.848 1.00 0.00 H ATOM 307 N TYR A 616 11.037 127.728 9.290 1.00 50.18 N ATOM 308 CA TYR A 616 11.212 128.257 7.919 1.00 50.00 C ATOM 309 C TYR A 616 10.977 129.767 7.964 1.00 50.04 C ATOM 310 O TYR A 616 10.388 130.278 8.976 1.00 45.17 O ATOM 311 CB TYR A 616 10.258 127.530 6.971 1.00 45.60 C ATOM 312 CG TYR A 616 10.529 126.052 6.882 1.00 47.39 C ATOM 313 CD1 TYR A 616 11.641 125.574 6.211 1.00 46.96 C ATOM 314 CD2 TYR A 616 9.692 125.127 7.485 1.00 48.29 C ATOM 315 CE1 TYR A 616 11.910 124.221 6.128 1.00 46.88 C ATOM 316 CE2 TYR A 616 9.936 123.767 7.394 1.00 48.60 C ATOM 317 CZ TYR A 616 11.056 123.307 6.722 1.00 49.51 C ATOM 318 OH TYR A 616 11.297 121.962 6.617 1.00 50.31 O ATOM 319 HH TYR A 616 12.134 121.817 6.109 1.00 0.00 H ATOM 320 H TYR A 616 10.261 128.123 9.859 1.00 0.00 H ATOM 321 N ALA A 617 11.446 130.450 6.919 1.00 45.70 N ATOM 322 CA ALA A 617 11.143 131.870 6.666 1.00 47.94 C ATOM 323 C ALA A 617 10.251 131.911 5.422 1.00 45.95 C ATOM 324 O ALA A 617 10.696 131.507 4.339 1.00 45.31 O ATOM 325 CB ALA A 617 12.417 132.676 6.544 1.00 44.88 C ATOM 326 H ALA A 617 12.061 129.952 6.244 1.00 0.00 H ATOM 327 N VAL A 618 9.006 132.328 5.613 1.00 47.95 N ATOM 328 CA VAL A 618 7.947 132.323 4.569 1.00 50.16 C ATOM 329 C VAL A 618 7.608 133.779 4.211 1.00 51.24 C ATOM 330 O VAL A 618 7.248 134.567 5.110 1.00 47.94 O ATOM 331 CB VAL A 618 6.728 131.519 5.062 1.00 51.03 C ATOM 332 CG1 VAL A 618 5.469 131.776 4.249 1.00 51.06 C ATOM 333 CG2 VAL A 618 7.049 130.035 5.099 1.00 50.52 C ATOM 334 H VAL A 618 8.753 132.683 6.557 1.00 0.00 H ATOM 335 N LYS A 619 7.772 134.117 2.933 1.00 50.45 N ATOM 336 CA LYS A 619 7.397 135.420 2.336 1.00 49.69 C ATOM 337 C LYS A 619 5.969 135.278 1.849 1.00 52.36 C ATOM 338 O LYS A 619 5.724 134.317 1.087 1.00 51.82 O ATOM 339 CB LYS A 619 8.333 135.741 1.175 1.00 51.54 C ATOM 340 CG LYS A 619 8.337 137.175 0.671 1.00 56.91 C ATOM 341 CD LYS A 619 9.560 137.430 -0.182 1.00 58.55 C ATOM 342 CE LYS A 619 9.591 138.810 -0.791 1.00 66.91 C ATOM 343 NZ LYS A 619 10.847 138.994 -1.553 1.00 68.46 N ATOM 344 HZ1 LYS A 619 11.659 138.882 -0.913 1.00 0.00 H ATOM 345 HZ2 LYS A 619 10.899 138.282 -2.310 1.00 0.00 H ATOM 346 HZ3 LYS A 619 10.862 139.947 -1.970 1.00 0.00 H ATOM 347 H LYS A 619 8.198 133.408 2.303 1.00 0.00 H ATOM 348 N ARG A 620 5.075 136.137 2.354 1.00 57.08 N ATOM 349 CA ARG A 620 3.642 136.220 1.972 1.00 59.44 C ATOM 350 C ARG A 620 3.476 137.482 1.124 1.00 60.57 C ATOM 351 O ARG A 620 3.721 138.588 1.659 1.00 62.53 O ATOM 352 CB ARG A 620 2.767 136.229 3.235 1.00 63.81 C ATOM 353 CG ARG A 620 1.265 136.213 2.986 1.00 69.35 C ATOM 354 CD ARG A 620 0.519 137.379 3.637 1.00 75.23 C ATOM 355 NE ARG A 620 0.470 137.445 5.098 1.00 78.53 N ATOM 356 CZ ARG A 620 -0.185 136.592 5.897 1.00 82.22 C ATOM 357 NH1 ARG A 620 -0.815 135.536 5.400 1.00 80.61 N ATOM 358 NH2 ARG A 620 -0.194 136.791 7.206 1.00 81.97 N ATOM 359 HE ARG A 620 0.989 138.221 5.556 1.00 0.00 H ATOM 360 HH12 ARG A 620 -1.318 134.884 6.035 1.00 0.00 H ATOM 361 HH11 ARG A 620 -0.806 135.360 4.375 1.00 0.00 H ATOM 362 HH22 ARG A 620 -0.702 136.131 7.829 1.00 0.00 H ATOM 363 HH21 ARG A 620 0.306 137.608 7.611 1.00 0.00 H ATOM 364 H ARG A 620 5.413 136.804 3.077 1.00 0.00 H ATOM 365 N ILE A 621 3.097 137.312 -0.149 1.00 63.94 N ATOM 366 CA ILE A 621 2.919 138.415 -1.152 1.00 62.85 C ATOM 367 C ILE A 621 1.483 138.391 -1.676 1.00 59.91 C ATOM 368 O ILE A 621 0.999 137.356 -2.129 1.00 56.15 O ATOM 369 CB ILE A 621 3.935 138.280 -2.308 1.00 65.20 C ATOM 370 CG1 ILE A 621 5.344 137.907 -1.832 1.00 62.22 C ATOM 371 CG2 ILE A 621 3.946 139.547 -3.142 1.00 68.65 C ATOM 372 CD1 ILE A 621 6.212 137.290 -2.903 1.00 61.24 C ATOM 373 H ILE A 621 2.911 136.340 -0.468 1.00 0.00 H ATOM 374 N PRO A 622 0.747 139.522 -1.632 1.00 61.43 N ATOM 375 CA PRO A 622 -0.566 139.614 -2.263 1.00 64.83 C ATOM 376 C PRO A 622 -0.436 139.634 -3.798 1.00 66.24 C ATOM 377 O PRO A 622 0.504 140.231 -4.310 1.00 63.67 O ATOM 378 CB PRO A 622 -1.161 140.932 -1.739 1.00 66.58 C ATOM 379 CG PRO A 622 -0.199 141.416 -0.678 1.00 64.94 C ATOM 380 CD PRO A 622 1.135 140.790 -1.005 1.00 62.10 C ATOM 381 N ILE A 623 -1.391 139.004 -4.495 1.00 68.70 N ATOM 382 CA ILE A 623 -1.255 138.578 -5.918 1.00 71.21 C ATOM 383 C ILE A 623 -2.642 138.489 -6.564 1.00 71.78 C ATOM 384 O ILE A 623 -3.609 138.138 -5.871 1.00 72.86 O ATOM 385 CB ILE A 623 -0.469 137.240 -6.008 1.00 72.97 C ATOM 386 CG1 ILE A 623 0.385 137.164 -7.281 1.00 75.19 C ATOM 387 CG2 ILE A 623 -1.385 136.015 -5.872 1.00 71.55 C ATOM 388 CD1 ILE A 623 1.120 135.855 -7.472 1.00 73.27 C ATOM 389 H ILE A 623 -2.288 138.798 -4.011 1.00 0.00 H ATOM 390 N ASN A 624 -2.708 138.762 -7.865 1.00 72.42 N ATOM 391 CA ASN A 624 -3.851 138.386 -8.732 1.00 75.79 C ATOM 392 C ASN A 624 -3.383 137.278 -9.663 1.00 75.00 C ATOM 393 O ASN A 624 -2.379 137.414 -10.350 1.00 72.18 O ATOM 394 CB ASN A 624 -4.388 139.569 -9.535 1.00 79.22 C ATOM 395 CG ASN A 624 -4.933 140.667 -8.653 1.00 80.19 C ATOM 396 OD1 ASN A 624 -6.078 140.595 -8.216 1.00 82.57 O ATOM 397 ND2 ASN A 624 -4.121 141.681 -8.400 1.00 77.36 N ATOM 398 HD22 ASN A 624 -3.160 141.689 -8.797 1.00 0.00 H ATOM 399 HD21 ASN A 624 -4.444 142.470 -7.804 1.00 0.00 H ATOM 400 H ASN A 624 -1.911 139.269 -8.299 1.00 0.00 H ATOM 401 N PRO A 625 -4.061 136.117 -9.666 1.00 81.90 N ATOM 402 CA PRO A 625 -3.951 135.161 -10.765 1.00 82.90 C ATOM 403 C PRO A 625 -3.854 135.755 -12.177 1.00 80.29 C ATOM 404 O PRO A 625 -4.364 136.823 -12.402 1.00 82.39 O ATOM 405 CB PRO A 625 -5.290 134.419 -10.605 1.00 86.31 C ATOM 406 CG PRO A 625 -5.419 134.281 -9.101 1.00 83.95 C ATOM 407 CD PRO A 625 -4.916 135.612 -8.576 1.00 84.47 C ATOM 408 N ALA A 626 -3.203 135.006 -13.068 1.00 78.68 N ATOM 409 CA ALA A 626 -3.185 135.149 -14.544 1.00 81.37 C ATOM 410 C ALA A 626 -2.943 136.603 -14.989 1.00 81.83 C ATOM 411 O ALA A 626 -3.386 136.938 -16.120 1.00 79.24 O ATOM 412 CB ALA A 626 -4.478 134.591 -15.109 1.00 84.38 C ATOM 413 H ALA A 626 -2.638 134.224 -12.679 1.00 0.00 H ATOM 414 N SER A 627 -2.215 137.393 -14.175 1.00 78.98 N ATOM 415 CA SER A 627 -1.940 138.842 -14.373 1.00 78.91 C ATOM 416 C SER A 627 -0.497 139.056 -14.837 1.00 74.81 C ATOM 417 O SER A 627 0.310 138.133 -14.641 1.00 71.08 O ATOM 418 CB SER A 627 -2.209 139.617 -13.104 1.00 78.80 C ATOM 419 OG SER A 627 -1.483 139.073 -12.009 1.00 74.13 O ATOM 420 HG SER A 627 -1.755 138.131 -11.870 1.00 0.00 H ATOM 421 H SER A 627 -1.807 136.948 -13.328 1.00 0.00 H ATOM 422 N ARG A 628 -0.185 140.245 -15.364 1.00 79.94 N ATOM 423 CA ARG A 628 1.207 140.672 -15.686 1.00 83.39 C ATOM 424 C ARG A 628 2.046 140.668 -14.395 1.00 81.24 C ATOM 425 O ARG A 628 3.141 140.069 -14.407 1.00 77.59 O ATOM 426 CB ARG A 628 1.247 142.038 -16.393 1.00 87.72 C ATOM 427 CG ARG A 628 2.656 142.594 -16.589 1.00 88.63 C ATOM 428 CD ARG A 628 3.674 141.616 -17.211 1.00 91.45 C ATOM 429 NE ARG A 628 4.945 141.409 -16.485 1.00 89.72 N ATOM 430 CZ ARG A 628 5.884 140.500 -16.784 1.00 86.06 C ATOM 431 NH1 ARG A 628 5.732 139.686 -17.815 1.00 84.85 N ATOM 432 NH2 ARG A 628 6.982 140.411 -16.047 1.00 86.06 N ATOM 433 HE ARG A 628 5.128 142.025 -15.667 1.00 0.00 H ATOM 434 HH12 ARG A 628 6.467 138.985 -18.037 1.00 0.00 H ATOM 435 HH11 ARG A 628 4.877 139.747 -18.404 1.00 0.00 H ATOM 436 HH22 ARG A 628 7.709 139.705 -16.281 1.00 0.00 H ATOM 437 HH21 ARG A 628 7.116 141.047 -15.235 1.00 0.00 H ATOM 438 H ARG A 628 -0.959 140.911 -15.561 1.00 0.00 H ATOM 439 N GLN A 629 1.549 141.275 -13.312 1.00 84.30 N ATOM 440 CA GLN A 629 2.278 141.363 -12.012 1.00 86.75 C ATOM 441 C GLN A 629 2.487 139.952 -11.428 1.00 77.25 C ATOM 442 O GLN A 629 3.524 139.745 -10.803 1.00 69.52 O ATOM 443 CB GLN A 629 1.586 142.334 -11.045 1.00 97.09 C ATOM 444 CG GLN A 629 0.231 141.859 -10.522 1.00107.33 C ATOM 445 CD GLN A 629 0.309 140.953 -9.312 1.00108.65 C ATOM 446 OE1 GLN A 629 -0.605 140.176 -9.028 1.00102.79 O ATOM 447 NE2 GLN A 629 1.396 141.063 -8.562 1.00110.41 N ATOM 448 HE22 GLN A 629 2.148 141.729 -8.831 1.00 0.00 H ATOM 449 HE21 GLN A 629 1.497 140.483 -7.704 1.00 0.00 H ATOM 450 H GLN A 629 0.606 141.708 -13.379 1.00 0.00 H ATOM 451 N PHE A 630 1.567 139.011 -11.661 1.00 77.39 N ATOM 452 CA PHE A 630 1.650 137.596 -11.198 1.00 75.85 C ATOM 453 C PHE A 630 2.879 136.909 -11.808 1.00 71.97 C ATOM 454 O PHE A 630 3.688 136.317 -11.064 1.00 66.42 O ATOM 455 CB PHE A 630 0.375 136.827 -11.567 1.00 81.82 C ATOM 456 CG PHE A 630 0.472 135.321 -11.523 1.00 84.15 C ATOM 457 CD1 PHE A 630 1.202 134.672 -10.540 1.00 80.89 C ATOM 458 CD2 PHE A 630 -0.194 134.546 -12.460 1.00 90.03 C ATOM 459 CE1 PHE A 630 1.279 133.288 -10.514 1.00 84.72 C ATOM 460 CE2 PHE A 630 -0.118 133.162 -12.433 1.00 86.75 C ATOM 461 CZ PHE A 630 0.612 132.535 -11.454 1.00 87.32 C ATOM 462 H PHE A 630 0.727 139.287 -12.208 1.00 0.00 H ATOM 463 N ARG A 631 2.979 136.955 -13.137 1.00 70.20 N ATOM 464 CA ARG A 631 4.051 136.302 -13.929 1.00 65.49 C ATOM 465 C ARG A 631 5.385 136.929 -13.518 1.00 63.09 C ATOM 466 O ARG A 631 6.387 136.197 -13.504 1.00 63.91 O ATOM 467 CB ARG A 631 3.772 136.418 -15.436 1.00 67.99 C ATOM 468 CG ARG A 631 2.565 135.621 -15.917 1.00 68.37 C ATOM 469 CD ARG A 631 2.341 135.740 -17.414 1.00 71.21 C ATOM 470 NE ARG A 631 1.251 136.639 -17.780 1.00 74.09 N ATOM 471 CZ ARG A 631 -0.037 136.302 -17.872 1.00 76.31 C ATOM 472 NH1 ARG A 631 -0.421 135.059 -17.618 1.00 77.10 N ATOM 473 NH2 ARG A 631 -0.941 137.215 -18.210 1.00 77.16 N ATOM 474 HE ARG A 631 1.499 137.627 -17.987 1.00 0.00 H ATOM 475 HH12 ARG A 631 -1.426 134.800 -17.691 1.00 0.00 H ATOM 476 HH11 ARG A 631 0.282 134.343 -17.346 1.00 0.00 H ATOM 477 HH22 ARG A 631 -1.945 136.952 -18.281 1.00 0.00 H ATOM 478 HH21 ARG A 631 -0.645 138.193 -18.403 1.00 0.00 H ATOM 479 H ARG A 631 2.252 137.488 -13.657 1.00 0.00 H ATOM 480 N ARG A 632 5.379 138.215 -13.153 1.00 65.85 N ATOM 481 CA ARG A 632 6.569 138.967 -12.669 1.00 68.16 C ATOM 482 C ARG A 632 7.074 138.345 -11.356 1.00 65.35 C ATOM 483 O ARG A 632 8.284 138.033 -11.287 1.00 61.28 O ATOM 484 CB ARG A 632 6.208 140.452 -12.531 1.00 77.57 C ATOM 485 CG ARG A 632 7.236 141.352 -11.852 1.00 85.10 C ATOM 486 CD ARG A 632 6.597 142.404 -10.931 1.00 90.87 C ATOM 487 NE ARG A 632 7.500 143.454 -10.461 1.00 90.92 N ATOM 488 CZ ARG A 632 8.439 143.323 -9.515 1.00 93.58 C ATOM 489 NH1 ARG A 632 8.648 142.167 -8.901 1.00 91.60 N ATOM 490 NH2 ARG A 632 9.184 144.366 -9.188 1.00 95.44 N ATOM 491 HE ARG A 632 7.404 144.391 -10.903 1.00 0.00 H ATOM 492 HH12 ARG A 632 9.384 142.092 -8.170 1.00 0.00 H ATOM 493 HH11 ARG A 632 8.076 141.335 -9.150 1.00 0.00 H ATOM 494 HH22 ARG A 632 9.915 144.273 -8.455 1.00 0.00 H ATOM 495 HH21 ARG A 632 9.038 145.279 -9.664 1.00 0.00 H ATOM 496 H ARG A 632 4.476 138.728 -13.212 1.00 0.00 H ATOM 497 N ILE A 633 6.202 138.154 -10.356 1.00 67.30 N ATOM 498 CA ILE A 633 6.609 137.798 -8.963 1.00 65.03 C ATOM 499 C ILE A 633 6.899 136.293 -8.900 1.00 66.12 C ATOM 500 O ILE A 633 7.860 135.920 -8.193 1.00 71.42 O ATOM 501 CB ILE A 633 5.574 138.263 -7.907 1.00 68.08 C ATOM 502 CG1 ILE A 633 5.262 139.756 -8.018 1.00 72.45 C ATOM 503 CG2 ILE A 633 6.051 137.948 -6.494 1.00 69.68 C ATOM 504 CD1 ILE A 633 4.036 140.197 -7.245 1.00 75.75 C ATOM 505 H ILE A 633 5.188 138.259 -10.561 1.00 0.00 H ATOM 506 N LYS A 634 6.115 135.469 -9.604 1.00 67.56 N ATOM 507 CA LYS A 634 6.371 134.010 -9.799 1.00 66.34 C ATOM 508 C LYS A 634 7.809 133.789 -10.316 1.00 69.63 C ATOM 509 O LYS A 634 8.427 132.755 -9.971 1.00 61.34 O ATOM 510 CB LYS A 634 5.334 133.440 -10.772 1.00 68.38 C ATOM 511 CG LYS A 634 5.720 132.138 -11.455 1.00 69.42 C ATOM 512 CD LYS A 634 4.664 131.607 -12.408 1.00 74.86 C ATOM 513 CE LYS A 634 5.227 130.621 -13.417 1.00 77.83 C ATOM 514 NZ LYS A 634 4.348 129.440 -13.612 1.00 81.75 N ATOM 515 HZ1 LYS A 634 4.234 128.941 -12.707 1.00 0.00 H ATOM 516 HZ2 LYS A 634 3.418 129.754 -13.956 1.00 0.00 H ATOM 517 HZ3 LYS A 634 4.779 128.800 -14.310 1.00 0.00 H ATOM 518 H LYS A 634 5.266 135.873 -10.048 1.00 0.00 H ATOM 519 N GLY A 635 8.313 134.709 -11.147 1.00 68.93 N ATOM 520 CA GLY A 635 9.727 134.785 -11.559 1.00 61.15 C ATOM 521 C GLY A 635 10.678 134.568 -10.397 1.00 52.77 C ATOM 522 O GLY A 635 11.670 133.885 -10.589 1.00 51.37 O ATOM 523 H GLY A 635 7.660 135.422 -11.530 1.00 0.00 H ATOM 524 N GLU A 636 10.401 135.130 -9.219 1.00 55.63 N ATOM 525 CA GLU A 636 11.267 134.966 -8.015 1.00 53.88 C ATOM 526 C GLU A 636 11.327 133.485 -7.621 1.00 47.05 C ATOM 527 O GLU A 636 12.406 133.011 -7.264 1.00 45.90 O ATOM 528 CB GLU A 636 10.752 135.807 -6.843 1.00 62.70 C ATOM 529 CG GLU A 636 11.745 135.907 -5.678 1.00 64.67 C ATOM 530 CD GLU A 636 11.284 136.715 -4.473 1.00 64.71 C ATOM 531 OE1 GLU A 636 10.230 137.432 -4.585 1.00 57.96 O ATOM 532 OE2 GLU A 636 11.984 136.627 -3.420 1.00 63.73 O ATOM 533 H GLU A 636 9.541 135.709 -9.136 1.00 0.00 H ATOM 534 N VAL A 637 10.190 132.794 -7.672 1.00 43.52 N ATOM 535 CA VAL A 637 10.031 131.353 -7.343 1.00 42.59 C ATOM 536 C VAL A 637 10.903 130.521 -8.301 1.00 47.29 C ATOM 537 O VAL A 637 11.711 129.708 -7.803 1.00 52.45 O ATOM 538 CB VAL A 637 8.532 130.993 -7.409 1.00 42.78 C ATOM 539 CG1 VAL A 637 8.260 129.505 -7.519 1.00 44.52 C ATOM 540 CG2 VAL A 637 7.761 131.593 -6.251 1.00 42.24 C ATOM 541 H VAL A 637 9.336 133.309 -7.969 1.00 0.00 H ATOM 542 N THR A 638 10.768 130.717 -9.622 1.00 49.95 N ATOM 543 CA THR A 638 11.466 129.894 -10.650 1.00 47.68 C ATOM 544 C THR A 638 12.966 130.184 -10.582 1.00 46.86 C ATOM 545 O THR A 638 13.761 129.250 -10.797 1.00 47.43 O ATOM 546 CB THR A 638 10.855 130.087 -12.040 1.00 51.23 C ATOM 547 OG1 THR A 638 10.814 131.482 -12.317 1.00 51.17 O ATOM 548 CG2 THR A 638 9.466 129.498 -12.132 1.00 52.57 C ATOM 549 HG1 THR A 638 10.421 131.628 -13.214 1.00 0.00 H ATOM 550 H THR A 638 10.144 131.483 -9.945 1.00 0.00 H ATOM 551 N LEU A 639 13.338 131.404 -10.211 1.00 47.66 N ATOM 552 CA LEU A 639 14.740 131.795 -9.894 1.00 50.31 C ATOM 553 C LEU A 639 15.282 130.971 -8.721 1.00 50.02 C ATOM 554 O LEU A 639 16.267 130.245 -8.913 1.00 52.75 O ATOM 555 CB LEU A 639 14.749 133.277 -9.526 1.00 56.78 C ATOM 556 CG LEU A 639 16.065 134.002 -9.739 1.00 63.31 C ATOM 557 CD1 LEU A 639 16.312 134.175 -11.241 1.00 67.13 C ATOM 558 CD2 LEU A 639 16.047 135.356 -9.009 1.00 58.59 C ATOM 559 H LEU A 639 12.602 132.135 -10.137 1.00 0.00 H ATOM 560 N LEU A 640 14.656 131.086 -7.547 1.00 49.66 N ATOM 561 CA LEU A 640 15.136 130.503 -6.258 1.00 49.46 C ATOM 562 C LEU A 640 15.125 128.967 -6.310 1.00 51.38 C ATOM 563 O LEU A 640 16.010 128.354 -5.682 1.00 49.30 O ATOM 564 CB LEU A 640 14.239 130.986 -5.116 1.00 49.29 C ATOM 565 CG LEU A 640 14.449 132.430 -4.673 1.00 53.42 C ATOM 566 CD1 LEU A 640 13.342 132.865 -3.726 1.00 56.68 C ATOM 567 CD2 LEU A 640 15.808 132.625 -4.022 1.00 51.24 C ATOM 568 H LEU A 640 13.766 131.623 -7.529 1.00 0.00 H ATOM 569 N SER A 641 14.163 128.365 -7.021 1.00 45.74 N ATOM 570 CA SER A 641 14.039 126.899 -7.170 1.00 44.83 C ATOM 571 C SER A 641 15.220 126.335 -7.977 1.00 43.01 C ATOM 572 O SER A 641 15.287 125.124 -8.132 1.00 52.53 O ATOM 573 CB SER A 641 12.692 126.524 -7.777 1.00 50.76 C ATOM 574 OG SER A 641 12.584 126.907 -9.152 1.00 52.09 O ATOM 575 HG SER A 641 12.691 127.888 -9.229 1.00 0.00 H ATOM 576 H SER A 641 13.460 128.965 -7.498 1.00 0.00 H ATOM 577 N ARG A 642 16.116 127.161 -8.499 1.00 43.63 N ATOM 578 CA ARG A 642 17.267 126.703 -9.328 1.00 44.80 C ATOM 579 C ARG A 642 18.592 127.240 -8.756 1.00 47.89 C ATOM 580 O ARG A 642 19.644 126.906 -9.334 1.00 50.92 O ATOM 581 CB ARG A 642 17.064 127.109 -10.795 1.00 43.36 C ATOM 582 CG ARG A 642 15.873 126.450 -11.488 1.00 44.39 C ATOM 583 CD ARG A 642 15.620 127.034 -12.889 1.00 44.50 C ATOM 584 NE ARG A 642 14.566 126.349 -13.614 1.00 44.92 N ATOM 585 CZ ARG A 642 13.261 126.412 -13.331 1.00 49.91 C ATOM 586 NH1 ARG A 642 12.814 127.164 -12.329 1.00 50.53 N ATOM 587 NH2 ARG A 642 12.397 125.707 -14.052 1.00 51.83 N ATOM 588 HE ARG A 642 14.850 125.759 -14.422 1.00 0.00 H ATOM 589 HH12 ARG A 642 11.796 127.202 -12.122 1.00 0.00 H ATOM 590 HH11 ARG A 642 13.483 127.714 -11.753 1.00 0.00 H ATOM 591 HH22 ARG A 642 11.381 125.752 -13.836 1.00 0.00 H ATOM 592 HH21 ARG A 642 12.737 125.110 -14.833 1.00 0.00 H ATOM 593 H ARG A 642 16.010 128.180 -8.321 1.00 0.00 H ATOM 594 N LEU A 643 18.562 127.986 -7.642 1.00 46.08 N ATOM 595 CA LEU A 643 19.764 128.369 -6.858 1.00 44.55 C ATOM 596 C LEU A 643 20.079 127.244 -5.876 1.00 44.33 C ATOM 597 O LEU A 643 19.159 126.790 -5.188 1.00 37.92 O ATOM 598 CB LEU A 643 19.514 129.682 -6.115 1.00 47.00 C ATOM 599 CG LEU A 643 19.174 130.898 -6.985 1.00 50.85 C ATOM 600 CD1 LEU A 643 19.054 132.144 -6.128 1.00 44.95 C ATOM 601 CD2 LEU A 643 20.202 131.135 -8.095 1.00 54.49 C ATOM 602 H LEU A 643 17.636 128.318 -7.305 1.00 0.00 H ATOM 603 N HIS A 644 21.329 126.770 -5.888 1.00 48.40 N ATOM 604 CA HIS A 644 21.881 125.750 -4.949 1.00 50.27 C ATOM 605 C HIS A 644 23.308 126.179 -4.611 1.00 47.04 C ATOM 606 O HIS A 644 24.231 125.759 -5.336 1.00 45.56 O ATOM 607 CB HIS A 644 21.845 124.316 -5.528 1.00 54.68 C ATOM 608 CG HIS A 644 20.653 124.012 -6.383 1.00 61.83 C ATOM 609 ND1 HIS A 644 19.411 123.696 -5.852 1.00 64.88 N ATOM 610 CD2 HIS A 644 20.503 123.983 -7.732 1.00 62.87 C ATOM 611 CE1 HIS A 644 18.555 123.474 -6.837 1.00 66.59 C ATOM 612 NE2 HIS A 644 19.199 123.654 -8.006 1.00 61.27 N ATOM 613 H HIS A 644 21.972 127.144 -6.614 1.00 0.00 H ATOM 614 N HIS A 645 23.467 127.047 -3.605 1.00 44.56 N ATOM 615 CA HIS A 645 24.790 127.525 -3.117 1.00 46.93 C ATOM 616 C HIS A 645 24.767 127.663 -1.601 1.00 45.14 C ATOM 617 O HIS A 645 23.741 128.109 -1.037 1.00 46.87 O ATOM 618 CB HIS A 645 25.203 128.837 -3.781 1.00 47.21 C ATOM 619 CG HIS A 645 26.645 129.159 -3.610 1.00 47.71 C ATOM 620 ND1 HIS A 645 27.096 130.098 -2.701 1.00 60.08 N ATOM 621 CD2 HIS A 645 27.738 128.682 -4.232 1.00 49.43 C ATOM 622 CE1 HIS A 645 28.415 130.180 -2.766 1.00 58.06 C ATOM 623 NE2 HIS A 645 28.832 129.327 -3.714 1.00 56.76 N ATOM 624 H HIS A 645 22.613 127.410 -3.135 1.00 0.00 H ATOM 625 N GLU A 646 25.876 127.300 -0.970 1.00 47.14 N ATOM 626 CA GLU A 646 25.939 127.179 0.510 1.00 47.60 C ATOM 627 C GLU A 646 25.807 128.568 1.138 1.00 44.82 C ATOM 628 O GLU A 646 25.549 128.587 2.354 1.00 45.12 O ATOM 629 CB GLU A 646 27.210 126.440 0.940 1.00 52.56 C ATOM 630 CG GLU A 646 28.504 127.169 0.610 1.00 56.53 C ATOM 631 CD GLU A 646 29.456 126.335 -0.212 1.00 62.44 C ATOM 632 OE1 GLU A 646 30.177 125.513 0.393 1.00 70.71 O ATOM 633 OE2 GLU A 646 29.407 126.462 -1.467 1.00 69.28 O ATOM 634 H GLU A 646 26.729 127.094 -1.529 1.00 0.00 H ATOM 635 N ASN A 647 25.926 129.655 0.343 1.00 41.81 N ATOM 636 CA ASN A 647 25.852 131.068 0.825 1.00 39.59 C ATOM 637 C ASN A 647 24.613 131.778 0.264 1.00 38.32 C ATOM 638 O ASN A 647 24.580 133.042 0.245 1.00 40.74 O ATOM 639 CB ASN A 647 27.147 131.823 0.545 1.00 36.72 C ATOM 640 CG ASN A 647 28.310 131.233 1.312 1.00 38.74 C ATOM 641 OD1 ASN A 647 29.282 130.764 0.712 1.00 38.30 O ATOM 642 ND2 ASN A 647 28.199 131.231 2.637 1.00 36.45 N ATOM 643 HD22 ASN A 647 27.357 131.641 3.089 1.00 0.00 H ATOM 644 HD21 ASN A 647 28.955 130.820 3.222 1.00 0.00 H ATOM 645 H ASN A 647 26.080 129.497 -0.673 1.00 0.00 H ATOM 646 N ILE A 648 23.594 130.997 -0.096 1.00 37.00 N ATOM 647 CA ILE A 648 22.276 131.514 -0.560 1.00 38.13 C ATOM 648 C ILE A 648 21.186 130.778 0.213 1.00 39.21 C ATOM 649 O ILE A 648 21.265 129.531 0.310 1.00 37.22 O ATOM 650 CB ILE A 648 22.096 131.339 -2.086 1.00 37.73 C ATOM 651 CG1 ILE A 648 23.261 131.944 -2.879 1.00 38.52 C ATOM 652 CG2 ILE A 648 20.760 131.918 -2.535 1.00 37.06 C ATOM 653 CD1 ILE A 648 23.258 133.447 -2.929 1.00 37.22 C ATOM 654 H ILE A 648 23.727 129.967 -0.050 1.00 0.00 H ATOM 655 N VAL A 649 20.205 131.532 0.714 1.00 43.28 N ATOM 656 CA VAL A 649 19.057 130.997 1.495 1.00 44.73 C ATOM 657 C VAL A 649 18.383 129.909 0.644 1.00 45.02 C ATOM 658 O VAL A 649 17.999 130.194 -0.501 1.00 42.72 O ATOM 659 CB VAL A 649 18.084 132.117 1.911 1.00 47.35 C ATOM 660 CG1 VAL A 649 16.875 131.538 2.626 1.00 53.31 C ATOM 661 CG2 VAL A 649 18.743 133.142 2.817 1.00 50.19 C ATOM 662 H VAL A 649 20.246 132.558 0.548 1.00 0.00 H ATOM 663 N ARG A 650 18.283 128.695 1.182 1.00 48.22 N ATOM 664 CA ARG A 650 17.650 127.539 0.505 1.00 50.50 C ATOM 665 C ARG A 650 16.178 127.837 0.252 1.00 45.54 C ATOM 666 O ARG A 650 15.544 128.402 1.138 1.00 49.96 O ATOM 667 CB ARG A 650 17.678 126.278 1.375 1.00 57.88 C ATOM 668 CG ARG A 650 18.956 125.457 1.321 1.00 66.09 C ATOM 669 CD ARG A 650 18.733 124.166 2.074 1.00 71.88 C ATOM 670 NE ARG A 650 17.582 123.478 1.505 1.00 87.24 N ATOM 671 CZ ARG A 650 17.129 122.290 1.907 1.00110.50 C ATOM 672 NH1 ARG A 650 17.720 121.652 2.907 1.00117.81 N ATOM 673 NH2 ARG A 650 16.079 121.738 1.313 1.00101.35 N ATOM 674 HE ARG A 650 17.076 123.948 0.728 1.00 0.00 H ATOM 675 HH12 ARG A 650 17.363 120.726 3.216 1.00 0.00 H ATOM 676 HH11 ARG A 650 18.541 122.078 3.382 1.00 0.00 H ATOM 677 HH22 ARG A 650 15.730 120.811 1.630 1.00 0.00 H ATOM 678 HH21 ARG A 650 15.605 122.232 0.530 1.00 0.00 H ATOM 679 H ARG A 650 18.673 128.549 2.135 1.00 0.00 H ATOM 680 N TYR A 651 15.667 127.391 -0.890 1.00 43.77 N ATOM 681 CA TYR A 651 14.225 127.344 -1.236 1.00 41.82 C ATOM 682 C TYR A 651 13.674 125.986 -0.809 1.00 39.11 C ATOM 683 O TYR A 651 14.412 125.024 -0.858 1.00 40.01 O ATOM 684 CB TYR A 651 14.065 127.586 -2.733 1.00 39.81 C ATOM 685 CG TYR A 651 12.773 127.124 -3.342 1.00 40.12 C ATOM 686 CD1 TYR A 651 11.692 127.986 -3.459 1.00 42.40 C ATOM 687 CD2 TYR A 651 12.639 125.855 -3.870 1.00 40.11 C ATOM 688 CE1 TYR A 651 10.505 127.588 -4.064 1.00 42.44 C ATOM 689 CE2 TYR A 651 11.454 125.436 -4.459 1.00 41.05 C ATOM 690 CZ TYR A 651 10.394 126.312 -4.584 1.00 38.93 C ATOM 691 OH TYR A 651 9.238 125.884 -5.158 1.00 39.40 O ATOM 692 HH TYR A 651 8.583 126.626 -5.172 1.00 0.00 H ATOM 693 H TYR A 651 16.337 127.044 -1.605 1.00 0.00 H ATOM 694 N TYR A 652 12.408 125.917 -0.412 1.00 42.28 N ATOM 695 CA TYR A 652 11.738 124.645 -0.035 1.00 42.96 C ATOM 696 C TYR A 652 10.462 124.473 -0.865 1.00 42.56 C ATOM 697 O TYR A 652 10.239 123.354 -1.333 1.00 42.60 O ATOM 698 CB TYR A 652 11.457 124.594 1.481 1.00 46.62 C ATOM 699 CG TYR A 652 12.636 124.133 2.296 1.00 42.57 C ATOM 700 CD1 TYR A 652 13.647 125.019 2.610 1.00 43.37 C ATOM 701 CD2 TYR A 652 12.787 122.820 2.689 1.00 42.22 C ATOM 702 CE1 TYR A 652 14.758 124.624 3.333 1.00 43.06 C ATOM 703 CE2 TYR A 652 13.894 122.405 3.416 1.00 43.14 C ATOM 704 CZ TYR A 652 14.883 123.314 3.738 1.00 43.75 C ATOM 705 OH TYR A 652 15.989 122.942 4.442 1.00 54.37 O ATOM 706 HH TYR A 652 16.576 123.729 4.572 1.00 0.00 H ATOM 707 H TYR A 652 11.858 126.798 -0.363 1.00 0.00 H ATOM 708 N ASN A 653 9.607 125.501 -0.950 1.00 42.76 N ATOM 709 CA ASN A 653 8.280 125.414 -1.617 1.00 44.26 C ATOM 710 C ASN A 653 7.711 126.810 -1.910 1.00 41.91 C ATOM 711 O ASN A 653 8.177 127.808 -1.343 1.00 36.33 O ATOM 712 CB ASN A 653 7.250 124.618 -0.812 1.00 49.32 C ATOM 713 CG ASN A 653 6.912 123.284 -1.445 1.00 57.86 C ATOM 714 OD1 ASN A 653 5.790 123.059 -1.906 1.00 64.97 O ATOM 715 ND2 ASN A 653 7.883 122.383 -1.468 1.00 58.19 N ATOM 716 HD22 ASN A 653 8.815 122.613 -1.068 1.00 0.00 H ATOM 717 HD21 ASN A 653 7.713 121.446 -1.886 1.00 0.00 H ATOM 718 H ASN A 653 9.886 126.409 -0.527 1.00 0.00 H ATOM 719 N ALA A 654 6.750 126.844 -2.825 1.00 41.75 N ATOM 720 CA ALA A 654 5.960 128.032 -3.173 1.00 41.81 C ATOM 721 C ALA A 654 4.554 127.580 -3.539 1.00 42.18 C ATOM 722 O ALA A 654 4.418 126.577 -4.209 1.00 41.58 O ATOM 723 CB ALA A 654 6.610 128.776 -4.299 1.00 40.63 C ATOM 724 H ALA A 654 6.541 125.962 -3.334 1.00 0.00 H ATOM 725 N TRP A 655 3.547 128.328 -3.121 1.00 46.03 N ATOM 726 CA TRP A 655 2.143 128.010 -3.463 1.00 50.82 C ATOM 727 C TRP A 655 1.277 129.282 -3.402 1.00 53.14 C ATOM 728 O TRP A 655 1.744 130.323 -2.895 1.00 49.83 O ATOM 729 CB TRP A 655 1.631 126.887 -2.550 1.00 49.89 C ATOM 730 CG TRP A 655 1.423 127.334 -1.135 1.00 49.52 C ATOM 731 CD1 TRP A 655 0.284 127.860 -0.601 1.00 52.34 C ATOM 732 CD2 TRP A 655 2.394 127.318 -0.075 1.00 48.00 C ATOM 733 NE1 TRP A 655 0.479 128.181 0.713 1.00 55.87 N ATOM 734 CE2 TRP A 655 1.766 127.862 1.067 1.00 53.57 C ATOM 735 CE3 TRP A 655 3.720 126.891 0.030 1.00 45.35 C ATOM 736 CZ2 TRP A 655 2.428 128.010 2.287 1.00 50.24 C ATOM 737 CZ3 TRP A 655 4.376 127.052 1.229 1.00 46.10 C ATOM 738 CH2 TRP A 655 3.736 127.593 2.345 1.00 47.56 C ATOM 739 HE1 TRP A 655 -0.234 128.600 1.344 1.00 0.00 H ATOM 740 H TRP A 655 3.747 129.164 -2.535 1.00 0.00 H ATOM 741 N ILE A 656 0.056 129.159 -3.913 1.00 54.92 N ATOM 742 CA ILE A 656 -0.961 130.227 -4.013 1.00 62.32 C ATOM 743 C ILE A 656 -2.192 129.737 -3.250 1.00 65.03 C ATOM 744 O ILE A 656 -2.512 128.539 -3.382 1.00 65.25 O ATOM 745 CB ILE A 656 -1.239 130.474 -5.507 1.00 69.72 C ATOM 746 CG1 ILE A 656 -0.020 131.057 -6.225 1.00 71.02 C ATOM 747 CG2 ILE A 656 -2.488 131.325 -5.715 1.00 76.44 C ATOM 748 CD1 ILE A 656 -0.085 130.883 -7.730 1.00 76.43 C ATOM 749 H ILE A 656 -0.209 128.222 -4.277 1.00 0.00 H ATOM 750 N GLU A 657 -2.829 130.599 -2.458 1.00 66.72 N ATOM 751 CA GLU A 657 -4.074 130.259 -1.728 1.00 74.62 C ATOM 752 C GLU A 657 -5.142 131.295 -2.047 1.00 80.23 C ATOM 753 O GLU A 657 -4.763 132.398 -2.487 1.00 80.45 O ATOM 754 CB GLU A 657 -3.871 130.305 -0.216 1.00 77.59 C ATOM 755 CG GLU A 657 -2.862 129.309 0.308 1.00 75.12 C ATOM 756 CD GLU A 657 -2.659 129.370 1.815 1.00 76.35 C ATOM 757 OE1 GLU A 657 -3.357 130.185 2.484 1.00 79.11 O ATOM 758 OE2 GLU A 657 -1.794 128.611 2.318 1.00 69.37 O ATOM 759 H GLU A 657 -2.434 131.555 -2.347 1.00 0.00 H ATOM 760 N ASN A 658 -6.404 130.958 -1.759 1.00 85.59 N ATOM 761 CA ASN A 658 -7.525 131.921 -1.586 1.00 92.44 C ATOM 762 C ASN A 658 -7.165 132.887 -0.452 1.00 92.99 C ATOM 763 O ASN A 658 -8.084 133.581 0.009 1.00 97.35 O ATOM 764 CB ASN A 658 -8.842 131.200 -1.296 1.00 98.15 C ATOM 765 CG ASN A 658 -9.288 130.327 -2.448 1.00100.90 C ATOM 766 OD1 ASN A 658 -9.429 130.809 -3.566 1.00104.51 O ATOM 767 ND2 ASN A 658 -9.504 129.047 -2.190 1.00100.97 N ATOM 768 HD22 ASN A 658 -9.372 128.681 -1.225 1.00 0.00 H ATOM 769 HD21 ASN A 658 -9.806 128.407 -2.952 1.00 0.00 H ATOM 770 H ASN A 658 -6.618 129.946 -1.648 1.00 0.00 H TER 771 ASN A 658 ATOM 772 N VAL A 795 -6.423 132.458 -4.835 1.00 91.76 N ATOM 773 CA VAL A 795 -6.496 133.799 -5.487 1.00 92.72 C ATOM 774 C VAL A 795 -5.476 134.746 -4.828 1.00 92.74 C ATOM 775 O VAL A 795 -4.436 135.024 -5.468 1.00 96.63 O ATOM 776 CB VAL A 795 -7.937 134.345 -5.458 1.00 99.61 C ATOM 777 CG1 VAL A 795 -8.018 135.822 -5.825 1.00103.26 C ATOM 778 CG2 VAL A 795 -8.846 133.519 -6.360 1.00102.78 C ATOM 779 HN3 VAL A 795 -6.641 132.554 -3.823 1.00 0.00 H ATOM 780 HN2 VAL A 795 -5.465 132.070 -4.949 1.00 0.00 H ATOM 781 HN1 VAL A 795 -7.112 131.819 -5.281 1.00 0.00 H ATOM 782 N HIS A 796 -5.718 135.188 -3.589 1.00 92.31 N ATOM 783 CA HIS A 796 -5.058 136.384 -2.989 1.00 88.46 C ATOM 784 C HIS A 796 -3.532 136.235 -2.804 1.00 80.74 C ATOM 785 O HIS A 796 -2.889 137.251 -3.053 1.00 76.86 O ATOM 786 CB HIS A 796 -5.760 136.832 -1.689 1.00 91.16 C ATOM 787 CG HIS A 796 -6.890 137.784 -1.895 1.00 91.14 C ATOM 788 ND1 HIS A 796 -8.033 137.745 -1.118 1.00 93.54 N ATOM 789 CD2 HIS A 796 -7.052 138.798 -2.770 1.00 91.96 C ATOM 790 CE1 HIS A 796 -8.865 138.687 -1.516 1.00 98.13 C ATOM 791 NE2 HIS A 796 -8.284 139.349 -2.527 1.00 99.23 N ATOM 792 H HIS A 796 -6.407 134.667 -3.010 1.00 0.00 H ATOM 793 N TYR A 797 -2.953 135.116 -2.334 1.00 73.76 N ATOM 794 CA TYR A 797 -1.600 135.150 -1.702 1.00 69.07 C ATOM 795 C TYR A 797 -0.614 134.175 -2.364 1.00 64.45 C ATOM 796 O TYR A 797 -0.979 133.039 -2.681 1.00 65.36 O ATOM 797 CB TYR A 797 -1.697 134.862 -0.199 1.00 70.68 C ATOM 798 CG TYR A 797 -2.337 135.945 0.641 1.00 76.47 C ATOM 799 CD1 TYR A 797 -1.645 137.103 0.962 1.00 78.07 C ATOM 800 CD2 TYR A 797 -3.630 135.810 1.141 1.00 77.89 C ATOM 801 CE1 TYR A 797 -2.231 138.108 1.718 1.00 81.14 C ATOM 802 CE2 TYR A 797 -4.226 136.807 1.894 1.00 79.97 C ATOM 803 CZ TYR A 797 -3.518 137.955 2.197 1.00 80.99 C ATOM 804 OH TYR A 797 -4.081 138.941 2.952 1.00 87.38 O ATOM 805 HH TYR A 797 -3.432 139.680 3.065 1.00 0.00 H ATOM 806 H TYR A 797 -3.457 134.210 -2.412 1.00 0.00 H ATOM 807 N LEU A 798 0.620 134.633 -2.573 1.00 60.46 N ATOM 808 CA LEU A 798 1.791 133.776 -2.884 1.00 57.72 C ATOM 809 C LEU A 798 2.664 133.683 -1.629 1.00 57.59 C ATOM 810 O LEU A 798 3.039 134.763 -1.102 1.00 58.03 O ATOM 811 CB LEU A 798 2.592 134.360 -4.059 1.00 58.15 C ATOM 812 CG LEU A 798 3.908 133.638 -4.376 1.00 56.59 C ATOM 813 CD1 LEU A 798 3.663 132.223 -4.880 1.00 55.32 C ATOM 814 CD2 LEU A 798 4.760 134.410 -5.374 1.00 55.51 C ATOM 815 H LEU A 798 0.773 135.660 -2.514 1.00 0.00 H ATOM 816 N TYR A 799 2.949 132.450 -1.168 1.00 56.72 N ATOM 817 CA TYR A 799 3.846 132.100 -0.030 1.00 50.14 C ATOM 818 C TYR A 799 5.109 131.445 -0.587 1.00 50.18 C ATOM 819 O TYR A 799 5.007 130.499 -1.401 1.00 49.79 O ATOM 820 CB TYR A 799 3.201 131.100 0.929 1.00 48.16 C ATOM 821 CG TYR A 799 1.985 131.624 1.642 1.00 51.60 C ATOM 822 CD1 TYR A 799 0.738 131.542 1.053 1.00 53.90 C ATOM 823 CD2 TYR A 799 2.069 132.212 2.893 1.00 51.83 C ATOM 824 CE1 TYR A 799 -0.393 132.038 1.675 1.00 56.01 C ATOM 825 CE2 TYR A 799 0.947 132.701 3.536 1.00 53.78 C ATOM 826 CZ TYR A 799 -0.288 132.631 2.915 1.00 56.77 C ATOM 827 OH TYR A 799 -1.417 133.118 3.512 1.00 61.63 O ATOM 828 HH TYR A 799 -2.193 132.976 2.914 1.00 0.00 H ATOM 829 H TYR A 799 2.493 131.655 -1.660 1.00 0.00 H ATOM 830 N ILE A 800 6.274 131.920 -0.153 1.00 49.02 N ATOM 831 CA ILE A 800 7.589 131.316 -0.499 1.00 45.37 C ATOM 832 C ILE A 800 8.262 130.834 0.796 1.00 45.55 C ATOM 833 O ILE A 800 8.503 131.656 1.708 1.00 45.14 O ATOM 834 CB ILE A 800 8.436 132.327 -1.284 1.00 44.45 C ATOM 835 CG1 ILE A 800 7.573 133.055 -2.316 1.00 48.18 C ATOM 836 CG2 ILE A 800 9.642 131.640 -1.904 1.00 45.13 C ATOM 837 CD1 ILE A 800 8.330 133.826 -3.382 1.00 50.50 C ATOM 838 H ILE A 800 6.265 132.759 0.461 1.00 0.00 H ATOM 839 N GLN A 801 8.511 129.529 0.881 1.00 44.88 N ATOM 840 CA GLN A 801 9.066 128.823 2.067 1.00 42.23 C ATOM 841 C GLN A 801 10.560 128.664 1.820 1.00 39.35 C ATOM 842 O GLN A 801 10.915 128.055 0.784 1.00 37.54 O ATOM 843 CB GLN A 801 8.352 127.480 2.232 1.00 44.15 C ATOM 844 CG GLN A 801 8.584 126.786 3.558 1.00 44.64 C ATOM 845 CD GLN A 801 8.019 125.390 3.560 1.00 45.26 C ATOM 846 OE1 GLN A 801 7.053 125.063 2.881 1.00 46.53 O ATOM 847 NE2 GLN A 801 8.676 124.523 4.292 1.00 46.91 N ATOM 848 HE22 GLN A 801 9.492 124.832 4.857 1.00 0.00 H ATOM 849 HE21 GLN A 801 8.381 123.526 4.307 1.00 0.00 H ATOM 850 H GLN A 801 8.298 128.951 0.043 1.00 0.00 H ATOM 851 N MET A 802 11.376 129.234 2.716 1.00 40.57 N ATOM 852 CA MET A 802 12.864 129.245 2.664 1.00 40.72 C ATOM 853 C MET A 802 13.474 128.745 3.992 1.00 38.69 C ATOM 854 O MET A 802 12.781 128.767 5.035 1.00 43.96 O ATOM 855 CB MET A 802 13.355 130.665 2.376 1.00 42.05 C ATOM 856 CG MET A 802 12.609 131.351 1.250 1.00 44.64 C ATOM 857 SD MET A 802 13.030 130.621 -0.350 1.00 42.08 S ATOM 858 CE MET A 802 14.722 131.211 -0.416 1.00 40.31 C ATOM 859 H MET A 802 10.929 129.714 3.523 1.00 0.00 H ATOM 860 N GLU A 803 14.753 128.369 3.984 1.00 36.40 N ATOM 861 CA GLU A 803 15.459 127.987 5.231 1.00 39.90 C ATOM 862 C GLU A 803 15.318 129.171 6.186 1.00 41.22 C ATOM 863 O GLU A 803 15.213 130.294 5.693 1.00 37.05 O ATOM 864 CB GLU A 803 16.915 127.536 5.004 1.00 40.13 C ATOM 865 CG GLU A 803 17.968 128.623 5.128 1.00 41.12 C ATOM 866 CD GLU A 803 19.414 128.173 4.958 1.00 43.22 C ATOM 867 OE1 GLU A 803 20.019 127.686 5.933 1.00 44.00 O ATOM 868 OE2 GLU A 803 19.956 128.352 3.855 1.00 53.64 O ATOM 869 H GLU A 803 15.268 128.343 3.081 1.00 0.00 H ATOM 870 N TYR A 804 15.236 128.895 7.490 1.00 45.12 N ATOM 871 CA TYR A 804 15.367 129.904 8.564 1.00 47.29 C ATOM 872 C TYR A 804 16.766 129.781 9.190 1.00 48.39 C ATOM 873 O TYR A 804 17.095 128.785 9.874 1.00 51.78 O ATOM 874 CB TYR A 804 14.222 129.772 9.571 1.00 52.47 C ATOM 875 CG TYR A 804 14.369 130.665 10.777 1.00 54.95 C ATOM 876 CD1 TYR A 804 14.084 132.024 10.714 1.00 58.04 C ATOM 877 CD2 TYR A 804 14.826 130.155 11.978 1.00 57.38 C ATOM 878 CE1 TYR A 804 14.242 132.853 11.813 1.00 57.07 C ATOM 879 CE2 TYR A 804 15.009 130.972 13.082 1.00 60.90 C ATOM 880 CZ TYR A 804 14.708 132.321 13.001 1.00 59.14 C ATOM 881 OH TYR A 804 14.873 133.109 14.096 1.00 58.31 O ATOM 882 HH TYR A 804 14.616 134.039 13.874 1.00 0.00 H ATOM 883 H TYR A 804 15.069 127.907 7.769 1.00 0.00 H ATOM 884 N CYS A 805 17.579 130.809 8.957 1.00 53.48 N ATOM 885 CA CYS A 805 18.940 130.994 9.520 1.00 53.27 C ATOM 886 C CYS A 805 18.798 131.480 10.976 1.00 54.81 C ATOM 887 O CYS A 805 18.240 132.569 11.202 1.00 56.53 O ATOM 888 CB CYS A 805 19.718 131.938 8.615 1.00 51.05 C ATOM 889 SG CYS A 805 19.663 131.451 6.868 1.00 50.18 S ATOM 890 H CYS A 805 17.228 131.553 8.321 1.00 0.00 H ATOM 891 N GLU A 806 19.253 130.665 11.924 1.00 53.31 N ATOM 892 CA GLU A 806 18.874 130.738 13.362 1.00 58.89 C ATOM 893 C GLU A 806 19.518 131.955 14.031 1.00 54.09 C ATOM 894 O GLU A 806 18.836 132.566 14.856 1.00 51.23 O ATOM 895 CB GLU A 806 19.314 129.464 14.095 1.00 66.55 C ATOM 896 CG GLU A 806 18.581 128.221 13.630 1.00 72.27 C ATOM 897 CD GLU A 806 17.474 127.760 14.566 1.00 81.38 C ATOM 898 OE1 GLU A 806 17.180 128.473 15.563 1.00 93.19 O ATOM 899 OE2 GLU A 806 16.908 126.681 14.311 1.00 72.09 O ATOM 900 H GLU A 806 19.923 129.922 11.640 1.00 0.00 H ATOM 901 N ALA A 807 20.782 132.257 13.708 1.00 50.96 N ATOM 902 CA ALA A 807 21.624 133.255 14.409 1.00 52.65 C ATOM 903 C ALA A 807 21.217 134.673 13.989 1.00 53.51 C ATOM 904 O ALA A 807 20.085 134.859 13.558 1.00 52.04 O ATOM 905 CB ALA A 807 23.085 132.963 14.157 1.00 50.47 C ATOM 906 H ALA A 807 21.205 131.752 12.903 1.00 0.00 H ATOM 907 N SER A 808 22.110 135.644 14.122 1.00 61.61 N ATOM 908 CA SER A 808 21.845 137.071 13.808 1.00 66.09 C ATOM 909 C SER A 808 21.811 137.312 12.289 1.00 63.26 C ATOM 910 O SER A 808 22.312 136.469 11.529 1.00 74.71 O ATOM 911 CB SER A 808 22.853 137.957 14.501 1.00 74.57 C ATOM 912 OG SER A 808 24.063 137.256 14.774 1.00 85.55 O ATOM 913 HG SER A 808 24.457 136.937 13.924 1.00 0.00 H ATOM 914 H SER A 808 23.057 135.390 14.469 1.00 0.00 H ATOM 915 N THR A 809 21.156 138.402 11.879 1.00 59.72 N ATOM 916 CA THR A 809 21.423 139.168 10.636 1.00 53.01 C ATOM 917 C THR A 809 22.843 139.733 10.711 1.00 52.13 C ATOM 918 O THR A 809 23.297 140.071 11.824 1.00 51.58 O ATOM 919 CB THR A 809 20.467 140.362 10.468 1.00 53.85 C ATOM 920 OG1 THR A 809 20.746 141.380 11.438 1.00 50.61 O ATOM 921 CG2 THR A 809 19.007 139.978 10.589 1.00 55.98 C ATOM 922 HG1 THR A 809 21.677 141.698 11.323 1.00 0.00 H ATOM 923 H THR A 809 20.387 138.746 12.488 1.00 0.00 H ATOM 924 N LEU A 810 23.511 139.877 9.571 1.00 48.54 N ATOM 925 CA LEU A 810 24.817 140.582 9.509 1.00 49.33 C ATOM 926 C LEU A 810 24.684 141.921 10.249 1.00 51.02 C ATOM 927 O LEU A 810 25.614 142.306 10.957 1.00 49.70 O ATOM 928 CB LEU A 810 25.228 140.789 8.048 1.00 47.33 C ATOM 929 CG LEU A 810 26.667 141.260 7.867 1.00 49.78 C ATOM 930 CD1 LEU A 810 27.629 140.222 8.439 1.00 49.49 C ATOM 931 CD2 LEU A 810 26.992 141.580 6.404 1.00 45.86 C ATOM 932 H LEU A 810 23.107 139.484 8.697 1.00 0.00 H ATOM 933 N ARG A 811 23.545 142.596 10.090 1.00 53.76 N ATOM 934 CA ARG A 811 23.235 143.900 10.737 1.00 55.66 C ATOM 935 C ARG A 811 23.515 143.739 12.222 1.00 60.42 C ATOM 936 O ARG A 811 24.334 144.499 12.767 1.00 62.78 O ATOM 937 CB ARG A 811 21.777 144.304 10.478 1.00 55.72 C ATOM 938 CG ARG A 811 21.247 145.499 11.258 1.00 56.13 C ATOM 939 CD ARG A 811 21.757 146.785 10.682 1.00 57.12 C ATOM 940 NE ARG A 811 23.041 147.187 11.232 1.00 60.10 N ATOM 941 CZ ARG A 811 23.991 147.869 10.574 1.00 67.36 C ATOM 942 NH1 ARG A 811 23.853 148.199 9.291 1.00 67.30 N ATOM 943 NH2 ARG A 811 25.105 148.185 11.209 1.00 71.40 N ATOM 944 HE ARG A 811 23.240 146.924 12.218 1.00 0.00 H ATOM 945 HH12 ARG A 811 24.606 148.728 8.806 1.00 0.00 H ATOM 946 HH11 ARG A 811 22.992 147.928 8.774 1.00 0.00 H ATOM 947 HH22 ARG A 811 25.853 148.713 10.716 1.00 0.00 H ATOM 948 HH21 ARG A 811 25.235 147.906 12.202 1.00 0.00 H ATOM 949 H ARG A 811 22.821 142.181 9.469 1.00 0.00 H ATOM 950 N ASP A 812 22.865 142.760 12.843 1.00 62.63 N ATOM 951 CA ASP A 812 22.991 142.582 14.304 1.00 67.35 C ATOM 952 C ASP A 812 24.434 142.168 14.586 1.00 66.29 C ATOM 953 O ASP A 812 25.024 142.778 15.495 1.00 72.38 O ATOM 954 CB ASP A 812 21.860 141.711 14.848 1.00 72.63 C ATOM 955 CG ASP A 812 20.639 142.540 15.265 1.00 81.11 C ATOM 956 OD1 ASP A 812 20.639 143.795 15.072 1.00 79.49 O ATOM 957 OD2 ASP A 812 19.705 141.942 15.834 1.00 88.16 O ATOM 958 H ASP A 812 22.262 142.113 12.295 1.00 0.00 H ATOM 959 N THR A 813 25.018 141.275 13.784 1.00 61.96 N ATOM 960 CA THR A 813 26.403 140.783 13.995 1.00 62.39 C ATOM 961 C THR A 813 27.362 141.967 14.065 1.00 62.18 C ATOM 962 O THR A 813 28.176 141.966 15.000 1.00 67.53 O ATOM 963 CB THR A 813 26.871 139.829 12.887 1.00 65.27 C ATOM 964 OG1 THR A 813 26.068 138.640 12.920 1.00 68.21 O ATOM 965 CG2 THR A 813 28.338 139.473 13.025 1.00 64.56 C ATOM 966 HG1 THR A 813 25.119 138.880 12.774 1.00 0.00 H ATOM 967 H THR A 813 24.478 140.907 12.975 1.00 0.00 H ATOM 968 N ILE A 814 27.253 142.917 13.118 1.00 62.64 N ATOM 969 CA ILE A 814 28.127 144.132 12.969 1.00 60.63 C ATOM 970 C ILE A 814 28.036 144.981 14.241 1.00 58.63 C ATOM 971 O ILE A 814 29.086 145.397 14.736 1.00 57.63 O ATOM 972 CB ILE A 814 27.761 144.970 11.717 1.00 59.25 C ATOM 973 CG1 ILE A 814 28.119 144.239 10.423 1.00 62.81 C ATOM 974 CG2 ILE A 814 28.411 146.350 11.741 1.00 58.79 C ATOM 975 CD1 ILE A 814 27.546 144.891 9.167 1.00 64.92 C ATOM 976 H ILE A 814 26.490 142.800 12.421 1.00 0.00 H ATOM 977 N ASP A 815 26.816 145.264 14.695 1.00 59.33 N ATOM 978 CA ASP A 815 26.538 146.151 15.852 1.00 65.42 C ATOM 979 C ASP A 815 27.097 145.521 17.137 1.00 71.04 C ATOM 980 O ASP A 815 27.373 146.295 18.067 1.00 75.48 O ATOM 981 CB ASP A 815 25.040 146.436 15.987 1.00 66.96 C ATOM 982 CG ASP A 815 24.458 147.289 14.854 1.00 67.74 C ATOM 983 OD1 ASP A 815 25.169 148.170 14.361 1.00 72.35 O ATOM 984 OD2 ASP A 815 23.284 147.076 14.485 1.00 71.30 O ATOM 985 H ASP A 815 26.004 144.835 14.206 1.00 0.00 H ATOM 986 N GLN A 816 27.266 144.186 17.184 1.00 75.03 N ATOM 987 CA GLN A 816 27.799 143.423 18.356 1.00 74.42 C ATOM 988 C GLN A 816 29.336 143.398 18.315 1.00 71.24 C ATOM 989 O GLN A 816 29.930 142.583 19.024 1.00 70.44 O ATOM 990 CB GLN A 816 27.234 141.997 18.362 1.00 73.53 C ATOM 991 CG GLN A 816 25.737 141.943 18.636 1.00 75.91 C ATOM 992 CD GLN A 816 25.046 140.709 18.092 1.00 79.27 C ATOM 993 OE1 GLN A 816 25.646 139.852 17.435 1.00 84.27 O ATOM 994 NE2 GLN A 816 23.745 140.618 18.336 1.00 77.19 N ATOM 995 HE22 GLN A 816 23.267 141.355 18.892 1.00 0.00 H ATOM 996 HE21 GLN A 816 23.203 139.809 17.971 1.00 0.00 H ATOM 997 H GLN A 816 27.005 143.641 16.338 1.00 0.00 H ATOM 998 N GLY A 817 29.956 144.235 17.484 1.00 68.63 N ATOM 999 CA GLY A 817 31.411 144.476 17.460 1.00 69.34 C ATOM 1000 C GLY A 817 32.158 143.490 16.583 1.00 67.35 C ATOM 1001 O GLY A 817 33.279 143.117 16.958 1.00 67.84 O ATOM 1002 H GLY A 817 29.370 144.757 16.801 1.00 0.00 H ATOM 1003 N LEU A 818 31.595 143.116 15.429 1.00 65.58 N ATOM 1004 CA LEU A 818 32.264 142.232 14.440 1.00 65.86 C ATOM 1005 C LEU A 818 33.665 142.766 14.124 1.00 70.54 C ATOM 1006 O LEU A 818 34.568 141.926 13.917 1.00 74.60 O ATOM 1007 CB LEU A 818 31.431 142.160 13.161 1.00 65.30 C ATOM 1008 CG LEU A 818 32.084 141.406 12.004 1.00 65.85 C ATOM 1009 CD1 LEU A 818 32.423 139.983 12.413 1.00 65.37 C ATOM 1010 CD2 LEU A 818 31.186 141.419 10.771 1.00 65.53 C ATOM 1011 H LEU A 818 30.639 143.462 15.213 1.00 0.00 H ATOM 1012 N TYR A 819 33.836 144.095 14.082 1.00 72.43 N ATOM 1013 CA TYR A 819 35.073 144.777 13.612 1.00 78.09 C ATOM 1014 C TYR A 819 36.339 144.303 14.354 1.00 81.50 C ATOM 1015 O TYR A 819 37.410 144.279 13.717 1.00 84.88 O ATOM 1016 CB TYR A 819 34.906 146.298 13.686 1.00 82.13 C ATOM 1017 CG TYR A 819 35.038 146.920 15.053 1.00 82.93 C ATOM 1018 CD1 TYR A 819 34.062 146.723 16.012 1.00 82.31 C ATOM 1019 CD2 TYR A 819 36.112 147.744 15.373 1.00 86.88 C ATOM 1020 CE1 TYR A 819 34.169 147.293 17.273 1.00 88.78 C ATOM 1021 CE2 TYR A 819 36.230 148.326 16.629 1.00 92.64 C ATOM 1022 CZ TYR A 819 35.251 148.101 17.587 1.00 92.13 C ATOM 1023 OH TYR A 819 35.324 148.676 18.828 1.00 89.48 O ATOM 1024 HH TYR A 819 34.540 148.398 19.366 1.00 0.00 H ATOM 1025 H TYR A 819 33.047 144.693 14.401 1.00 0.00 H ATOM 1026 N ARG A 820 36.262 143.938 15.636 1.00 84.35 N ATOM 1027 CA ARG A 820 37.456 143.483 16.402 1.00 89.40 C ATOM 1028 C ARG A 820 37.919 142.100 15.912 1.00 84.56 C ATOM 1029 O ARG A 820 39.106 141.808 16.048 1.00 82.25 O ATOM 1030 CB ARG A 820 37.175 143.482 17.911 1.00102.25 C ATOM 1031 CG ARG A 820 37.372 144.834 18.597 1.00112.49 C ATOM 1032 CD ARG A 820 38.797 145.158 19.080 1.00118.86 C ATOM 1033 NE ARG A 820 39.157 146.582 19.012 1.00121.11 N ATOM 1034 CZ ARG A 820 39.966 147.151 18.100 1.00117.21 C ATOM 1035 NH1 ARG A 820 40.539 146.429 17.150 1.00113.07 N ATOM 1036 NH2 ARG A 820 40.198 148.453 18.144 1.00116.53 N ATOM 1037 HE ARG A 820 38.748 147.207 19.736 1.00 0.00 H ATOM 1038 HH12 ARG A 820 41.161 146.886 16.453 1.00 0.00 H ATOM 1039 HH11 ARG A 820 40.367 145.405 17.100 1.00 0.00 H ATOM 1040 HH22 ARG A 820 40.823 148.894 17.439 1.00 0.00 H ATOM 1041 HH21 ARG A 820 39.755 149.035 18.883 1.00 0.00 H ATOM 1042 H ARG A 820 35.339 143.972 16.115 1.00 0.00 H ATOM 1043 N ASP A 821 37.025 141.307 15.320 1.00 81.04 N ATOM 1044 CA ASP A 821 37.199 139.863 15.000 1.00 78.49 C ATOM 1045 C ASP A 821 37.614 139.702 13.523 1.00 76.10 C ATOM 1046 O ASP A 821 36.767 139.252 12.713 1.00 71.24 O ATOM 1047 CB ASP A 821 35.875 139.169 15.372 1.00 75.98 C ATOM 1048 CG ASP A 821 35.944 137.651 15.684 1.00 74.80 C ATOM 1049 OD1 ASP A 821 36.983 137.021 15.420 1.00 75.63 O ATOM 1050 OD2 ASP A 821 34.942 137.153 16.235 1.00 72.96 O ATOM 1051 H ASP A 821 36.117 141.740 15.056 1.00 0.00 H ATOM 1052 N THR A 822 38.865 140.044 13.168 1.00 75.57 N ATOM 1053 CA THR A 822 39.296 140.233 11.749 1.00 72.02 C ATOM 1054 C THR A 822 39.247 138.890 10.995 1.00 68.40 C ATOM 1055 O THR A 822 38.713 138.879 9.873 1.00 67.36 O ATOM 1056 CB THR A 822 40.666 140.922 11.579 1.00 72.60 C ATOM 1057 OG1 THR A 822 41.701 139.939 11.567 1.00 73.42 O ATOM 1058 CG2 THR A 822 40.976 141.973 12.622 1.00 74.41 C ATOM 1059 HG1 THR A 822 42.578 140.386 11.458 1.00 0.00 H ATOM 1060 H THR A 822 39.570 140.184 13.920 1.00 0.00 H ATOM 1061 N VAL A 823 39.761 137.794 11.560 1.00 66.40 N ATOM 1062 CA VAL A 823 39.760 136.463 10.873 1.00 65.20 C ATOM 1063 C VAL A 823 38.304 136.080 10.535 1.00 62.93 C ATOM 1064 O VAL A 823 38.060 135.607 9.399 1.00 56.92 O ATOM 1065 CB VAL A 823 40.490 135.383 11.701 1.00 65.95 C ATOM 1066 CG1 VAL A 823 40.023 133.972 11.376 1.00 63.29 C ATOM 1067 CG2 VAL A 823 41.996 135.482 11.529 1.00 69.03 C ATOM 1068 H VAL A 823 40.177 137.868 12.511 1.00 0.00 H ATOM 1069 N ARG A 824 37.362 136.299 11.462 1.00 62.91 N ATOM 1070 CA ARG A 824 35.911 136.061 11.233 1.00 60.73 C ATOM 1071 C ARG A 824 35.394 136.977 10.109 1.00 63.41 C ATOM 1072 O ARG A 824 34.634 136.505 9.238 1.00 68.48 O ATOM 1073 CB ARG A 824 35.117 136.326 12.515 1.00 57.46 C ATOM 1074 CG ARG A 824 33.636 136.004 12.370 1.00 53.55 C ATOM 1075 CD ARG A 824 33.006 135.683 13.707 1.00 53.98 C ATOM 1076 NE ARG A 824 31.556 135.576 13.658 1.00 52.12 N ATOM 1077 CZ ARG A 824 30.706 136.510 14.063 1.00 50.67 C ATOM 1078 NH1 ARG A 824 31.154 137.669 14.511 1.00 54.95 N ATOM 1079 NH2 ARG A 824 29.404 136.299 14.004 1.00 47.13 N ATOM 1080 HE ARG A 824 31.154 134.697 13.275 1.00 0.00 H ATOM 1081 HH12 ARG A 824 30.484 138.398 14.828 1.00 0.00 H ATOM 1082 HH11 ARG A 824 32.177 137.852 14.547 1.00 0.00 H ATOM 1083 HH22 ARG A 824 28.743 137.036 14.323 1.00 0.00 H ATOM 1084 HH21 ARG A 824 29.040 135.396 13.638 1.00 0.00 H ATOM 1085 H ARG A 824 37.661 136.655 12.392 1.00 0.00 H ATOM 1086 N LEU A 825 35.777 138.251 10.176 1.00 64.62 N ATOM 1087 CA LEU A 825 35.309 139.388 9.340 1.00 64.19 C ATOM 1088 C LEU A 825 35.634 139.124 7.856 1.00 62.28 C ATOM 1089 O LEU A 825 34.808 139.453 6.960 1.00 59.54 O ATOM 1090 CB LEU A 825 36.056 140.593 9.928 1.00 74.04 C ATOM 1091 CG LEU A 825 36.012 141.938 9.201 1.00 77.56 C ATOM 1092 CD1 LEU A 825 36.226 143.052 10.212 1.00 77.77 C ATOM 1093 CD2 LEU A 825 37.068 142.039 8.104 1.00 77.02 C ATOM 1094 H LEU A 825 36.489 138.478 10.900 1.00 0.00 H ATOM 1095 N TRP A 826 36.810 138.555 7.592 1.00 60.59 N ATOM 1096 CA TRP A 826 37.312 138.275 6.224 1.00 58.94 C ATOM 1097 C TRP A 826 36.685 136.981 5.707 1.00 57.91 C ATOM 1098 O TRP A 826 36.435 136.904 4.495 1.00 60.76 O ATOM 1099 CB TRP A 826 38.843 138.206 6.191 1.00 62.20 C ATOM 1100 CG TRP A 826 39.553 139.529 6.215 1.00 62.93 C ATOM 1101 CD1 TRP A 826 40.215 140.088 7.276 1.00 62.71 C ATOM 1102 CD2 TRP A 826 39.709 140.446 5.113 1.00 61.54 C ATOM 1103 NE1 TRP A 826 40.744 141.294 6.924 1.00 63.32 N ATOM 1104 CE2 TRP A 826 40.451 141.542 5.606 1.00 63.39 C ATOM 1105 CE3 TRP A 826 39.277 140.467 3.780 1.00 59.44 C ATOM 1106 CZ2 TRP A 826 40.805 142.620 4.798 1.00 61.87 C ATOM 1107 CZ3 TRP A 826 39.621 141.541 2.990 1.00 59.29 C ATOM 1108 CH2 TRP A 826 40.381 142.598 3.491 1.00 61.10 C ATOM 1109 HE1 TRP A 826 41.282 141.924 7.552 1.00 0.00 H ATOM 1110 H TRP A 826 37.414 138.290 8.396 1.00 0.00 H ATOM 1111 N ARG A 827 36.438 136.003 6.579 1.00 56.70 N ATOM 1112 CA ARG A 827 35.677 134.794 6.190 1.00 55.22 C ATOM 1113 C ARG A 827 34.273 135.230 5.752 1.00 55.21 C ATOM 1114 O ARG A 827 33.887 134.902 4.622 1.00 55.27 O ATOM 1115 CB ARG A 827 35.618 133.769 7.319 1.00 54.83 C ATOM 1116 CG ARG A 827 34.958 132.464 6.899 1.00 53.17 C ATOM 1117 CD ARG A 827 35.000 131.395 7.977 1.00 56.03 C ATOM 1118 NE ARG A 827 34.279 131.790 9.183 1.00 56.18 N ATOM 1119 CZ ARG A 827 32.951 131.788 9.334 1.00 54.74 C ATOM 1120 NH1 ARG A 827 32.155 131.400 8.358 1.00 52.25 N ATOM 1121 NH2 ARG A 827 32.417 132.156 10.484 1.00 59.37 N ATOM 1122 HE ARG A 827 34.848 132.100 9.996 1.00 0.00 H ATOM 1123 HH12 ARG A 827 31.124 131.405 8.495 1.00 0.00 H ATOM 1124 HH11 ARG A 827 32.558 131.088 7.451 1.00 0.00 H ATOM 1125 HH22 ARG A 827 31.384 132.155 10.602 1.00 0.00 H ATOM 1126 HH21 ARG A 827 33.030 132.447 11.272 1.00 0.00 H ATOM 1127 H ARG A 827 36.788 136.091 7.554 1.00 0.00 H ATOM 1128 N LEU A 828 33.548 135.985 6.577 1.00 54.63 N ATOM 1129 CA LEU A 828 32.147 136.382 6.269 1.00 52.19 C ATOM 1130 C LEU A 828 32.110 137.190 4.968 1.00 51.52 C ATOM 1131 O LEU A 828 31.229 136.932 4.184 1.00 52.88 O ATOM 1132 CB LEU A 828 31.558 137.178 7.434 1.00 52.39 C ATOM 1133 CG LEU A 828 31.466 136.422 8.756 1.00 54.57 C ATOM 1134 CD1 LEU A 828 30.830 137.298 9.822 1.00 55.47 C ATOM 1135 CD2 LEU A 828 30.712 135.102 8.600 1.00 52.78 C ATOM 1136 H LEU A 828 33.976 136.308 7.468 1.00 0.00 H ATOM 1137 N PHE A 829 33.057 138.102 4.737 1.00 55.35 N ATOM 1138 CA PHE A 829 33.198 138.885 3.474 1.00 54.92 C ATOM 1139 C PHE A 829 33.330 137.940 2.260 1.00 57.02 C ATOM 1140 O PHE A 829 32.517 138.018 1.312 1.00 49.82 O ATOM 1141 CB PHE A 829 34.402 139.822 3.586 1.00 57.08 C ATOM 1142 CG PHE A 829 34.648 140.684 2.379 1.00 55.36 C ATOM 1143 CD1 PHE A 829 33.696 141.595 1.964 1.00 54.76 C ATOM 1144 CD2 PHE A 829 35.842 140.605 1.675 1.00 59.82 C ATOM 1145 CE1 PHE A 829 33.924 142.400 0.857 1.00 57.13 C ATOM 1146 CE2 PHE A 829 36.060 141.400 0.555 1.00 59.33 C ATOM 1147 CZ PHE A 829 35.100 142.300 0.151 1.00 57.34 C ATOM 1148 H PHE A 829 33.748 138.280 5.493 1.00 0.00 H ATOM 1149 N ARG A 830 34.321 137.041 2.302 1.00 60.43 N ATOM 1150 CA ARG A 830 34.600 136.013 1.264 1.00 59.21 C ATOM 1151 C ARG A 830 33.342 135.168 1.031 1.00 56.09 C ATOM 1152 O ARG A 830 33.098 134.797 -0.126 1.00 60.93 O ATOM 1153 CB ARG A 830 35.810 135.166 1.676 1.00 62.31 C ATOM 1154 CG ARG A 830 36.033 133.923 0.829 1.00 68.05 C ATOM 1155 CD ARG A 830 37.226 133.127 1.309 1.00 75.24 C ATOM 1156 NE ARG A 830 38.433 133.945 1.360 1.00 80.97 N ATOM 1157 CZ ARG A 830 39.186 134.269 0.307 1.00 82.39 C ATOM 1158 NH1 ARG A 830 38.852 133.860 -0.913 1.00 76.15 N ATOM 1159 NH2 ARG A 830 40.273 135.008 0.488 1.00 80.44 N ATOM 1160 HE ARG A 830 38.730 134.304 2.290 1.00 0.00 H ATOM 1161 HH12 ARG A 830 39.445 134.117 -1.728 1.00 0.00 H ATOM 1162 HH11 ARG A 830 37.998 133.283 -1.052 1.00 0.00 H ATOM 1163 HH22 ARG A 830 40.867 135.267 -0.325 1.00 0.00 H ATOM 1164 HH21 ARG A 830 40.531 135.329 1.443 1.00 0.00 H ATOM 1165 H ARG A 830 34.949 137.063 3.131 1.00 0.00 H ATOM 1166 N GLU A 831 32.558 134.890 2.070 1.00 52.64 N ATOM 1167 CA GLU A 831 31.302 134.107 1.928 1.00 49.28 C ATOM 1168 C GLU A 831 30.242 134.960 1.236 1.00 47.22 C ATOM 1169 O GLU A 831 29.529 134.385 0.395 1.00 45.48 O ATOM 1170 CB GLU A 831 30.806 133.585 3.270 1.00 50.33 C ATOM 1171 CG GLU A 831 31.606 132.394 3.761 1.00 51.20 C ATOM 1172 CD GLU A 831 31.298 131.958 5.179 1.00 53.96 C ATOM 1173 OE1 GLU A 831 30.298 132.432 5.751 1.00 53.46 O ATOM 1174 OE2 GLU A 831 32.060 131.150 5.706 1.00 57.52 O ATOM 1175 H GLU A 831 32.833 135.232 3.013 1.00 0.00 H ATOM 1176 N ILE A 832 30.157 136.269 1.520 1.00 44.77 N ATOM 1177 CA ILE A 832 29.215 137.153 0.769 1.00 45.70 C ATOM 1178 C ILE A 832 29.655 137.120 -0.707 1.00 46.17 C ATOM 1179 O ILE A 832 28.812 136.822 -1.564 1.00 44.60 O ATOM 1180 CB ILE A 832 29.099 138.581 1.359 1.00 48.03 C ATOM 1181 CG1 ILE A 832 28.593 138.566 2.811 1.00 47.64 C ATOM 1182 CG2 ILE A 832 28.195 139.449 0.472 1.00 47.24 C ATOM 1183 CD1 ILE A 832 28.919 139.812 3.624 1.00 48.56 C ATOM 1184 H ILE A 832 30.753 136.672 2.271 1.00 0.00 H ATOM 1185 N LEU A 833 30.949 137.300 -0.981 1.00 46.69 N ATOM 1186 CA LEU A 833 31.500 137.301 -2.359 1.00 47.99 C ATOM 1187 C LEU A 833 31.188 135.978 -3.060 1.00 48.07 C ATOM 1188 O LEU A 833 30.784 136.034 -4.232 1.00 51.49 O ATOM 1189 CB LEU A 833 33.006 137.564 -2.330 1.00 50.92 C ATOM 1190 CG LEU A 833 33.390 139.035 -2.462 1.00 52.08 C ATOM 1191 CD1 LEU A 833 34.877 139.225 -2.240 1.00 55.33 C ATOM 1192 CD2 LEU A 833 32.989 139.582 -3.822 1.00 51.08 C ATOM 1193 H LEU A 833 31.605 137.447 -0.188 1.00 0.00 H ATOM 1194 N ASP A 834 31.343 134.834 -2.400 1.00 45.61 N ATOM 1195 CA ASP A 834 31.075 133.536 -3.069 1.00 44.37 C ATOM 1196 C ASP A 834 29.595 133.476 -3.464 1.00 43.28 C ATOM 1197 O ASP A 834 29.278 132.897 -4.512 1.00 43.39 O ATOM 1198 CB ASP A 834 31.509 132.357 -2.202 1.00 44.23 C ATOM 1199 CG ASP A 834 33.015 132.200 -2.063 1.00 48.53 C ATOM 1200 OD1 ASP A 834 33.772 132.804 -2.867 1.00 49.36 O ATOM 1201 OD2 ASP A 834 33.425 131.481 -1.130 1.00 56.84 O ATOM 1202 H ASP A 834 31.654 134.849 -1.408 1.00 0.00 H ATOM 1203 N GLY A 835 28.715 134.081 -2.674 1.00 44.81 N ATOM 1204 CA GLY A 835 27.268 134.083 -2.948 1.00 45.20 C ATOM 1205 C GLY A 835 26.930 135.039 -4.079 1.00 47.97 C ATOM 1206 O GLY A 835 26.049 134.700 -4.903 1.00 47.29 O ATOM 1207 H GLY A 835 29.062 134.574 -1.827 1.00 0.00 H ATOM 1208 N LEU A 836 27.603 136.194 -4.129 1.00 45.44 N ATOM 1209 CA LEU A 836 27.450 137.165 -5.239 1.00 44.63 C ATOM 1210 C LEU A 836 27.918 136.538 -6.557 1.00 45.32 C ATOM 1211 O LEU A 836 27.220 136.683 -7.570 1.00 47.77 O ATOM 1212 CB LEU A 836 28.246 138.429 -4.917 1.00 44.46 C ATOM 1213 CG LEU A 836 27.509 139.470 -4.086 1.00 45.89 C ATOM 1214 CD1 LEU A 836 28.183 140.814 -4.248 1.00 49.74 C ATOM 1215 CD2 LEU A 836 26.030 139.584 -4.457 1.00 45.84 C ATOM 1216 H LEU A 836 28.261 136.420 -3.357 1.00 0.00 H ATOM 1217 N ALA A 837 29.073 135.878 -6.566 1.00 43.57 N ATOM 1218 CA ALA A 837 29.674 135.336 -7.798 1.00 40.12 C ATOM 1219 C ALA A 837 28.744 134.265 -8.370 1.00 39.99 C ATOM 1220 O ALA A 837 28.497 134.288 -9.622 1.00 41.13 O ATOM 1221 CB ALA A 837 31.055 134.830 -7.505 1.00 40.92 C ATOM 1222 H ALA A 837 29.573 135.738 -5.665 1.00 0.00 H ATOM 1223 N TYR A 838 28.217 133.383 -7.513 1.00 36.75 N ATOM 1224 CA TYR A 838 27.276 132.313 -7.945 1.00 36.94 C ATOM 1225 C TYR A 838 26.058 132.924 -8.629 1.00 40.96 C ATOM 1226 O TYR A 838 25.799 132.519 -9.758 1.00 51.74 O ATOM 1227 CB TYR A 838 26.769 131.455 -6.797 1.00 34.57 C ATOM 1228 CG TYR A 838 25.801 130.367 -7.172 1.00 32.49 C ATOM 1229 CD1 TYR A 838 26.249 129.118 -7.554 1.00 33.53 C ATOM 1230 CD2 TYR A 838 24.436 130.556 -7.077 1.00 33.21 C ATOM 1231 CE1 TYR A 838 25.372 128.082 -7.821 1.00 32.88 C ATOM 1232 CE2 TYR A 838 23.538 129.535 -7.349 1.00 33.09 C ATOM 1233 CZ TYR A 838 24.008 128.293 -7.734 1.00 33.79 C ATOM 1234 OH TYR A 838 23.132 127.284 -8.038 1.00 36.61 O ATOM 1235 HH TYR A 838 23.640 126.473 -8.291 1.00 0.00 H ATOM 1236 H TYR A 838 28.474 133.447 -6.507 1.00 0.00 H ATOM 1237 N ILE A 839 25.340 133.856 -7.991 1.00 40.45 N ATOM 1238 CA ILE A 839 24.102 134.421 -8.596 1.00 41.10 C ATOM 1239 C ILE A 839 24.447 135.285 -9.825 1.00 42.91 C ATOM 1240 O ILE A 839 23.670 135.253 -10.791 1.00 39.61 O ATOM 1241 CB ILE A 839 23.238 135.141 -7.554 1.00 45.17 C ATOM 1242 CG1 ILE A 839 23.741 136.521 -7.151 1.00 48.08 C ATOM 1243 CG2 ILE A 839 23.058 134.245 -6.343 1.00 52.84 C ATOM 1244 CD1 ILE A 839 22.998 137.083 -5.935 1.00 50.91 C ATOM 1245 H ILE A 839 25.652 134.191 -7.057 1.00 0.00 H ATOM 1246 N HIS A 840 25.592 135.971 -9.840 1.00 42.89 N ATOM 1247 CA HIS A 840 26.070 136.753 -11.015 1.00 44.58 C ATOM 1248 C HIS A 840 26.359 135.796 -12.193 1.00 48.91 C ATOM 1249 O HIS A 840 25.975 136.141 -13.331 1.00 51.65 O ATOM 1250 CB HIS A 840 27.245 137.652 -10.609 1.00 43.32 C ATOM 1251 CG HIS A 840 26.854 138.806 -9.748 1.00 44.66 C ATOM 1252 ND1 HIS A 840 27.759 139.782 -9.375 1.00 45.29 N ATOM 1253 CD2 HIS A 840 25.669 139.155 -9.189 1.00 44.37 C ATOM 1254 CE1 HIS A 840 27.149 140.670 -8.609 1.00 45.77 C ATOM 1255 NE2 HIS A 840 25.881 140.302 -8.467 1.00 46.70 N ATOM 1256 H HIS A 840 26.183 135.959 -8.984 1.00 0.00 H ATOM 1257 N GLU A 841 26.961 134.622 -11.942 1.00 47.80 N ATOM 1258 CA GLU A 841 27.256 133.598 -12.982 1.00 48.18 C ATOM 1259 C GLU A 841 25.936 133.075 -13.561 1.00 45.63 C ATOM 1260 O GLU A 841 25.945 132.663 -14.715 1.00 54.83 O ATOM 1261 CB GLU A 841 28.146 132.492 -12.399 1.00 53.26 C ATOM 1262 CG GLU A 841 28.436 131.329 -13.330 1.00 58.97 C ATOM 1263 CD GLU A 841 27.459 130.153 -13.276 1.00 69.26 C ATOM 1264 OE1 GLU A 841 26.729 129.997 -12.254 1.00 80.12 O ATOM 1265 OE2 GLU A 841 27.422 129.384 -14.259 1.00 72.90 O ATOM 1266 H GLU A 841 27.238 134.415 -10.961 1.00 0.00 H ATOM 1267 N LYS A 842 24.837 133.135 -12.812 1.00 45.30 N ATOM 1268 CA LYS A 842 23.492 132.667 -13.241 1.00 44.92 C ATOM 1269 C LYS A 842 22.726 133.807 -13.926 1.00 42.84 C ATOM 1270 O LYS A 842 21.573 133.548 -14.362 1.00 39.55 O ATOM 1271 CB LYS A 842 22.684 132.169 -12.045 1.00 46.10 C ATOM 1272 CG LYS A 842 23.288 130.974 -11.334 1.00 55.10 C ATOM 1273 CD LYS A 842 23.029 129.644 -12.022 1.00 63.65 C ATOM 1274 CE LYS A 842 22.037 128.752 -11.297 1.00 60.98 C ATOM 1275 NZ LYS A 842 21.218 127.976 -12.260 1.00 65.79 N ATOM 1276 HZ1 LYS A 842 20.692 128.631 -12.873 1.00 0.00 H ATOM 1277 HZ2 LYS A 842 21.841 127.380 -12.841 1.00 0.00 H ATOM 1278 HZ3 LYS A 842 20.549 127.375 -11.738 1.00 0.00 H ATOM 1279 H LYS A 842 24.925 133.538 -11.858 1.00 0.00 H ATOM 1280 N GLY A 843 23.321 135.006 -14.004 1.00 41.70 N ATOM 1281 CA GLY A 843 22.799 136.146 -14.793 1.00 44.46 C ATOM 1282 C GLY A 843 22.114 137.219 -13.949 1.00 42.58 C ATOM 1283 O GLY A 843 21.732 138.265 -14.501 1.00 38.84 O ATOM 1284 H GLY A 843 24.206 135.145 -13.476 1.00 0.00 H ATOM 1285 N MET A 844 21.980 136.983 -12.647 1.00 43.54 N ATOM 1286 CA MET A 844 21.075 137.749 -11.768 1.00 46.08 C ATOM 1287 C MET A 844 21.761 139.031 -11.304 1.00 48.42 C ATOM 1288 O MET A 844 23.004 139.109 -11.388 1.00 49.59 O ATOM 1289 CB MET A 844 20.684 136.893 -10.573 1.00 50.01 C ATOM 1290 CG MET A 844 19.919 135.650 -11.006 1.00 57.82 C ATOM 1291 SD MET A 844 19.800 134.422 -9.683 1.00 64.42 S ATOM 1292 CE MET A 844 19.201 135.496 -8.373 1.00 57.90 C ATOM 1293 H MET A 844 22.543 136.217 -12.225 1.00 0.00 H ATOM 1294 N ILE A 845 20.958 140.014 -10.897 1.00 49.97 N ATOM 1295 CA ILE A 845 21.399 141.148 -10.035 1.00 50.54 C ATOM 1296 C ILE A 845 20.517 141.149 -8.782 1.00 52.65 C ATOM 1297 O ILE A 845 19.281 141.044 -8.967 1.00 55.12 O ATOM 1298 CB ILE A 845 21.342 142.485 -10.790 1.00 49.88 C ATOM 1299 CG1 ILE A 845 21.813 142.359 -12.249 1.00 50.44 C ATOM 1300 CG2 ILE A 845 22.137 143.516 -10.012 1.00 48.33 C ATOM 1301 CD1 ILE A 845 21.804 143.664 -13.031 1.00 47.75 C ATOM 1302 H ILE A 845 19.963 139.989 -11.199 1.00 0.00 H ATOM 1303 N HIS A 846 21.128 141.201 -7.583 1.00 48.47 N ATOM 1304 CA HIS A 846 20.427 141.303 -6.274 1.00 45.21 C ATOM 1305 C HIS A 846 19.619 142.610 -6.199 1.00 42.68 C ATOM 1306 O HIS A 846 18.409 142.529 -5.942 1.00 37.39 O ATOM 1307 CB HIS A 846 21.428 141.205 -5.127 1.00 46.97 C ATOM 1308 CG HIS A 846 20.776 140.987 -3.802 1.00 50.48 C ATOM 1309 ND1 HIS A 846 19.980 141.941 -3.209 1.00 48.61 N ATOM 1310 CD2 HIS A 846 20.814 139.933 -2.949 1.00 49.13 C ATOM 1311 CE1 HIS A 846 19.538 141.477 -2.054 1.00 55.22 C ATOM 1312 NE2 HIS A 846 20.042 140.232 -1.866 1.00 48.60 N ATOM 1313 H HIS A 846 22.167 141.167 -7.571 1.00 0.00 H ATOM 1314 N ARG A 847 20.276 143.760 -6.415 1.00 45.67 N ATOM 1315 CA ARG A 847 19.689 145.137 -6.481 1.00 51.17 C ATOM 1316 C ARG A 847 19.483 145.716 -5.079 1.00 51.54 C ATOM 1317 O ARG A 847 19.267 146.915 -4.977 1.00 54.21 O ATOM 1318 CB ARG A 847 18.340 145.175 -7.215 1.00 55.99 C ATOM 1319 CG ARG A 847 18.429 145.145 -8.738 1.00 60.49 C ATOM 1320 CD ARG A 847 17.189 144.582 -9.401 1.00 65.77 C ATOM 1321 NE ARG A 847 16.806 143.288 -8.823 1.00 70.89 N ATOM 1322 CZ ARG A 847 15.600 142.979 -8.324 1.00 72.54 C ATOM 1323 NH1 ARG A 847 14.612 143.865 -8.323 1.00 76.68 N ATOM 1324 NH2 ARG A 847 15.377 141.766 -7.844 1.00 69.16 N ATOM 1325 HE ARG A 847 17.534 142.546 -8.798 1.00 0.00 H ATOM 1326 HH12 ARG A 847 13.683 143.608 -7.932 1.00 0.00 H ATOM 1327 HH11 ARG A 847 14.766 144.817 -8.713 1.00 0.00 H ATOM 1328 HH22 ARG A 847 14.443 141.524 -7.456 1.00 0.00 H ATOM 1329 HH21 ARG A 847 16.136 141.055 -7.854 1.00 0.00 H ATOM 1330 H ARG A 847 21.304 143.688 -6.551 1.00 0.00 H ATOM 1331 N ASN A 848 19.524 144.892 -4.043 1.00 53.97 N ATOM 1332 CA ASN A 848 18.989 145.239 -2.702 1.00 61.69 C ATOM 1333 C ASN A 848 19.883 144.639 -1.604 1.00 60.50 C ATOM 1334 O ASN A 848 19.357 144.309 -0.523 1.00 63.14 O ATOM 1335 CB ASN A 848 17.540 144.756 -2.566 1.00 66.92 C ATOM 1336 CG ASN A 848 16.792 145.461 -1.455 1.00 71.99 C ATOM 1337 OD1 ASN A 848 16.966 146.664 -1.237 1.00 73.52 O ATOM 1338 ND2 ASN A 848 15.958 144.714 -0.746 1.00 72.28 N ATOM 1339 HD22 ASN A 848 15.846 143.704 -0.969 1.00 0.00 H ATOM 1340 HD21 ASN A 848 15.415 145.137 0.033 1.00 0.00 H ATOM 1341 H ASN A 848 19.953 143.954 -4.175 1.00 0.00 H ATOM 1342 N LEU A 849 21.180 144.474 -1.867 1.00 53.24 N ATOM 1343 CA LEU A 849 22.130 143.916 -0.880 1.00 51.64 C ATOM 1344 C LEU A 849 22.301 144.948 0.227 1.00 54.90 C ATOM 1345 O LEU A 849 22.585 146.115 -0.133 1.00 62.74 O ATOM 1346 CB LEU A 849 23.474 143.623 -1.544 1.00 52.74 C ATOM 1347 CG LEU A 849 24.356 142.633 -0.788 1.00 52.52 C ATOM 1348 CD1 LEU A 849 23.789 141.225 -0.906 1.00 49.84 C ATOM 1349 CD2 LEU A 849 25.789 142.695 -1.302 1.00 52.80 C ATOM 1350 H LEU A 849 21.538 144.749 -2.804 1.00 0.00 H ATOM 1351 N LYS A 850 22.108 144.529 1.485 1.00 54.08 N ATOM 1352 CA LYS A 850 22.280 145.358 2.714 1.00 55.06 C ATOM 1353 C LYS A 850 22.252 144.451 3.952 1.00 54.04 C ATOM 1354 O LYS A 850 21.805 143.300 3.891 1.00 48.41 O ATOM 1355 CB LYS A 850 21.240 146.486 2.751 1.00 59.54 C ATOM 1356 CG LYS A 850 19.796 146.029 2.656 1.00 61.63 C ATOM 1357 CD LYS A 850 18.809 147.076 2.249 1.00 63.35 C ATOM 1358 CE LYS A 850 17.434 146.449 2.147 1.00 64.76 C ATOM 1359 NZ LYS A 850 16.352 147.426 2.411 1.00 70.93 N ATOM 1360 HZ1 LYS A 850 16.461 147.812 3.371 1.00 0.00 H ATOM 1361 HZ2 LYS A 850 16.407 148.199 1.717 1.00 0.00 H ATOM 1362 HZ3 LYS A 850 15.430 146.951 2.330 1.00 0.00 H ATOM 1363 H LYS A 850 21.813 143.540 1.616 1.00 0.00 H ATOM 1364 N PRO A 851 22.806 144.920 5.094 1.00 50.98 N ATOM 1365 CA PRO A 851 23.034 144.068 6.259 1.00 50.38 C ATOM 1366 C PRO A 851 21.831 143.296 6.836 1.00 50.85 C ATOM 1367 O PRO A 851 22.056 142.245 7.356 1.00 47.09 O ATOM 1368 CB PRO A 851 23.570 145.068 7.282 1.00 53.05 C ATOM 1369 CG PRO A 851 24.294 146.084 6.449 1.00 54.13 C ATOM 1370 CD PRO A 851 23.355 146.270 5.284 1.00 54.77 C ATOM 1371 N VAL A 852 20.595 143.795 6.722 1.00 52.73 N ATOM 1372 CA VAL A 852 19.363 143.090 7.208 1.00 51.99 C ATOM 1373 C VAL A 852 18.940 141.958 6.245 1.00 52.45 C ATOM 1374 O VAL A 852 18.045 141.197 6.628 1.00 54.17 O ATOM 1375 CB VAL A 852 18.197 144.073 7.443 1.00 52.94 C ATOM 1376 CG1 VAL A 852 18.512 145.078 8.539 1.00 56.55 C ATOM 1377 CG2 VAL A 852 17.749 144.796 6.182 1.00 51.43 C ATOM 1378 H VAL A 852 20.482 144.725 6.271 1.00 0.00 H ATOM 1379 N ASN A 853 19.497 141.879 5.033 1.00 50.90 N ATOM 1380 CA ASN A 853 19.144 140.872 3.994 1.00 53.46 C ATOM 1381 C ASN A 853 20.252 139.820 3.877 1.00 56.43 C ATOM 1382 O ASN A 853 20.204 138.996 2.931 1.00 59.77 O ATOM 1383 CB ASN A 853 18.937 141.508 2.619 1.00 58.18 C ATOM 1384 CG ASN A 853 17.574 142.147 2.476 1.00 66.95 C ATOM 1385 OD1 ASN A 853 16.587 141.688 3.040 1.00 67.20 O ATOM 1386 ND2 ASN A 853 17.512 143.223 1.721 1.00 75.32 N ATOM 1387 HD22 ASN A 853 18.371 143.584 1.258 1.00 0.00 H ATOM 1388 HD21 ASN A 853 16.604 143.713 1.587 1.00 0.00 H ATOM 1389 H ASN A 853 20.234 142.574 4.797 1.00 0.00 H ATOM 1390 N ILE A 854 21.240 139.878 4.769 1.00 54.35 N ATOM 1391 CA ILE A 854 22.299 138.842 4.893 1.00 49.21 C ATOM 1392 C ILE A 854 22.080 138.176 6.238 1.00 46.96 C ATOM 1393 O ILE A 854 21.740 138.876 7.193 1.00 48.20 O ATOM 1394 CB ILE A 854 23.697 139.468 4.776 1.00 53.37 C ATOM 1395 CG1 ILE A 854 23.882 140.094 3.389 1.00 54.63 C ATOM 1396 CG2 ILE A 854 24.772 138.439 5.103 1.00 52.64 C ATOM 1397 CD1 ILE A 854 25.058 141.031 3.280 1.00 58.14 C ATOM 1398 H ILE A 854 21.272 140.693 5.414 1.00 0.00 H ATOM 1399 N PHE A 855 22.215 136.861 6.286 1.00 47.89 N ATOM 1400 CA PHE A 855 21.789 136.035 7.449 1.00 48.05 C ATOM 1401 C PHE A 855 22.977 135.149 7.841 1.00 48.12 C ATOM 1402 O PHE A 855 23.809 134.845 6.955 1.00 47.36 O ATOM 1403 CB PHE A 855 20.492 135.278 7.110 1.00 42.85 C ATOM 1404 CG PHE A 855 19.333 136.178 6.747 1.00 39.48 C ATOM 1405 CD1 PHE A 855 18.615 136.837 7.727 1.00 40.34 C ATOM 1406 CD2 PHE A 855 18.990 136.412 5.423 1.00 41.19 C ATOM 1407 CE1 PHE A 855 17.567 137.680 7.404 1.00 40.85 C ATOM 1408 CE2 PHE A 855 17.956 137.274 5.097 1.00 40.96 C ATOM 1409 CZ PHE A 855 17.242 137.908 6.092 1.00 41.35 C ATOM 1410 H PHE A 855 22.641 136.379 5.469 1.00 0.00 H ATOM 1411 N LEU A 856 23.083 134.818 9.129 1.00 51.11 N ATOM 1412 CA LEU A 856 24.051 133.809 9.642 1.00 52.46 C ATOM 1413 C LEU A 856 23.272 132.638 10.238 1.00 51.78 C ATOM 1414 O LEU A 856 22.305 132.896 10.991 1.00 52.97 O ATOM 1415 CB LEU A 856 24.987 134.461 10.652 1.00 51.50 C ATOM 1416 CG LEU A 856 25.832 135.573 10.047 1.00 53.70 C ATOM 1417 CD1 LEU A 856 26.616 136.298 11.128 1.00 55.57 C ATOM 1418 CD2 LEU A 856 26.753 135.011 8.977 1.00 53.09 C ATOM 1419 H LEU A 856 22.456 135.290 9.812 1.00 0.00 H ATOM 1420 N ASP A 857 23.642 131.421 9.818 1.00 49.16 N ATOM 1421 CA ASP A 857 23.025 130.138 10.227 1.00 52.24 C ATOM 1422 C ASP A 857 23.664 129.698 11.560 1.00 55.19 C ATOM 1423 O ASP A 857 24.528 130.433 12.102 1.00 53.52 O ATOM 1424 CB ASP A 857 23.118 129.118 9.081 1.00 50.90 C ATOM 1425 CG ASP A 857 24.498 128.540 8.781 1.00 52.25 C ATOM 1426 OD1 ASP A 857 25.465 128.869 9.496 1.00 50.47 O ATOM 1427 OD2 ASP A 857 24.611 127.765 7.809 1.00 54.63 O ATOM 1428 H ASP A 857 24.433 131.373 9.145 1.00 0.00 H ATOM 1429 N SER A 858 23.266 128.533 12.073 1.00 60.20 N ATOM 1430 CA SER A 858 23.711 128.006 13.396 1.00 61.22 C ATOM 1431 C SER A 858 25.187 127.567 13.373 1.00 60.94 C ATOM 1432 O SER A 858 25.696 127.249 14.471 1.00 73.32 O ATOM 1433 CB SER A 858 22.793 126.907 13.897 1.00 60.22 C ATOM 1434 OG SER A 858 22.784 125.796 13.017 1.00 58.01 O ATOM 1435 HG SER A 858 22.177 125.100 13.373 1.00 0.00 H ATOM 1436 H SER A 858 22.604 127.956 11.516 1.00 0.00 H ATOM 1437 N ASP A 859 25.867 127.594 12.214 1.00 58.37 N ATOM 1438 CA ASP A 859 27.329 127.314 12.073 1.00 59.43 C ATOM 1439 C ASP A 859 28.095 128.604 11.717 1.00 57.17 C ATOM 1440 O ASP A 859 29.317 128.522 11.446 1.00 57.96 O ATOM 1441 CB ASP A 859 27.589 126.197 11.054 1.00 62.55 C ATOM 1442 CG ASP A 859 27.250 124.798 11.563 1.00 68.17 C ATOM 1443 OD1 ASP A 859 27.788 124.393 12.634 1.00 70.86 O ATOM 1444 OD2 ASP A 859 26.445 124.116 10.895 1.00 70.70 O ATOM 1445 H ASP A 859 25.336 127.827 11.350 1.00 0.00 H ATOM 1446 N ASP A 860 27.411 129.752 11.739 1.00 54.66 N ATOM 1447 CA ASP A 860 27.992 131.106 11.545 1.00 54.58 C ATOM 1448 C ASP A 860 28.376 131.326 10.077 1.00 52.38 C ATOM 1449 O ASP A 860 29.334 132.100 9.848 1.00 53.72 O ATOM 1450 CB ASP A 860 29.209 131.340 12.448 1.00 55.93 C ATOM 1451 CG ASP A 860 29.466 132.830 12.736 1.00 55.04 C ATOM 1452 OD1 ASP A 860 28.549 133.465 13.231 1.00 54.43 O ATOM 1453 OD2 ASP A 860 30.567 133.343 12.404 1.00 55.81 O ATOM 1454 H ASP A 860 26.386 129.693 11.906 1.00 0.00 H ATOM 1455 N HIS A 861 27.684 130.692 9.124 1.00 48.08 N ATOM 1456 CA HIS A 861 27.911 130.911 7.671 1.00 47.66 C ATOM 1457 C HIS A 861 26.923 131.946 7.141 1.00 47.54 C ATOM 1458 O HIS A 861 25.765 131.952 7.594 1.00 52.28 O ATOM 1459 CB HIS A 861 27.826 129.617 6.874 1.00 46.04 C ATOM 1460 CG HIS A 861 29.010 128.770 7.112 1.00 48.71 C ATOM 1461 ND1 HIS A 861 30.269 129.251 6.879 1.00 51.67 N ATOM 1462 CD2 HIS A 861 29.142 127.527 7.622 1.00 48.98 C ATOM 1463 CE1 HIS A 861 31.152 128.321 7.208 1.00 53.94 C ATOM 1464 NE2 HIS A 861 30.485 127.261 7.670 1.00 52.09 N ATOM 1465 H HIS A 861 26.952 130.013 9.413 1.00 0.00 H ATOM 1466 N VAL A 862 27.398 132.779 6.217 1.00 44.90 N ATOM 1467 CA VAL A 862 26.596 133.793 5.475 1.00 42.85 C ATOM 1468 C VAL A 862 25.598 133.057 4.581 1.00 39.23 C ATOM 1469 O VAL A 862 25.978 132.025 3.998 1.00 37.30 O ATOM 1470 CB VAL A 862 27.500 134.727 4.649 1.00 42.71 C ATOM 1471 CG1 VAL A 862 26.690 135.675 3.781 1.00 44.28 C ATOM 1472 CG2 VAL A 862 28.451 135.501 5.541 1.00 43.62 C ATOM 1473 H VAL A 862 28.412 132.717 5.995 1.00 0.00 H ATOM 1474 N LYS A 863 24.370 133.565 4.529 1.00 38.50 N ATOM 1475 CA LYS A 863 23.346 133.203 3.528 1.00 41.63 C ATOM 1476 C LYS A 863 22.677 134.503 3.077 1.00 42.14 C ATOM 1477 O LYS A 863 22.036 135.190 3.942 1.00 35.37 O ATOM 1478 CB LYS A 863 22.278 132.249 4.079 1.00 45.94 C ATOM 1479 CG LYS A 863 22.770 131.083 4.916 1.00 49.85 C ATOM 1480 CD LYS A 863 23.247 129.923 4.096 1.00 53.30 C ATOM 1481 CE LYS A 863 23.650 128.743 4.949 1.00 55.14 C ATOM 1482 NZ LYS A 863 23.426 127.480 4.218 1.00 57.73 N ATOM 1483 HZ1 LYS A 863 22.418 127.395 3.976 1.00 0.00 H ATOM 1484 HZ2 LYS A 863 23.995 127.479 3.347 1.00 0.00 H ATOM 1485 HZ3 LYS A 863 23.708 126.679 4.818 1.00 0.00 H ATOM 1486 H LYS A 863 24.111 134.271 5.248 1.00 0.00 H ATOM 1487 N ILE A 864 22.810 134.819 1.785 1.00 38.28 N ATOM 1488 CA ILE A 864 22.172 136.026 1.195 1.00 39.43 C ATOM 1489 C ILE A 864 20.684 135.738 0.965 1.00 39.36 C ATOM 1490 O ILE A 864 20.348 134.677 0.373 1.00 40.36 O ATOM 1491 CB ILE A 864 22.893 136.473 -0.096 1.00 39.75 C ATOM 1492 CG1 ILE A 864 24.379 136.755 0.158 1.00 39.02 C ATOM 1493 CG2 ILE A 864 22.193 137.683 -0.694 1.00 40.09 C ATOM 1494 CD1 ILE A 864 25.277 136.476 -1.003 1.00 37.78 C ATOM 1495 H ILE A 864 23.378 134.200 1.172 1.00 0.00 H ATOM 1496 N GLY A 865 19.834 136.678 1.383 1.00 43.03 N ATOM 1497 CA GLY A 865 18.392 136.696 1.076 1.00 42.59 C ATOM 1498 C GLY A 865 17.952 138.067 0.585 1.00 43.71 C ATOM 1499 O GLY A 865 18.838 138.918 0.323 1.00 42.46 O ATOM 1500 H GLY A 865 20.215 137.451 1.965 1.00 0.00 H ATOM 1501 N ASP A 866 16.627 138.243 0.441 1.00 48.39 N ATOM 1502 CA ASP A 866 15.984 139.527 0.045 1.00 54.65 C ATOM 1503 C ASP A 866 14.464 139.491 0.331 1.00 54.33 C ATOM 1504 O ASP A 866 13.772 138.516 -0.098 1.00 51.17 O ATOM 1505 CB ASP A 866 16.313 139.836 -1.416 1.00 56.98 C ATOM 1506 CG ASP A 866 15.768 141.168 -1.892 1.00 58.08 C ATOM 1507 OD1 ASP A 866 15.425 141.998 -1.033 1.00 58.83 O ATOM 1508 OD2 ASP A 866 15.672 141.345 -3.116 1.00 61.43 O ATOM 1509 H ASP A 866 16.008 137.426 0.618 1.00 0.00 H ATOM 1510 N PHE A 867 13.959 140.549 0.977 1.00 52.25 N ATOM 1511 CA PHE A 867 12.567 140.680 1.480 1.00 56.77 C ATOM 1512 C PHE A 867 11.674 141.340 0.405 1.00 55.66 C ATOM 1513 O PHE A 867 12.167 142.112 -0.457 1.00 54.96 O ATOM 1514 CB PHE A 867 12.567 141.470 2.802 1.00 59.94 C ATOM 1515 CG PHE A 867 12.986 140.775 4.089 1.00 57.14 C ATOM 1516 CD1 PHE A 867 13.679 139.567 4.100 1.00 56.92 C ATOM 1517 CD2 PHE A 867 12.727 141.380 5.321 1.00 58.80 C ATOM 1518 CE1 PHE A 867 14.063 138.970 5.301 1.00 56.69 C ATOM 1519 CE2 PHE A 867 13.112 140.783 6.518 1.00 58.59 C ATOM 1520 CZ PHE A 867 13.789 139.582 6.509 1.00 57.50 C ATOM 1521 H PHE A 867 14.599 141.352 1.142 1.00 0.00 H TER 1522 PHE A 867 ATOM 1523 N ALA A 904 19.215 153.796 4.116 1.00 75.33 N ATOM 1524 CA ALA A 904 18.890 152.602 3.292 1.00 74.88 C ATOM 1525 C ALA A 904 19.258 152.853 1.822 1.00 72.50 C ATOM 1526 O ALA A 904 19.697 151.870 1.142 1.00 73.34 O ATOM 1527 CB ALA A 904 17.432 152.233 3.443 1.00 74.81 C ATOM 1528 HN3 ALA A 904 18.677 154.614 3.766 1.00 0.00 H ATOM 1529 HN2 ALA A 904 20.234 153.995 4.049 1.00 0.00 H ATOM 1530 HN1 ALA A 904 18.961 153.611 5.107 1.00 0.00 H ATOM 1531 N ALA A 905 19.084 154.107 1.376 1.00 69.99 N ATOM 1532 CA ALA A 905 19.554 154.689 0.094 1.00 72.19 C ATOM 1533 C ALA A 905 21.090 154.695 0.034 1.00 71.74 C ATOM 1534 O ALA A 905 21.660 154.972 -1.054 1.00 66.61 O ATOM 1535 CB ALA A 905 19.013 156.101 -0.055 1.00 72.73 C ATOM 1536 H ALA A 905 18.557 154.747 2.004 1.00 0.00 H ATOM 1537 N LEU A 906 21.735 154.431 1.176 1.00 73.28 N ATOM 1538 CA LEU A 906 23.206 154.528 1.360 1.00 73.26 C ATOM 1539 C LEU A 906 23.914 153.267 0.844 1.00 72.91 C ATOM 1540 O LEU A 906 25.149 153.350 0.718 1.00 70.78 O ATOM 1541 CB LEU A 906 23.492 154.768 2.846 1.00 71.15 C ATOM 1542 CG LEU A 906 22.914 156.067 3.404 1.00 73.51 C ATOM 1543 CD1 LEU A 906 22.340 155.851 4.803 1.00 74.62 C ATOM 1544 CD2 LEU A 906 23.961 157.176 3.391 1.00 72.63 C ATOM 1545 H LEU A 906 21.165 154.136 1.995 1.00 0.00 H ATOM 1546 N TYR A 907 23.184 152.171 0.548 1.00 73.10 N ATOM 1547 CA TYR A 907 23.722 150.907 -0.045 1.00 68.05 C ATOM 1548 C TYR A 907 23.582 150.870 -1.582 1.00 64.37 C ATOM 1549 O TYR A 907 24.141 149.946 -2.220 1.00 63.31 O ATOM 1550 CB TYR A 907 23.034 149.703 0.596 1.00 66.30 C ATOM 1551 CG TYR A 907 23.315 149.605 2.068 1.00 64.71 C ATOM 1552 CD1 TYR A 907 24.562 149.215 2.529 1.00 61.83 C ATOM 1553 CD2 TYR A 907 22.356 149.965 3.002 1.00 70.31 C ATOM 1554 CE1 TYR A 907 24.833 149.148 3.887 1.00 62.61 C ATOM 1555 CE2 TYR A 907 22.620 149.921 4.364 1.00 65.90 C ATOM 1556 CZ TYR A 907 23.865 149.512 4.806 1.00 63.53 C ATOM 1557 OH TYR A 907 24.137 149.457 6.139 1.00 66.55 O ATOM 1558 HH TYR A 907 25.067 149.146 6.272 1.00 0.00 H ATOM 1559 H TYR A 907 22.164 152.208 0.748 1.00 0.00 H ATOM 1560 N VAL A 908 22.903 151.867 -2.158 1.00 63.03 N ATOM 1561 CA VAL A 908 22.492 151.907 -3.589 1.00 62.23 C ATOM 1562 C VAL A 908 23.519 152.721 -4.379 1.00 64.11 C ATOM 1563 O VAL A 908 23.816 153.862 -3.971 1.00 68.70 O ATOM 1564 CB VAL A 908 21.073 152.485 -3.748 1.00 62.52 C ATOM 1565 CG1 VAL A 908 20.777 152.807 -5.203 1.00 62.67 C ATOM 1566 CG2 VAL A 908 20.005 151.555 -3.184 1.00 61.94 C ATOM 1567 H VAL A 908 22.642 152.677 -1.561 1.00 0.00 H ATOM 1568 N SER A 909 24.033 152.138 -5.466 1.00 65.28 N ATOM 1569 CA SER A 909 24.949 152.776 -6.454 1.00 64.52 C ATOM 1570 C SER A 909 24.380 154.115 -6.933 1.00 62.89 C ATOM 1571 O SER A 909 23.187 154.245 -7.208 1.00 60.22 O ATOM 1572 CB SER A 909 25.183 151.850 -7.632 1.00 66.33 C ATOM 1573 OG SER A 909 26.419 151.151 -7.508 1.00 65.53 O ATOM 1574 HG SER A 909 26.541 150.557 -8.291 1.00 0.00 H ATOM 1575 H SER A 909 23.769 151.147 -5.639 1.00 0.00 H ATOM 1576 N PRO A 910 25.219 155.156 -7.085 1.00 64.23 N ATOM 1577 CA PRO A 910 24.771 156.406 -7.705 1.00 70.93 C ATOM 1578 C PRO A 910 24.032 156.273 -9.054 1.00 73.87 C ATOM 1579 O PRO A 910 23.205 157.125 -9.330 1.00 79.85 O ATOM 1580 CB PRO A 910 26.078 157.180 -7.937 1.00 69.70 C ATOM 1581 CG PRO A 910 27.040 156.635 -6.898 1.00 67.08 C ATOM 1582 CD PRO A 910 26.628 155.194 -6.660 1.00 62.86 C ATOM 1583 N GLU A 911 24.374 155.278 -9.877 1.00 68.63 N ATOM 1584 CA GLU A 911 23.852 155.122 -11.264 1.00 69.62 C ATOM 1585 C GLU A 911 22.364 154.693 -11.253 1.00 66.53 C ATOM 1586 O GLU A 911 21.779 154.375 -10.148 1.00 61.83 O ATOM 1587 CB GLU A 911 24.802 154.165 -11.999 1.00 72.59 C ATOM 1588 CG GLU A 911 24.874 152.768 -11.370 1.00 78.43 C ATOM 1589 CD GLU A 911 26.232 152.251 -10.884 1.00 79.48 C ATOM 1590 OE1 GLU A 911 26.645 151.170 -11.345 1.00 83.38 O ATOM 1591 OE2 GLU A 911 26.871 152.911 -10.026 1.00 76.44 O ATOM 1592 H GLU A 911 25.048 154.567 -9.527 1.00 0.00 H TER 1593 GLU A 911 ATOM 1594 N TYR A 920 21.440 149.253 -16.606 1.00 99.39 N ATOM 1595 CA TYR A 920 22.507 149.092 -15.581 1.00 94.08 C ATOM 1596 C TYR A 920 22.817 147.600 -15.364 1.00 86.41 C ATOM 1597 O TYR A 920 22.203 146.741 -16.048 1.00 78.20 O ATOM 1598 CB TYR A 920 22.123 149.813 -14.287 1.00 91.77 C ATOM 1599 CG TYR A 920 20.971 149.198 -13.532 1.00 94.10 C ATOM 1600 CD1 TYR A 920 21.170 148.129 -12.678 1.00 88.05 C ATOM 1601 CD2 TYR A 920 19.681 149.700 -13.647 1.00102.18 C ATOM 1602 CE1 TYR A 920 20.126 147.562 -11.970 1.00 91.66 C ATOM 1603 CE2 TYR A 920 18.623 149.146 -12.943 1.00 98.88 C ATOM 1604 CZ TYR A 920 18.848 148.071 -12.102 1.00 97.09 C ATOM 1605 OH TYR A 920 17.827 147.508 -11.391 1.00105.87 O ATOM 1606 HH TYR A 920 18.178 146.757 -10.850 1.00 0.00 H ATOM 1607 HN3 TYR A 920 20.577 148.769 -16.285 1.00 0.00 H ATOM 1608 HN2 TYR A 920 21.759 148.837 -17.504 1.00 0.00 H ATOM 1609 HN1 TYR A 920 21.241 150.265 -16.742 1.00 0.00 H ATOM 1610 N ASN A 921 23.742 147.323 -14.429 1.00 78.49 N ATOM 1611 CA ASN A 921 24.680 146.164 -14.500 1.00 67.43 C ATOM 1612 C ASN A 921 24.870 145.513 -13.117 1.00 63.71 C ATOM 1613 O ASN A 921 24.279 145.987 -12.101 1.00 59.19 O ATOM 1614 CB ASN A 921 25.961 146.559 -15.264 1.00 68.01 C ATOM 1615 CG ASN A 921 27.243 146.852 -14.497 1.00 65.18 C ATOM 1616 OD1 ASN A 921 27.347 146.721 -13.278 1.00 68.61 O ATOM 1617 ND2 ASN A 921 28.264 147.252 -15.245 1.00 60.78 N ATOM 1618 HD22 ASN A 921 28.147 147.354 -16.273 1.00 0.00 H ATOM 1619 HD21 ASN A 921 29.181 147.464 -14.803 1.00 0.00 H ATOM 1620 H ASN A 921 23.808 147.955 -13.606 1.00 0.00 H ATOM 1621 N GLN A 922 25.663 144.433 -13.084 1.00 58.82 N ATOM 1622 CA GLN A 922 25.800 143.530 -11.910 1.00 53.19 C ATOM 1623 C GLN A 922 26.647 144.215 -10.837 1.00 53.67 C ATOM 1624 O GLN A 922 26.468 143.871 -9.669 1.00 58.09 O ATOM 1625 CB GLN A 922 26.399 142.172 -12.295 1.00 49.61 C ATOM 1626 CG GLN A 922 25.382 141.199 -12.898 1.00 48.32 C ATOM 1627 CD GLN A 922 25.995 139.873 -13.289 1.00 46.53 C ATOM 1628 OE1 GLN A 922 27.211 139.714 -13.376 1.00 48.29 O ATOM 1629 NE2 GLN A 922 25.150 138.896 -13.540 1.00 43.72 N ATOM 1630 HE22 GLN A 922 24.126 139.060 -13.458 1.00 0.00 H ATOM 1631 HE21 GLN A 922 25.506 137.960 -13.820 1.00 0.00 H ATOM 1632 H GLN A 922 26.219 144.212 -13.935 1.00 0.00 H ATOM 1633 N LYS A 923 27.512 145.159 -11.210 1.00 55.14 N ATOM 1634 CA LYS A 923 28.523 145.767 -10.306 1.00 53.81 C ATOM 1635 C LYS A 923 27.856 146.699 -9.280 1.00 54.95 C ATOM 1636 O LYS A 923 28.559 147.145 -8.368 1.00 55.38 O ATOM 1637 CB LYS A 923 29.624 146.449 -11.128 1.00 54.49 C ATOM 1638 CG LYS A 923 30.593 145.481 -11.806 1.00 55.19 C ATOM 1639 CD LYS A 923 31.727 146.169 -12.510 1.00 57.06 C ATOM 1640 CE LYS A 923 32.692 145.230 -13.196 1.00 62.61 C ATOM 1641 NZ LYS A 923 33.207 145.798 -14.477 1.00 67.00 N ATOM 1642 HZ1 LYS A 923 32.410 145.975 -15.122 1.00 0.00 H ATOM 1643 HZ2 LYS A 923 33.703 146.691 -14.284 1.00 0.00 H ATOM 1644 HZ3 LYS A 923 33.865 145.122 -14.915 1.00 0.00 H ATOM 1645 H LYS A 923 27.477 145.490 -12.195 1.00 0.00 H ATOM 1646 N VAL A 924 26.554 146.973 -9.382 1.00 54.70 N ATOM 1647 CA VAL A 924 25.815 147.762 -8.350 1.00 53.82 C ATOM 1648 C VAL A 924 25.809 146.955 -7.048 1.00 53.33 C ATOM 1649 O VAL A 924 25.885 147.592 -5.988 1.00 53.36 O ATOM 1650 CB VAL A 924 24.392 148.132 -8.808 1.00 58.36 C ATOM 1651 CG1 VAL A 924 24.409 148.887 -10.131 1.00 59.03 C ATOM 1652 CG2 VAL A 924 23.481 146.905 -8.900 1.00 60.89 C ATOM 1653 H VAL A 924 26.033 146.624 -10.212 1.00 0.00 H ATOM 1654 N ASP A 925 25.761 145.615 -7.125 1.00 52.09 N ATOM 1655 CA ASP A 925 25.876 144.706 -5.943 1.00 51.55 C ATOM 1656 C ASP A 925 27.262 144.871 -5.315 1.00 50.00 C ATOM 1657 O ASP A 925 27.345 144.847 -4.089 1.00 54.63 O ATOM 1658 CB ASP A 925 25.579 143.228 -6.254 1.00 47.36 C ATOM 1659 CG ASP A 925 24.087 142.944 -6.507 1.00 48.05 C ATOM 1660 OD1 ASP A 925 23.273 143.871 -6.318 1.00 53.27 O ATOM 1661 OD2 ASP A 925 23.758 141.814 -6.916 1.00 52.24 O ATOM 1662 H ASP A 925 25.636 145.184 -8.063 1.00 0.00 H ATOM 1663 N LEU A 926 28.311 145.092 -6.095 1.00 52.79 N ATOM 1664 CA LEU A 926 29.669 145.219 -5.498 1.00 56.34 C ATOM 1665 C LEU A 926 29.888 146.612 -4.896 1.00 52.15 C ATOM 1666 O LEU A 926 30.761 146.726 -4.015 1.00 48.11 O ATOM 1667 CB LEU A 926 30.722 144.822 -6.528 1.00 58.39 C ATOM 1668 CG LEU A 926 30.880 143.309 -6.615 1.00 61.31 C ATOM 1669 CD1 LEU A 926 30.298 142.769 -7.910 1.00 59.36 C ATOM 1670 CD2 LEU A 926 32.344 142.932 -6.468 1.00 63.50 C ATOM 1671 H LEU A 926 28.185 145.177 -7.124 1.00 0.00 H ATOM 1672 N PHE A 927 29.061 147.597 -5.248 1.00 51.23 N ATOM 1673 CA PHE A 927 29.055 148.911 -4.552 1.00 54.68 C ATOM 1674 C PHE A 927 28.447 148.747 -3.154 1.00 53.89 C ATOM 1675 O PHE A 927 29.057 149.189 -2.161 1.00 51.28 O ATOM 1676 CB PHE A 927 28.276 149.971 -5.331 1.00 57.13 C ATOM 1677 CG PHE A 927 28.372 151.333 -4.710 1.00 56.44 C ATOM 1678 CD1 PHE A 927 27.484 151.723 -3.734 1.00 60.43 C ATOM 1679 CD2 PHE A 927 29.397 152.197 -5.062 1.00 60.15 C ATOM 1680 CE1 PHE A 927 27.601 152.977 -3.140 1.00 67.46 C ATOM 1681 CE2 PHE A 927 29.504 153.453 -4.489 1.00 62.29 C ATOM 1682 CZ PHE A 927 28.603 153.843 -3.530 1.00 66.83 C ATOM 1683 H PHE A 927 28.399 147.441 -6.035 1.00 0.00 H ATOM 1684 N SER A 928 27.250 148.156 -3.095 1.00 49.96 N ATOM 1685 CA SER A 928 26.567 147.787 -1.840 1.00 50.20 C ATOM 1686 C SER A 928 27.588 147.096 -0.929 1.00 52.33 C ATOM 1687 O SER A 928 27.763 147.552 0.224 1.00 50.41 O ATOM 1688 CB SER A 928 25.389 146.898 -2.109 1.00 51.93 C ATOM 1689 OG SER A 928 24.574 147.426 -3.130 1.00 52.99 O ATOM 1690 HG SER A 928 23.807 146.820 -3.285 1.00 0.00 H ATOM 1691 H SER A 928 26.768 147.942 -3.992 1.00 0.00 H ATOM 1692 N LEU A 929 28.259 146.065 -1.461 1.00 51.90 N ATOM 1693 CA LEU A 929 29.202 145.196 -0.713 1.00 51.89 C ATOM 1694 C LEU A 929 30.298 146.054 -0.082 1.00 53.37 C ATOM 1695 O LEU A 929 30.802 145.673 0.990 1.00 54.15 O ATOM 1696 CB LEU A 929 29.830 144.159 -1.649 1.00 52.27 C ATOM 1697 CG LEU A 929 30.765 143.160 -0.953 1.00 53.46 C ATOM 1698 CD1 LEU A 929 30.017 142.320 0.081 1.00 50.94 C ATOM 1699 CD2 LEU A 929 31.484 142.265 -1.947 1.00 52.60 C ATOM 1700 H LEU A 929 28.108 145.859 -2.469 1.00 0.00 H ATOM 1701 N GLY A 930 30.702 147.125 -0.768 1.00 54.21 N ATOM 1702 CA GLY A 930 31.779 148.020 -0.313 1.00 52.29 C ATOM 1703 C GLY A 930 31.333 148.759 0.922 1.00 51.98 C ATOM 1704 O GLY A 930 32.145 148.893 1.845 1.00 54.59 O ATOM 1705 H GLY A 930 30.232 147.339 -1.671 1.00 0.00 H ATOM 1706 N ILE A 931 30.072 149.188 0.935 1.00 50.26 N ATOM 1707 CA ILE A 931 29.441 149.857 2.106 1.00 53.15 C ATOM 1708 C ILE A 931 29.340 148.841 3.249 1.00 55.05 C ATOM 1709 O ILE A 931 29.790 149.150 4.376 1.00 57.86 O ATOM 1710 CB ILE A 931 28.072 150.450 1.744 1.00 53.10 C ATOM 1711 CG1 ILE A 931 28.174 151.458 0.604 1.00 54.53 C ATOM 1712 CG2 ILE A 931 27.424 151.071 2.976 1.00 55.80 C ATOM 1713 CD1 ILE A 931 28.887 152.749 0.990 1.00 59.03 C ATOM 1714 H ILE A 931 29.497 149.048 0.080 1.00 0.00 H ATOM 1715 N ILE A 932 28.777 147.667 2.966 1.00 54.34 N ATOM 1716 CA ILE A 932 28.625 146.573 3.964 1.00 53.91 C ATOM 1717 C ILE A 932 29.991 146.233 4.567 1.00 54.70 C ATOM 1718 O ILE A 932 30.064 146.110 5.803 1.00 56.60 O ATOM 1719 CB ILE A 932 27.964 145.351 3.320 1.00 52.43 C ATOM 1720 CG1 ILE A 932 26.488 145.632 3.034 1.00 51.33 C ATOM 1721 CG2 ILE A 932 28.178 144.107 4.183 1.00 53.17 C ATOM 1722 CD1 ILE A 932 25.893 144.645 2.044 1.00 54.55 C ATOM 1723 H ILE A 932 28.426 147.507 2.000 1.00 0.00 H ATOM 1724 N PHE A 933 31.032 146.114 3.743 1.00 53.38 N ATOM 1725 CA PHE A 933 32.367 145.673 4.213 1.00 56.92 C ATOM 1726 C PHE A 933 33.018 146.766 5.055 1.00 59.66 C ATOM 1727 O PHE A 933 33.824 146.414 5.930 1.00 62.13 O ATOM 1728 CB PHE A 933 33.315 145.319 3.069 1.00 56.33 C ATOM 1729 CG PHE A 933 34.592 144.656 3.525 1.00 54.67 C ATOM 1730 CD1 PHE A 933 34.583 143.711 4.528 1.00 53.69 C ATOM 1731 CD2 PHE A 933 35.797 144.948 2.926 1.00 56.53 C ATOM 1732 CE1 PHE A 933 35.747 143.087 4.936 1.00 55.32 C ATOM 1733 CE2 PHE A 933 36.957 144.301 3.314 1.00 57.99 C ATOM 1734 CZ PHE A 933 36.931 143.381 4.332 1.00 56.69 C ATOM 1735 H PHE A 933 30.903 146.338 2.736 1.00 0.00 H ATOM 1736 N PHE A 934 32.722 148.037 4.776 1.00 57.97 N ATOM 1737 CA PHE A 934 33.242 149.149 5.601 1.00 61.29 C ATOM 1738 C PHE A 934 32.655 149.001 7.004 1.00 66.15 C ATOM 1739 O PHE A 934 33.426 149.016 7.981 1.00 69.44 O ATOM 1740 CB PHE A 934 32.896 150.532 5.054 1.00 61.55 C ATOM 1741 CG PHE A 934 33.120 151.602 6.085 1.00 62.05 C ATOM 1742 CD1 PHE A 934 34.395 152.079 6.335 1.00 64.53 C ATOM 1743 CD2 PHE A 934 32.070 152.071 6.853 1.00 62.82 C ATOM 1744 CE1 PHE A 934 34.609 153.039 7.309 1.00 68.95 C ATOM 1745 CE2 PHE A 934 32.285 153.034 7.826 1.00 68.25 C ATOM 1746 CZ PHE A 934 33.557 153.510 8.060 1.00 69.21 C ATOM 1747 H PHE A 934 32.112 148.250 3.961 1.00 0.00 H ATOM 1748 N GLU A 935 31.329 148.844 7.078 1.00 64.76 N ATOM 1749 CA GLU A 935 30.566 148.688 8.345 1.00 61.66 C ATOM 1750 C GLU A 935 31.085 147.483 9.130 1.00 60.39 C ATOM 1751 O GLU A 935 31.200 147.600 10.367 1.00 60.94 O ATOM 1752 CB GLU A 935 29.084 148.509 8.043 1.00 59.68 C ATOM 1753 CG GLU A 935 28.426 149.788 7.588 1.00 59.54 C ATOM 1754 CD GLU A 935 26.926 149.633 7.461 1.00 60.60 C ATOM 1755 OE1 GLU A 935 26.497 148.909 6.540 1.00 54.59 O ATOM 1756 OE2 GLU A 935 26.200 150.191 8.311 1.00 64.76 O ATOM 1757 H GLU A 935 30.794 148.830 6.187 1.00 0.00 H ATOM 1758 N MET A 936 31.369 146.377 8.431 1.00 58.28 N ATOM 1759 CA MET A 936 31.919 145.133 9.029 1.00 57.82 C ATOM 1760 C MET A 936 33.303 145.416 9.626 1.00 59.56 C ATOM 1761 O MET A 936 33.648 144.746 10.604 1.00 59.83 O ATOM 1762 CB MET A 936 32.043 144.017 7.988 1.00 55.85 C ATOM 1763 CG MET A 936 30.723 143.402 7.543 1.00 55.69 C ATOM 1764 SD MET A 936 30.948 142.504 5.958 1.00 59.58 S ATOM 1765 CE MET A 936 32.054 141.221 6.539 1.00 55.56 C ATOM 1766 H MET A 936 31.194 146.389 7.406 1.00 0.00 H ATOM 1767 N SER A 937 34.055 146.371 9.068 1.00 62.47 N ATOM 1768 CA SER A 937 35.479 146.633 9.409 1.00 67.08 C ATOM 1769 C SER A 937 35.619 147.718 10.485 1.00 67.82 C ATOM 1770 O SER A 937 36.732 147.820 11.053 1.00 65.35 O ATOM 1771 CB SER A 937 36.247 146.984 8.177 1.00 68.38 C ATOM 1772 OG SER A 937 36.249 145.886 7.284 1.00 76.88 O ATOM 1773 HG SER A 937 35.317 145.662 7.037 1.00 0.00 H ATOM 1774 H SER A 937 33.613 146.973 8.344 1.00 0.00 H ATOM 1775 N TYR A 938 34.529 148.452 10.749 1.00 68.38 N ATOM 1776 CA TYR A 938 34.462 149.676 11.592 1.00 74.28 C ATOM 1777 C TYR A 938 33.541 149.427 12.805 1.00 78.16 C ATOM 1778 O TYR A 938 32.731 148.449 12.793 1.00 78.37 O ATOM 1779 CB TYR A 938 33.990 150.855 10.740 1.00 72.33 C ATOM 1780 CG TYR A 938 34.213 152.227 11.329 1.00 77.50 C ATOM 1781 CD1 TYR A 938 35.474 152.637 11.731 1.00 79.64 C ATOM 1782 CD2 TYR A 938 33.169 153.131 11.480 1.00 77.66 C ATOM 1783 CE1 TYR A 938 35.694 153.898 12.267 1.00 79.53 C ATOM 1784 CE2 TYR A 938 33.369 154.389 12.031 1.00 76.49 C ATOM 1785 CZ TYR A 938 34.636 154.778 12.425 1.00 78.66 C ATOM 1786 OH TYR A 938 34.839 156.032 12.933 1.00 77.98 O ATOM 1787 HH TYR A 938 35.796 156.143 13.162 1.00 0.00 H ATOM 1788 H TYR A 938 33.637 148.133 10.320 1.00 0.00 H ATOM 1789 N HIS A 939 33.659 150.281 13.837 1.00 75.11 N ATOM 1790 CA HIS A 939 32.876 150.161 15.095 1.00 74.14 C ATOM 1791 C HIS A 939 31.415 150.477 14.811 1.00 73.58 C ATOM 1792 O HIS A 939 31.073 151.113 13.817 1.00 78.18 O ATOM 1793 CB HIS A 939 33.473 150.967 16.280 1.00 75.23 C ATOM 1794 CG HIS A 939 33.686 152.460 16.079 1.00 74.80 C ATOM 1795 ND1 HIS A 939 32.649 153.384 16.071 1.00 73.01 N ATOM 1796 CD2 HIS A 939 34.822 153.196 15.919 1.00 75.95 C ATOM 1797 CE1 HIS A 939 33.131 154.605 15.919 1.00 75.73 C ATOM 1798 NE2 HIS A 939 34.461 154.518 15.834 1.00 77.45 N ATOM 1799 H HIS A 939 34.334 151.067 13.750 1.00 0.00 H ATOM 1800 N PRO A 940 30.491 149.975 15.646 1.00 71.44 N ATOM 1801 CA PRO A 940 29.081 150.313 15.495 1.00 71.01 C ATOM 1802 C PRO A 940 28.859 151.820 15.657 1.00 70.97 C ATOM 1803 O PRO A 940 29.355 152.413 16.564 1.00 68.53 O ATOM 1804 CB PRO A 940 28.393 149.485 16.587 1.00 71.48 C ATOM 1805 CG PRO A 940 29.365 148.347 16.828 1.00 71.38 C ATOM 1806 CD PRO A 940 30.729 148.995 16.708 1.00 71.82 C ATOM 1807 N MET A 941 28.122 152.381 14.711 1.00 73.38 N ATOM 1808 CA MET A 941 27.744 153.808 14.656 1.00 81.49 C ATOM 1809 C MET A 941 26.348 153.908 15.267 1.00 83.15 C ATOM 1810 O MET A 941 25.360 153.642 14.566 1.00 82.46 O ATOM 1811 CB MET A 941 27.769 154.295 13.199 1.00 83.55 C ATOM 1812 CG MET A 941 29.160 154.173 12.545 1.00 84.47 C ATOM 1813 SD MET A 941 29.307 154.645 10.785 1.00 85.94 S ATOM 1814 CE MET A 941 28.964 153.079 9.985 1.00 83.43 C ATOM 1815 H MET A 941 27.781 151.767 13.944 1.00 0.00 H ATOM 1816 N VAL A 942 26.272 154.237 16.551 1.00 87.85 N ATOM 1817 CA VAL A 942 25.045 154.026 17.371 1.00 90.38 C ATOM 1818 C VAL A 942 23.959 155.032 16.970 1.00 92.65 C ATOM 1819 O VAL A 942 22.768 154.660 17.013 1.00 96.66 O ATOM 1820 CB VAL A 942 25.359 154.128 18.872 1.00 93.03 C ATOM 1821 CG1 VAL A 942 25.522 155.568 19.325 1.00 93.84 C ATOM 1822 CG2 VAL A 942 24.299 153.432 19.707 1.00 97.27 C ATOM 1823 H VAL A 942 27.106 154.661 17.005 1.00 0.00 H ATOM 1824 N THR A 943 24.351 156.264 16.638 1.00 91.94 N ATOM 1825 CA THR A 943 23.442 157.336 16.160 1.00 93.14 C ATOM 1826 C THR A 943 23.324 157.245 14.625 1.00 96.58 C ATOM 1827 O THR A 943 24.297 156.792 13.940 1.00 90.05 O ATOM 1828 CB THR A 943 23.918 158.692 16.687 1.00 92.50 C ATOM 1829 OG1 THR A 943 25.237 158.944 16.215 1.00 90.96 O ATOM 1830 CG2 THR A 943 23.972 158.745 18.193 1.00 95.30 C ATOM 1831 HG1 THR A 943 25.546 159.821 16.555 1.00 0.00 H ATOM 1832 H THR A 943 25.363 156.488 16.720 1.00 0.00 H ATOM 1833 N ALA A 944 22.155 157.623 14.100 1.00101.93 N ATOM 1834 CA ALA A 944 21.876 157.745 12.650 1.00100.43 C ATOM 1835 C ALA A 944 22.785 158.830 12.062 1.00101.44 C ATOM 1836 O ALA A 944 23.524 158.531 11.122 1.00106.01 O ATOM 1837 CB ALA A 944 20.418 158.061 12.422 1.00102.49 C ATOM 1838 H ALA A 944 21.383 157.849 14.759 1.00 0.00 H ATOM 1839 N SER A 945 22.775 160.031 12.640 1.00101.99 N ATOM 1840 CA SER A 945 23.550 161.203 12.159 1.00107.71 C ATOM 1841 C SER A 945 25.053 160.890 12.045 1.00105.96 C ATOM 1842 O SER A 945 25.720 161.551 11.204 1.00116.75 O ATOM 1843 CB SER A 945 23.294 162.401 13.023 1.00115.97 C ATOM 1844 OG SER A 945 22.024 162.959 12.720 1.00120.42 O ATOM 1845 HG SER A 945 21.866 163.749 13.296 1.00 0.00 H ATOM 1846 H SER A 945 22.184 160.156 13.486 1.00 0.00 H ATOM 1847 N GLU A 946 25.575 159.933 12.826 1.00 98.13 N ATOM 1848 CA GLU A 946 26.966 159.418 12.665 1.00 92.79 C ATOM 1849 C GLU A 946 27.029 158.531 11.410 1.00 88.25 C ATOM 1850 O GLU A 946 27.935 158.755 10.581 1.00 79.20 O ATOM 1851 CB GLU A 946 27.448 158.650 13.897 1.00 91.05 C ATOM 1852 CG GLU A 946 28.903 158.205 13.796 1.00 90.09 C ATOM 1853 CD GLU A 946 29.417 157.227 14.850 1.00 91.89 C ATOM 1854 OE1 GLU A 946 30.540 156.708 14.630 1.00 89.76 O ATOM 1855 OE2 GLU A 946 28.709 156.987 15.892 1.00 91.43 O ATOM 1856 H GLU A 946 24.982 159.531 13.580 1.00 0.00 H ATOM 1857 N ARG A 947 26.115 157.557 11.295 1.00 86.36 N ATOM 1858 CA ARG A 947 25.965 156.660 10.118 1.00 81.22 C ATOM 1859 C ARG A 947 25.924 157.494 8.832 1.00 81.50 C ATOM 1860 O ARG A 947 26.739 157.237 7.922 1.00 75.14 O ATOM 1861 CB ARG A 947 24.680 155.839 10.220 1.00 80.32 C ATOM 1862 CG ARG A 947 24.428 155.015 8.976 1.00 86.16 C ATOM 1863 CD ARG A 947 23.018 154.471 8.861 1.00 91.00 C ATOM 1864 NE ARG A 947 22.895 153.288 9.685 1.00 85.76 N ATOM 1865 CZ ARG A 947 23.534 152.153 9.467 1.00 84.23 C ATOM 1866 NH1 ARG A 947 23.334 151.145 10.300 1.00 97.77 N ATOM 1867 NH2 ARG A 947 24.366 152.021 8.441 1.00 77.59 N ATOM 1868 HE ARG A 947 22.259 153.335 10.506 1.00 0.00 H ATOM 1869 HH12 ARG A 947 23.826 150.241 10.150 1.00 0.00 H ATOM 1870 HH11 ARG A 947 22.685 151.257 11.105 1.00 0.00 H ATOM 1871 HH22 ARG A 947 24.860 151.119 8.285 1.00 0.00 H ATOM 1872 HH21 ARG A 947 24.523 152.819 7.793 1.00 0.00 H ATOM 1873 H ARG A 947 25.460 157.418 12.091 1.00 0.00 H ATOM 1874 N ILE A 948 24.996 158.454 8.774 1.00 80.74 N ATOM 1875 CA ILE A 948 24.696 159.310 7.588 1.00 78.10 C ATOM 1876 C ILE A 948 25.968 160.082 7.193 1.00 79.29 C ATOM 1877 O ILE A 948 26.223 160.213 5.974 1.00 76.20 O ATOM 1878 CB ILE A 948 23.481 160.222 7.890 1.00 82.15 C ATOM 1879 CG1 ILE A 948 22.146 159.535 7.580 1.00 80.68 C ATOM 1880 CG2 ILE A 948 23.577 161.568 7.170 1.00 86.72 C ATOM 1881 CD1 ILE A 948 21.881 158.236 8.318 1.00 81.93 C ATOM 1882 H ILE A 948 24.432 158.620 9.632 1.00 0.00 H ATOM 1883 N PHE A 949 26.743 160.574 8.170 1.00 82.03 N ATOM 1884 CA PHE A 949 27.940 161.419 7.925 1.00 81.02 C ATOM 1885 C PHE A 949 29.098 160.580 7.373 1.00 78.42 C ATOM 1886 O PHE A 949 29.728 161.005 6.384 1.00 84.21 O ATOM 1887 CB PHE A 949 28.428 162.122 9.189 1.00 82.08 C ATOM 1888 CG PHE A 949 29.673 162.932 8.920 1.00 83.15 C ATOM 1889 CD1 PHE A 949 29.591 164.160 8.278 1.00 84.53 C ATOM 1890 CD2 PHE A 949 30.934 162.426 9.219 1.00 81.85 C ATOM 1891 CE1 PHE A 949 30.738 164.899 8.020 1.00 86.36 C ATOM 1892 CE2 PHE A 949 32.079 163.159 8.950 1.00 82.67 C ATOM 1893 CZ PHE A 949 31.977 164.396 8.356 1.00 85.34 C ATOM 1894 H PHE A 949 26.492 160.352 9.155 1.00 0.00 H ATOM 1895 N VAL A 950 29.404 159.464 8.037 1.00 76.56 N ATOM 1896 CA VAL A 950 30.577 158.581 7.759 1.00 75.04 C ATOM 1897 C VAL A 950 30.373 157.910 6.403 1.00 72.82 C ATOM 1898 O VAL A 950 31.373 157.784 5.675 1.00 73.87 O ATOM 1899 CB VAL A 950 30.776 157.524 8.869 1.00 74.87 C ATOM 1900 CG1 VAL A 950 31.591 156.318 8.412 1.00 71.93 C ATOM 1901 CG2 VAL A 950 31.392 158.137 10.112 1.00 78.77 C ATOM 1902 H VAL A 950 28.772 159.185 8.814 1.00 0.00 H ATOM 1903 N LEU A 951 29.135 157.479 6.119 1.00 70.54 N ATOM 1904 CA LEU A 951 28.767 156.739 4.895 1.00 68.50 C ATOM 1905 C LEU A 951 28.773 157.686 3.693 1.00 70.20 C ATOM 1906 O LEU A 951 29.389 157.321 2.697 1.00 64.93 O ATOM 1907 CB LEU A 951 27.409 156.064 5.107 1.00 66.86 C ATOM 1908 CG LEU A 951 27.430 154.891 6.089 1.00 67.03 C ATOM 1909 CD1 LEU A 951 26.200 154.005 5.929 1.00 65.87 C ATOM 1910 CD2 LEU A 951 28.693 154.051 5.941 1.00 65.46 C ATOM 1911 H LEU A 951 28.382 157.680 6.808 1.00 0.00 H ATOM 1912 N ASN A 952 28.155 158.865 3.803 1.00 75.02 N ATOM 1913 CA ASN A 952 28.140 159.894 2.729 1.00 78.42 C ATOM 1914 C ASN A 952 29.571 160.333 2.396 1.00 79.38 C ATOM 1915 O ASN A 952 29.774 160.812 1.281 1.00 83.89 O ATOM 1916 CB ASN A 952 27.261 161.091 3.097 1.00 84.21 C ATOM 1917 CG ASN A 952 25.786 160.833 2.860 1.00 86.71 C ATOM 1918 OD1 ASN A 952 25.363 159.696 2.678 1.00 90.54 O ATOM 1919 ND2 ASN A 952 24.990 161.888 2.852 1.00 94.16 N ATOM 1920 HD22 ASN A 952 25.384 162.838 3.010 1.00 0.00 H ATOM 1921 HD21 ASN A 952 23.970 161.769 2.688 1.00 0.00 H ATOM 1922 H ASN A 952 27.656 159.076 4.691 1.00 0.00 H ATOM 1923 N GLN A 953 30.535 160.167 3.305 1.00 81.90 N ATOM 1924 CA GLN A 953 31.954 160.573 3.073 1.00 84.91 C ATOM 1925 C GLN A 953 32.774 159.381 2.553 1.00 82.48 C ATOM 1926 O GLN A 953 34.022 159.493 2.523 1.00 89.55 O ATOM 1927 CB GLN A 953 32.557 161.180 4.347 1.00 83.79 C ATOM 1928 CG GLN A 953 31.950 162.521 4.739 1.00 85.34 C ATOM 1929 CD GLN A 953 32.956 163.456 5.369 1.00 89.08 C ATOM 1930 OE1 GLN A 953 33.023 164.647 5.047 1.00 91.11 O ATOM 1931 NE2 GLN A 953 33.756 162.921 6.280 1.00 85.49 N ATOM 1932 HE22 GLN A 953 33.667 161.914 6.523 1.00 0.00 H ATOM 1933 HE21 GLN A 953 34.473 163.509 6.752 1.00 0.00 H ATOM 1934 H GLN A 953 30.286 159.735 4.218 1.00 0.00 H ATOM 1935 N LEU A 954 32.103 158.289 2.173 1.00 79.73 N ATOM 1936 CA LEU A 954 32.664 157.207 1.311 1.00 79.99 C ATOM 1937 C LEU A 954 32.217 157.381 -0.159 1.00 72.65 C ATOM 1938 O LEU A 954 32.838 156.747 -1.008 1.00 69.18 O ATOM 1939 CB LEU A 954 32.229 155.846 1.869 1.00 80.94 C ATOM 1940 CG LEU A 954 32.636 155.534 3.310 1.00 80.03 C ATOM 1941 CD1 LEU A 954 32.030 154.225 3.780 1.00 77.17 C ATOM 1942 CD2 LEU A 954 34.142 155.494 3.465 1.00 85.08 C ATOM 1943 H LEU A 954 31.121 158.186 2.501 1.00 0.00 H ATOM 1944 N ARG A 955 31.227 158.249 -0.433 1.00 75.30 N ATOM 1945 CA ARG A 955 30.686 158.644 -1.774 1.00 74.59 C ATOM 1946 C ARG A 955 31.300 159.990 -2.179 1.00 78.79 C ATOM 1947 O ARG A 955 31.287 160.890 -1.318 1.00 79.92 O ATOM 1948 CB ARG A 955 29.160 158.731 -1.659 1.00 71.51 C ATOM 1949 CG ARG A 955 28.554 157.490 -1.008 1.00 67.09 C ATOM 1950 CD ARG A 955 27.119 157.661 -0.561 1.00 65.32 C ATOM 1951 NE ARG A 955 26.482 156.374 -0.609 1.00 60.68 N ATOM 1952 CZ ARG A 955 25.637 155.972 -1.556 1.00 64.38 C ATOM 1953 NH1 ARG A 955 25.260 156.773 -2.535 1.00 63.61 N ATOM 1954 NH2 ARG A 955 25.152 154.744 -1.518 1.00 66.24 N ATOM 1955 HE ARG A 955 26.698 155.704 0.156 1.00 0.00 H ATOM 1956 HH12 ARG A 955 24.598 156.431 -3.261 1.00 0.00 H ATOM 1957 HH11 ARG A 955 25.625 157.746 -2.580 1.00 0.00 H ATOM 1958 HH22 ARG A 955 24.491 154.423 -2.254 1.00 0.00 H ATOM 1959 HH21 ARG A 955 25.431 154.098 -0.752 1.00 0.00 H ATOM 1960 H ARG A 955 30.781 158.703 0.389 1.00 0.00 H ATOM 1961 N ASP A 956 31.867 160.153 -3.386 1.00 83.23 N ATOM 1962 CA ASP A 956 32.784 161.302 -3.619 1.00 87.77 C ATOM 1963 C ASP A 956 33.267 161.438 -5.063 1.00 84.18 C ATOM 1964 O ASP A 956 32.601 160.991 -5.997 1.00 77.13 O ATOM 1965 CB ASP A 956 33.971 161.152 -2.656 1.00 96.14 C ATOM 1966 CG ASP A 956 34.210 162.383 -1.789 1.00102.41 C ATOM 1967 OD1 ASP A 956 33.222 163.103 -1.472 1.00 95.93 O ATOM 1968 OD2 ASP A 956 35.392 162.641 -1.474 1.00108.41 O ATOM 1969 H ASP A 956 31.666 159.480 -4.153 1.00 0.00 H ATOM 1970 N PRO A 957 34.352 162.236 -5.283 1.00 89.20 N ATOM 1971 CA PRO A 957 35.327 162.004 -6.353 1.00 87.99 C ATOM 1972 C PRO A 957 36.077 160.666 -6.235 1.00 84.44 C ATOM 1973 O PRO A 957 36.942 160.576 -5.376 1.00 85.43 O ATOM 1974 CB PRO A 957 36.328 163.173 -6.201 1.00 90.59 C ATOM 1975 CG PRO A 957 35.535 164.273 -5.530 1.00 91.35 C ATOM 1976 CD PRO A 957 34.644 163.504 -4.577 1.00 91.74 C TER 1977 PRO A 957 ATOM 1978 N PHE A 962 36.470 158.546 4.263 1.00 68.45 N ATOM 1979 CA PHE A 962 36.891 157.543 5.287 1.00 71.10 C ATOM 1980 C PHE A 962 37.154 158.152 6.683 1.00 74.55 C ATOM 1981 O PHE A 962 37.963 159.067 6.851 1.00 78.03 O ATOM 1982 CB PHE A 962 38.192 156.893 4.823 1.00 71.90 C ATOM 1983 CG PHE A 962 38.070 155.614 4.046 1.00 68.82 C ATOM 1984 CD1 PHE A 962 37.363 154.527 4.546 1.00 69.93 C ATOM 1985 CD2 PHE A 962 38.765 155.457 2.865 1.00 70.32 C ATOM 1986 CE1 PHE A 962 37.282 153.335 3.840 1.00 67.72 C ATOM 1987 CE2 PHE A 962 38.697 154.260 2.163 1.00 71.20 C ATOM 1988 CZ PHE A 962 37.966 153.197 2.656 1.00 68.81 C ATOM 1989 HN3 PHE A 962 37.216 159.262 4.153 1.00 0.00 H ATOM 1990 HN2 PHE A 962 35.590 159.006 4.571 1.00 0.00 H ATOM 1991 HN1 PHE A 962 36.312 158.066 3.354 1.00 0.00 H ATOM 1992 N PRO A 963 36.566 157.641 7.783 1.00 74.68 N ATOM 1993 CA PRO A 963 36.775 158.252 9.104 1.00 77.97 C ATOM 1994 C PRO A 963 38.218 158.169 9.658 1.00 81.91 C ATOM 1995 O PRO A 963 38.951 157.259 9.316 1.00 83.96 O ATOM 1996 CB PRO A 963 35.805 157.473 10.000 1.00 74.47 C ATOM 1997 CG PRO A 963 35.682 156.129 9.322 1.00 71.84 C ATOM 1998 CD PRO A 963 35.741 156.429 7.837 1.00 71.32 C ATOM 1999 N GLU A 964 38.596 159.114 10.525 1.00 86.16 N ATOM 2000 CA GLU A 964 39.987 159.270 11.035 1.00 91.45 C ATOM 2001 C GLU A 964 40.398 158.092 11.948 1.00 93.60 C ATOM 2002 O GLU A 964 41.614 157.821 12.007 1.00 95.02 O ATOM 2003 CB GLU A 964 40.153 160.631 11.725 1.00 96.80 C ATOM 2004 CG GLU A 964 39.322 160.798 12.989 1.00 97.17 C ATOM 2005 CD GLU A 964 39.717 161.972 13.876 1.00102.74 C ATOM 2006 OE1 GLU A 964 40.621 162.738 13.489 1.00103.33 O ATOM 2007 OE2 GLU A 964 39.123 162.109 14.960 1.00101.66 O ATOM 2008 H GLU A 964 37.874 159.781 10.864 1.00 0.00 H ATOM 2009 N ASP A 965 39.473 157.408 12.646 1.00 93.04 N ATOM 2010 CA ASP A 965 39.826 156.267 13.551 1.00 91.94 C ATOM 2011 C ASP A 965 39.949 154.945 12.756 1.00 91.67 C ATOM 2012 O ASP A 965 40.172 153.905 13.404 1.00 90.75 O ATOM 2013 CB ASP A 965 38.920 156.180 14.790 1.00 93.01 C ATOM 2014 CG ASP A 965 37.467 156.558 14.574 1.00 91.08 C ATOM 2015 OD1 ASP A 965 37.078 156.692 13.354 1.00 83.77 O ATOM 2016 OD2 ASP A 965 36.744 156.757 15.644 1.00 88.92 O ATOM 2017 H ASP A 965 38.474 157.682 12.554 1.00 0.00 H ATOM 2018 N PHE A 966 39.817 154.964 11.417 1.00 91.91 N ATOM 2019 CA PHE A 966 40.452 154.016 10.455 1.00 86.21 C ATOM 2020 C PHE A 966 41.912 154.462 10.265 1.00 88.37 C ATOM 2021 O PHE A 966 42.707 153.769 9.598 1.00 84.69 O ATOM 2022 CB PHE A 966 39.679 154.008 9.130 1.00 83.57 C ATOM 2023 CG PHE A 966 38.997 152.721 8.736 1.00 79.84 C ATOM 2024 CD1 PHE A 966 38.459 151.852 9.675 1.00 81.22 C ATOM 2025 CD2 PHE A 966 38.848 152.395 7.396 1.00 76.59 C ATOM 2026 CE1 PHE A 966 37.829 150.680 9.278 1.00 77.14 C ATOM 2027 CE2 PHE A 966 38.217 151.224 7.002 1.00 72.45 C ATOM 2028 CZ PHE A 966 37.702 150.372 7.941 1.00 71.87 C ATOM 2029 H PHE A 966 39.215 155.710 11.014 1.00 0.00 H TER 2030 PHE A 966 ATOM 2031 N HIS A 971 44.550 148.605 8.834 1.00 96.98 N ATOM 2032 CA HIS A 971 43.385 148.412 7.923 1.00 96.21 C ATOM 2033 C HIS A 971 43.726 148.802 6.473 1.00 96.83 C ATOM 2034 O HIS A 971 42.806 149.276 5.770 1.00 95.65 O ATOM 2035 CB HIS A 971 42.167 149.237 8.367 1.00 96.21 C ATOM 2036 CG HIS A 971 41.636 148.921 9.724 1.00106.43 C ATOM 2037 ND1 HIS A 971 41.547 149.880 10.723 1.00118.28 N ATOM 2038 CD2 HIS A 971 41.136 147.782 10.252 1.00108.74 C ATOM 2039 CE1 HIS A 971 41.033 149.339 11.812 1.00113.25 C ATOM 2040 NE2 HIS A 971 40.773 148.051 11.548 1.00111.96 N ATOM 2041 HN3 HIS A 971 44.836 149.605 8.822 1.00 0.00 H ATOM 2042 HN2 HIS A 971 45.342 148.012 8.512 1.00 0.00 H ATOM 2043 HN1 HIS A 971 44.281 148.332 9.801 1.00 0.00 H ATOM 2044 N ALA A 972 44.973 148.610 6.022 1.00 97.21 N ATOM 2045 CA ALA A 972 45.458 149.015 4.673 1.00 93.68 C ATOM 2046 C ALA A 972 44.731 148.220 3.578 1.00 89.35 C ATOM 2047 O ALA A 972 44.357 148.836 2.558 1.00 80.06 O ATOM 2048 CB ALA A 972 46.956 148.835 4.560 1.00 93.72 C ATOM 2049 H ALA A 972 45.651 148.145 6.659 1.00 0.00 H ATOM 2050 N LYS A 973 44.532 146.918 3.808 1.00 89.29 N ATOM 2051 CA LYS A 973 44.003 145.938 2.822 1.00 86.65 C ATOM 2052 C LYS A 973 42.479 146.091 2.760 1.00 81.17 C ATOM 2053 O LYS A 973 41.930 146.096 1.644 1.00 86.56 O ATOM 2054 CB LYS A 973 44.423 144.505 3.186 1.00 92.23 C ATOM 2055 CG LYS A 973 45.732 144.338 3.964 1.00101.10 C ATOM 2056 CD LYS A 973 46.619 143.213 3.442 1.00103.18 C ATOM 2057 CE LYS A 973 47.252 143.550 2.104 1.00104.95 C ATOM 2058 NZ LYS A 973 47.358 142.371 1.210 1.00105.65 N ATOM 2059 HZ1 LYS A 973 47.944 141.643 1.667 1.00 0.00 H ATOM 2060 HZ2 LYS A 973 46.408 141.989 1.027 1.00 0.00 H ATOM 2061 HZ3 LYS A 973 47.797 142.657 0.311 1.00 0.00 H ATOM 2062 H LYS A 973 44.767 146.560 4.756 1.00 0.00 H ATOM 2063 N GLN A 974 41.827 146.229 3.917 1.00 78.12 N ATOM 2064 CA GLN A 974 40.394 146.617 4.036 1.00 75.75 C ATOM 2065 C GLN A 974 40.125 147.885 3.219 1.00 75.11 C ATOM 2066 O GLN A 974 39.177 147.878 2.434 1.00 70.01 O ATOM 2067 CB GLN A 974 40.028 146.869 5.502 1.00 77.31 C ATOM 2068 CG GLN A 974 39.526 145.627 6.217 1.00 76.01 C ATOM 2069 CD GLN A 974 40.019 145.498 7.636 1.00 76.76 C ATOM 2070 OE1 GLN A 974 39.249 145.257 8.566 1.00 74.37 O ATOM 2071 NE2 GLN A 974 41.328 145.611 7.801 1.00 77.45 N ATOM 2072 HE22 GLN A 974 41.939 145.816 6.985 1.00 0.00 H ATOM 2073 HE21 GLN A 974 41.745 145.495 8.747 1.00 0.00 H ATOM 2074 H GLN A 974 42.356 146.054 4.795 1.00 0.00 H ATOM 2075 N LYS A 975 40.914 148.942 3.443 1.00 77.39 N ATOM 2076 CA LYS A 975 40.761 150.271 2.797 1.00 80.42 C ATOM 2077 C LYS A 975 40.819 150.113 1.270 1.00 81.21 C ATOM 2078 O LYS A 975 40.014 150.767 0.564 1.00 83.95 O ATOM 2079 CB LYS A 975 41.872 151.191 3.312 1.00 85.82 C ATOM 2080 CG LYS A 975 42.016 152.545 2.625 1.00 91.14 C ATOM 2081 CD LYS A 975 42.217 153.712 3.575 1.00 98.66 C ATOM 2082 CE LYS A 975 41.184 153.711 4.682 1.00 98.16 C ATOM 2083 NZ LYS A 975 40.948 155.073 5.202 1.00105.04 N ATOM 2084 HZ1 LYS A 975 41.837 155.457 5.581 1.00 0.00 H ATOM 2085 HZ2 LYS A 975 40.606 155.682 4.432 1.00 0.00 H ATOM 2086 HZ3 LYS A 975 40.235 155.035 5.958 1.00 0.00 H ATOM 2087 H LYS A 975 41.694 148.824 4.121 1.00 0.00 H ATOM 2088 N SER A 976 41.751 149.295 0.769 1.00 77.61 N ATOM 2089 CA SER A 976 41.997 149.103 -0.684 1.00 72.24 C ATOM 2090 C SER A 976 40.750 148.480 -1.309 1.00 66.38 C ATOM 2091 O SER A 976 40.244 149.008 -2.320 1.00 61.73 O ATOM 2092 CB SER A 976 43.215 148.245 -0.932 1.00 74.52 C ATOM 2093 OG SER A 976 44.409 148.945 -0.623 1.00 76.22 O ATOM 2094 HG SER A 976 44.398 149.209 0.331 1.00 0.00 H ATOM 2095 H SER A 976 42.340 148.760 1.438 1.00 0.00 H ATOM 2096 N VAL A 977 40.277 147.403 -0.691 1.00 61.04 N ATOM 2097 CA VAL A 977 39.061 146.679 -1.126 1.00 57.40 C ATOM 2098 C VAL A 977 37.899 147.668 -1.201 1.00 56.72 C ATOM 2099 O VAL A 977 37.255 147.718 -2.229 1.00 68.47 O ATOM 2100 CB VAL A 977 38.779 145.496 -0.191 1.00 54.78 C ATOM 2101 CG1 VAL A 977 37.384 144.934 -0.396 1.00 51.65 C ATOM 2102 CG2 VAL A 977 39.840 144.419 -0.379 1.00 56.40 C ATOM 2103 H VAL A 977 40.788 147.050 0.143 1.00 0.00 H ATOM 2104 N ILE A 978 37.660 148.467 -0.176 1.00 56.51 N ATOM 2105 CA ILE A 978 36.425 149.298 -0.114 1.00 54.48 C ATOM 2106 C ILE A 978 36.497 150.371 -1.194 1.00 55.99 C ATOM 2107 O ILE A 978 35.504 150.462 -1.925 1.00 56.25 O ATOM 2108 CB ILE A 978 36.192 149.890 1.283 1.00 56.26 C ATOM 2109 CG1 ILE A 978 36.032 148.788 2.332 1.00 58.21 C ATOM 2110 CG2 ILE A 978 34.985 150.822 1.266 1.00 56.69 C ATOM 2111 CD1 ILE A 978 36.496 149.190 3.708 1.00 63.24 C ATOM 2112 H ILE A 978 38.348 148.517 0.603 1.00 0.00 H ATOM 2113 N SER A 979 37.615 151.110 -1.300 1.00 59.17 N ATOM 2114 CA SER A 979 37.840 152.199 -2.299 1.00 64.85 C ATOM 2115 C SER A 979 37.544 151.693 -3.722 1.00 66.11 C ATOM 2116 O SER A 979 36.949 152.436 -4.539 1.00 69.53 O ATOM 2117 CB SER A 979 39.253 152.738 -2.242 1.00 68.07 C ATOM 2118 OG SER A 979 39.694 152.921 -0.916 1.00 70.01 O ATOM 2119 HG SER A 979 39.674 152.053 -0.440 1.00 0.00 H ATOM 2120 H SER A 979 38.386 150.908 -0.632 1.00 0.00 H ATOM 2121 N TRP A 980 37.981 150.469 -4.009 1.00 64.12 N ATOM 2122 CA TRP A 980 37.751 149.772 -5.295 1.00 62.17 C ATOM 2123 C TRP A 980 36.245 149.640 -5.535 1.00 59.52 C ATOM 2124 O TRP A 980 35.793 150.045 -6.636 1.00 65.97 O ATOM 2125 CB TRP A 980 38.445 148.411 -5.272 1.00 60.92 C ATOM 2126 CG TRP A 980 38.729 147.849 -6.624 1.00 63.31 C ATOM 2127 CD1 TRP A 980 38.359 148.367 -7.829 1.00 63.27 C ATOM 2128 CD2 TRP A 980 39.418 146.620 -6.905 1.00 63.85 C ATOM 2129 NE1 TRP A 980 38.783 147.549 -8.841 1.00 64.08 N ATOM 2130 CE2 TRP A 980 39.445 146.475 -8.305 1.00 65.11 C ATOM 2131 CE3 TRP A 980 40.019 145.637 -6.114 1.00 64.10 C ATOM 2132 CZ2 TRP A 980 40.047 145.381 -8.928 1.00 67.61 C ATOM 2133 CZ3 TRP A 980 40.620 144.563 -6.728 1.00 66.54 C ATOM 2134 CH2 TRP A 980 40.633 144.438 -8.118 1.00 67.61 C ATOM 2135 HE1 TRP A 980 38.628 147.716 -9.856 1.00 0.00 H ATOM 2136 H TRP A 980 38.523 149.966 -3.278 1.00 0.00 H ATOM 2137 N LEU A 981 35.513 149.113 -4.544 1.00 52.46 N ATOM 2138 CA LEU A 981 34.068 148.779 -4.645 1.00 48.87 C ATOM 2139 C LEU A 981 33.216 150.049 -4.645 1.00 50.66 C ATOM 2140 O LEU A 981 32.055 149.979 -5.097 1.00 49.09 O ATOM 2141 CB LEU A 981 33.667 147.903 -3.464 1.00 46.97 C ATOM 2142 CG LEU A 981 34.336 146.542 -3.411 1.00 46.71 C ATOM 2143 CD1 LEU A 981 34.254 145.959 -2.010 1.00 48.05 C ATOM 2144 CD2 LEU A 981 33.708 145.602 -4.414 1.00 46.99 C ATOM 2145 H LEU A 981 35.990 148.924 -3.639 1.00 0.00 H ATOM 2146 N LEU A 982 33.743 151.160 -4.133 1.00 55.24 N ATOM 2147 CA LEU A 982 32.941 152.395 -3.948 1.00 58.77 C ATOM 2148 C LEU A 982 33.223 153.364 -5.086 1.00 60.18 C ATOM 2149 O LEU A 982 32.791 154.530 -4.968 1.00 61.83 O ATOM 2150 CB LEU A 982 33.254 153.023 -2.591 1.00 60.54 C ATOM 2151 CG LEU A 982 32.830 152.187 -1.387 1.00 62.97 C ATOM 2152 CD1 LEU A 982 32.827 153.045 -0.121 1.00 63.71 C ATOM 2153 CD2 LEU A 982 31.465 151.532 -1.631 1.00 59.91 C ATOM 2154 H LEU A 982 34.745 151.162 -3.855 1.00 0.00 H ATOM 2155 N ASN A 983 33.891 152.897 -6.144 1.00 60.01 N ATOM 2156 CA ASN A 983 34.023 153.673 -7.406 1.00 62.96 C ATOM 2157 C ASN A 983 32.632 154.079 -7.903 1.00 63.52 C ATOM 2158 O ASN A 983 31.746 153.192 -7.972 1.00 63.53 O ATOM 2159 CB ASN A 983 34.782 152.910 -8.484 1.00 61.30 C ATOM 2160 CG ASN A 983 36.077 153.612 -8.817 1.00 64.37 C ATOM 2161 OD1 ASN A 983 36.095 154.573 -9.600 1.00 61.31 O ATOM 2162 ND2 ASN A 983 37.153 153.145 -8.204 1.00 65.68 N ATOM 2163 HD22 ASN A 983 37.072 152.334 -7.558 1.00 0.00 H ATOM 2164 HD21 ASN A 983 38.079 153.589 -8.369 1.00 0.00 H ATOM 2165 H ASN A 983 34.334 151.958 -6.083 1.00 0.00 H ATOM 2166 N HIS A 984 32.445 155.369 -8.194 1.00 66.18 N ATOM 2167 CA HIS A 984 31.183 155.941 -8.730 1.00 70.31 C ATOM 2168 C HIS A 984 30.866 155.296 -10.080 1.00 69.75 C ATOM 2169 O HIS A 984 29.685 155.005 -10.346 1.00 70.10 O ATOM 2170 CB HIS A 984 31.275 157.475 -8.809 1.00 75.29 C ATOM 2171 CG HIS A 984 30.745 158.097 -7.568 1.00 84.63 C ATOM 2172 ND1 HIS A 984 29.781 159.090 -7.581 1.00 93.77 N ATOM 2173 CD2 HIS A 984 30.986 157.804 -6.271 1.00 82.75 C ATOM 2174 CE1 HIS A 984 29.488 159.422 -6.337 1.00 93.85 C ATOM 2175 NE2 HIS A 984 30.201 158.631 -5.517 1.00 89.82 N ATOM 2176 H HIS A 984 33.240 156.020 -8.034 1.00 0.00 H ATOM 2177 N ASP A 985 31.898 155.083 -10.891 1.00 68.42 N ATOM 2178 CA ASP A 985 31.788 154.468 -12.233 1.00 69.02 C ATOM 2179 C ASP A 985 31.824 152.953 -12.047 1.00 63.61 C ATOM 2180 O ASP A 985 32.796 152.420 -11.525 1.00 60.35 O ATOM 2181 CB ASP A 985 32.891 155.020 -13.139 1.00 70.37 C ATOM 2182 CG ASP A 985 32.603 154.789 -14.602 1.00 74.11 C ATOM 2183 OD1 ASP A 985 32.016 153.719 -14.925 1.00 75.18 O ATOM 2184 OD2 ASP A 985 32.932 155.689 -15.397 1.00 78.80 O ATOM 2185 H ASP A 985 32.843 155.367 -10.561 1.00 0.00 H ATOM 2186 N PRO A 986 30.769 152.202 -12.431 1.00 62.48 N ATOM 2187 CA PRO A 986 30.745 150.758 -12.193 1.00 58.56 C ATOM 2188 C PRO A 986 31.818 150.041 -13.022 1.00 58.51 C ATOM 2189 O PRO A 986 32.253 148.999 -12.645 1.00 56.75 O ATOM 2190 CB PRO A 986 29.345 150.318 -12.621 1.00 56.46 C ATOM 2191 CG PRO A 986 28.862 151.402 -13.549 1.00 59.44 C ATOM 2192 CD PRO A 986 29.567 152.677 -13.129 1.00 62.00 C ATOM 2193 N ALA A 987 32.239 150.639 -14.131 1.00 63.66 N ATOM 2194 CA ALA A 987 33.263 150.063 -15.030 1.00 66.94 C ATOM 2195 C ALA A 987 34.605 149.953 -14.288 1.00 66.15 C ATOM 2196 O ALA A 987 35.428 149.101 -14.679 1.00 67.17 O ATOM 2197 CB ALA A 987 33.372 150.901 -16.284 1.00 70.41 C ATOM 2198 H ALA A 987 31.827 151.561 -14.380 1.00 0.00 H ATOM 2199 N LYS A 988 34.824 150.790 -13.271 1.00 62.54 N ATOM 2200 CA LYS A 988 36.107 150.872 -12.529 1.00 63.57 C ATOM 2201 C LYS A 988 36.070 149.995 -11.268 1.00 60.70 C ATOM 2202 O LYS A 988 37.136 149.802 -10.668 1.00 59.78 O ATOM 2203 CB LYS A 988 36.389 152.338 -12.207 1.00 68.96 C ATOM 2204 CG LYS A 988 36.428 153.276 -13.410 1.00 70.80 C ATOM 2205 CD LYS A 988 36.836 154.686 -13.025 1.00 74.41 C ATOM 2206 CE LYS A 988 36.561 155.719 -14.097 1.00 76.52 C ATOM 2207 NZ LYS A 988 37.516 156.858 -14.017 1.00 78.79 N ATOM 2208 HZ1 LYS A 988 37.429 157.317 -13.088 1.00 0.00 H ATOM 2209 HZ2 LYS A 988 38.486 156.505 -14.141 1.00 0.00 H ATOM 2210 HZ3 LYS A 988 37.297 157.545 -14.766 1.00 0.00 H ATOM 2211 H LYS A 988 34.050 151.422 -12.982 1.00 0.00 H ATOM 2212 N ARG A 989 34.894 149.478 -10.888 1.00 60.35 N ATOM 2213 CA ARG A 989 34.693 148.443 -9.830 1.00 57.53 C ATOM 2214 C ARG A 989 35.075 147.056 -10.349 1.00 60.62 C ATOM 2215 O ARG A 989 34.995 146.788 -11.557 1.00 58.57 O ATOM 2216 CB ARG A 989 33.226 148.356 -9.412 1.00 53.24 C ATOM 2217 CG ARG A 989 32.731 149.562 -8.639 1.00 54.91 C ATOM 2218 CD ARG A 989 31.238 149.479 -8.418 1.00 54.89 C ATOM 2219 NE ARG A 989 30.660 150.808 -8.392 1.00 59.28 N ATOM 2220 CZ ARG A 989 29.416 151.107 -8.756 1.00 63.45 C ATOM 2221 NH1 ARG A 989 28.584 150.164 -9.174 1.00 60.00 N ATOM 2222 NH2 ARG A 989 29.011 152.366 -8.691 1.00 65.87 N ATOM 2223 HE ARG A 989 31.264 151.588 -8.063 1.00 0.00 H ATOM 2224 HH12 ARG A 989 27.614 150.413 -9.455 1.00 0.00 H ATOM 2225 HH11 ARG A 989 28.901 149.175 -9.221 1.00 0.00 H ATOM 2226 HH22 ARG A 989 28.041 152.615 -8.972 1.00 0.00 H ATOM 2227 HH21 ARG A 989 29.663 153.105 -8.359 1.00 0.00 H ATOM 2228 H ARG A 989 34.044 149.829 -11.374 1.00 0.00 H ATOM 2229 N PRO A 990 35.457 146.114 -9.449 1.00 57.74 N ATOM 2230 CA PRO A 990 35.699 144.727 -9.844 1.00 59.08 C ATOM 2231 C PRO A 990 34.389 143.929 -9.906 1.00 57.19 C ATOM 2232 O PRO A 990 33.402 144.382 -9.376 1.00 54.25 O ATOM 2233 CB PRO A 990 36.592 144.212 -8.713 1.00 61.01 C ATOM 2234 CG PRO A 990 36.076 144.962 -7.492 1.00 60.12 C ATOM 2235 CD PRO A 990 35.662 146.328 -8.010 1.00 56.73 C ATOM 2236 N THR A 991 34.411 142.774 -10.572 1.00 57.17 N ATOM 2237 CA THR A 991 33.365 141.724 -10.457 1.00 52.87 C ATOM 2238 C THR A 991 33.659 140.930 -9.191 1.00 54.59 C ATOM 2239 O THR A 991 34.803 141.038 -8.718 1.00 58.29 O ATOM 2240 CB THR A 991 33.367 140.800 -11.675 1.00 51.47 C ATOM 2241 OG1 THR A 991 34.595 140.070 -11.635 1.00 48.67 O ATOM 2242 CG2 THR A 991 33.201 141.552 -12.979 1.00 51.66 C ATOM 2243 HG1 THR A 991 34.639 139.547 -10.796 1.00 0.00 H ATOM 2244 H THR A 991 35.211 142.596 -11.213 1.00 0.00 H ATOM 2245 N ALA A 992 32.681 140.180 -8.667 1.00 54.50 N ATOM 2246 CA ALA A 992 32.848 139.349 -7.448 1.00 51.97 C ATOM 2247 C ALA A 992 34.015 138.375 -7.657 1.00 53.92 C ATOM 2248 O ALA A 992 34.890 138.270 -6.755 1.00 54.57 O ATOM 2249 CB ALA A 992 31.584 138.605 -7.119 1.00 50.37 C ATOM 2250 H ALA A 992 31.755 140.180 -9.139 1.00 0.00 H ATOM 2251 N THR A 993 34.065 137.720 -8.820 1.00 51.51 N ATOM 2252 CA THR A 993 35.101 136.717 -9.133 1.00 51.63 C ATOM 2253 C THR A 993 36.438 137.420 -9.287 1.00 54.36 C ATOM 2254 O THR A 993 37.447 136.827 -8.915 1.00 61.51 O ATOM 2255 CB THR A 993 34.787 135.920 -10.391 1.00 53.88 C ATOM 2256 OG1 THR A 993 33.526 135.263 -10.229 1.00 64.01 O ATOM 2257 CG2 THR A 993 35.869 134.898 -10.643 1.00 56.83 C ATOM 2258 HG1 THR A 993 32.819 135.940 -10.079 1.00 0.00 H ATOM 2259 H THR A 993 33.341 137.926 -9.537 1.00 0.00 H ATOM 2260 N GLU A 994 36.436 138.638 -9.825 1.00 56.30 N ATOM 2261 CA GLU A 994 37.661 139.472 -9.961 1.00 57.71 C ATOM 2262 C GLU A 994 38.291 139.630 -8.573 1.00 55.69 C ATOM 2263 O GLU A 994 39.502 139.449 -8.452 1.00 59.33 O ATOM 2264 CB GLU A 994 37.315 140.823 -10.603 1.00 58.70 C ATOM 2265 CG GLU A 994 38.484 141.563 -11.229 1.00 59.81 C ATOM 2266 CD GLU A 994 38.098 142.873 -11.908 1.00 61.11 C ATOM 2267 OE1 GLU A 994 37.030 142.906 -12.571 1.00 54.87 O ATOM 2268 OE2 GLU A 994 38.875 143.870 -11.771 1.00 66.08 O ATOM 2269 H GLU A 994 35.534 139.026 -10.167 1.00 0.00 H ATOM 2270 N LEU A 995 37.482 139.913 -7.557 1.00 52.71 N ATOM 2271 CA LEU A 995 37.976 140.331 -6.224 1.00 54.57 C ATOM 2272 C LEU A 995 38.458 139.126 -5.425 1.00 56.97 C ATOM 2273 O LEU A 995 39.476 139.262 -4.729 1.00 62.73 O ATOM 2274 CB LEU A 995 36.873 141.060 -5.461 1.00 50.54 C ATOM 2275 CG LEU A 995 37.368 141.764 -4.210 1.00 48.86 C ATOM 2276 CD1 LEU A 995 38.551 142.648 -4.541 1.00 50.72 C ATOM 2277 CD2 LEU A 995 36.255 142.583 -3.599 1.00 48.86 C ATOM 2278 H LEU A 995 36.455 139.838 -7.704 1.00 0.00 H ATOM 2279 N LEU A 996 37.751 138.003 -5.504 1.00 55.01 N ATOM 2280 CA LEU A 996 38.239 136.743 -4.895 1.00 59.01 C ATOM 2281 C LEU A 996 39.641 136.439 -5.450 1.00 63.34 C ATOM 2282 O LEU A 996 40.538 136.127 -4.657 1.00 66.18 O ATOM 2283 CB LEU A 996 37.249 135.614 -5.193 1.00 58.48 C ATOM 2284 CG LEU A 996 35.876 135.737 -4.527 1.00 54.36 C ATOM 2285 CD1 LEU A 996 34.907 134.699 -5.078 1.00 50.77 C ATOM 2286 CD2 LEU A 996 35.975 135.606 -3.010 1.00 56.35 C ATOM 2287 H LEU A 996 36.838 138.009 -6.003 1.00 0.00 H ATOM 2288 N LYS A 997 39.828 136.556 -6.765 1.00 67.09 N ATOM 2289 CA LYS A 997 41.092 136.204 -7.464 1.00 75.52 C ATOM 2290 C LYS A 997 42.147 137.285 -7.208 1.00 81.90 C ATOM 2291 O LYS A 997 43.349 136.954 -7.244 1.00 87.59 O ATOM 2292 CB LYS A 997 40.851 136.007 -8.961 1.00 81.14 C ATOM 2293 CG LYS A 997 40.146 134.708 -9.328 1.00 87.75 C ATOM 2294 CD LYS A 997 40.164 134.448 -10.821 1.00 93.21 C ATOM 2295 CE LYS A 997 39.214 133.354 -11.253 1.00 91.97 C ATOM 2296 NZ LYS A 997 39.095 133.310 -12.729 1.00 95.72 N ATOM 2297 HZ1 LYS A 997 38.734 134.222 -13.074 1.00 0.00 H ATOM 2298 HZ2 LYS A 997 40.030 133.126 -13.146 1.00 0.00 H ATOM 2299 HZ3 LYS A 997 38.438 132.551 -13.000 1.00 0.00 H ATOM 2300 H LYS A 997 39.039 136.917 -7.339 1.00 0.00 H ATOM 2301 N SER A 998 41.726 138.528 -6.962 1.00 80.94 N ATOM 2302 CA SER A 998 42.602 139.593 -6.416 1.00 79.95 C ATOM 2303 C SER A 998 43.315 139.036 -5.185 1.00 81.42 C ATOM 2304 O SER A 998 42.703 138.226 -4.464 1.00 77.78 O ATOM 2305 CB SER A 998 41.824 140.827 -6.069 1.00 77.17 C ATOM 2306 OG SER A 998 42.551 141.625 -5.159 1.00 75.63 O ATOM 2307 HG SER A 998 42.026 142.435 -4.939 1.00 0.00 H ATOM 2308 H SER A 998 40.733 138.761 -7.164 1.00 0.00 H ATOM 2309 N GLU A 999 44.549 139.470 -4.951 1.00 86.74 N ATOM 2310 CA GLU A 999 45.360 139.058 -3.779 1.00 95.26 C ATOM 2311 C GLU A 999 45.318 140.163 -2.706 1.00 97.23 C ATOM 2312 O GLU A 999 46.372 140.429 -2.093 1.00112.41 O ATOM 2313 CB GLU A 999 46.772 138.734 -4.280 1.00103.70 C ATOM 2314 CG GLU A 999 47.669 138.047 -3.254 1.00107.73 C ATOM 2315 CD GLU A 999 49.004 138.743 -3.030 1.00108.10 C ATOM 2316 OE1 GLU A 999 49.084 139.952 -3.303 1.00106.67 O ATOM 2317 OE2 GLU A 999 49.955 138.080 -2.588 1.00111.37 O ATOM 2318 H GLU A 999 44.971 140.137 -5.629 1.00 0.00 H ATOM 2319 N LEU A1000 44.160 140.805 -2.501 1.00 90.59 N ATOM 2320 CA LEU A1000 43.918 141.756 -1.379 1.00 88.19 C ATOM 2321 C LEU A1000 43.227 141.007 -0.239 1.00 90.53 C ATOM 2322 O LEU A1000 43.249 141.527 0.889 1.00 96.63 O ATOM 2323 CB LEU A1000 43.052 142.936 -1.832 1.00 84.11 C ATOM 2324 CG LEU A1000 43.642 143.853 -2.906 1.00 83.81 C ATOM 2325 CD1 LEU A1000 42.592 144.849 -3.362 1.00 81.06 C ATOM 2326 CD2 LEU A1000 44.888 144.587 -2.428 1.00 83.04 C ATOM 2327 H LEU A1000 43.381 140.629 -3.167 1.00 0.00 H ATOM 2328 N LEU A1001 42.601 139.857 -0.524 1.00 86.42 N ATOM 2329 CA LEU A1001 42.091 138.921 0.513 1.00 84.16 C ATOM 2330 C LEU A1001 43.222 137.974 0.915 1.00 89.67 C ATOM 2331 O LEU A1001 44.261 137.943 0.253 1.00 91.15 O ATOM 2332 CB LEU A1001 40.906 138.130 -0.050 1.00 81.07 C ATOM 2333 CG LEU A1001 39.861 138.915 -0.845 1.00 76.37 C ATOM 2334 CD1 LEU A1001 38.629 138.059 -1.116 1.00 72.81 C ATOM 2335 CD2 LEU A1001 39.434 140.182 -0.130 1.00 74.09 C ATOM 2336 H LEU A1001 42.465 139.606 -1.524 1.00 0.00 H ATOM 2337 N PRO A1002 43.103 137.238 2.045 1.00 89.35 N ATOM 2338 CA PRO A1002 43.879 136.018 2.281 1.00 89.14 C ATOM 2339 C PRO A1002 43.050 134.736 2.490 1.00 84.29 C ATOM 2340 O PRO A1002 43.613 133.651 2.772 1.00 82.99 O ATOM 2341 CB PRO A1002 44.580 136.440 3.575 1.00 90.60 C ATOM 2342 CG PRO A1002 43.600 137.425 4.254 1.00 89.82 C ATOM 2343 CD PRO A1002 42.462 137.682 3.284 1.00 85.95 C TER 2344 PRO A1002 HETATM 2345 O HOH 1 39.685 134.643 7.884 1.00 53.95 O HETATM 2346 O HOH 2 34.205 130.289 4.916 1.00 49.45 O HETATM 2347 O HOH 3 20.517 155.666 16.878 1.00 59.53 O HETATM 2348 O HOH 4 13.758 121.396 6.985 1.00 40.20 O HETATM 2349 O HOH 5 32.460 156.810 -3.696 1.00 62.95 O HETATM 2350 O HOH 6 23.660 149.074 -5.809 1.00 57.76 O HETATM 2351 O HOH 7 22.680 145.667 -3.867 1.00 37.69 O HETATM 2352 O HOH 8 19.259 139.841 14.175 1.00 43.26 O HETATM 2353 O HOH 9 36.178 131.699 -2.184 1.00 54.39 O HETATM 2354 O HOH 10 30.107 152.972 -16.778 1.00 43.76 O HETATM 2355 O HOH 11 4.002 121.211 -2.937 1.00 47.34 O HETATM 2356 O HOH 12 -7.980 138.911 -7.085 1.00 43.27 O HETATM 2357 O HOH 13 18.496 140.015 -12.199 1.00 43.16 O HETATM 2358 O HOH 14 3.102 124.672 -5.762 1.00 40.85 O HETATM 2359 O HOH 15 2.649 120.255 8.522 1.00 45.23 O HETATM 2360 O HOH 16 29.744 149.841 11.421 1.00 45.40 O HETATM 2361 O HOH 17 15.068 125.369 7.733 1.00 40.26 O HETATM 2362 O HOH 18 21.910 127.024 1.669 1.00 52.03 O HETATM 2363 O HOH 19 31.658 137.918 -10.479 1.00 33.76 O HETATM 2364 O HOH 20 -1.697 126.803 13.307 1.00 53.51 O HETATM 2365 O HOH 21 27.725 163.085 12.871 1.00 42.87 O HETATM 2366 O HOH 22 28.771 137.033 -14.275 1.00 47.75 O HETATM 2367 O HOH 23 35.057 146.714 -16.976 1.00 48.47 O HETATM 2368 O HOH 24 20.231 127.836 9.624 1.00 57.05 O HETATM 2369 O HOH 25 33.690 134.552 -13.663 1.00 40.59 O HETATM 2370 O HOH 26 20.483 147.339 6.428 1.00 50.23 O HETATM 2371 O HOH 27 24.556 124.373 1.203 1.00 44.97 O HETATM 2372 C5 KAV A 28 15.597 135.901 -2.347 1.00 0.11 C HETATM 2373 C6 KAV A 28 16.707 135.231 -1.817 1.00 -0.00 C HETATM 2374 C7 KAV A 28 17.971 135.275 -2.367 1.00 -0.04 C HETATM 2375 C8 KAV A 28 18.099 136.037 -3.505 1.00 0.03 C HETATM 2376 C9 KAV A 28 17.036 136.739 -4.093 1.00 -0.04 C HETATM 2377 C10 KAV A 28 15.780 136.678 -3.514 1.00 -0.00 C HETATM 2378 H3 KAV A 28 14.948 137.219 -3.950 1.00 0.06 H HETATM 2379 H13 KAV A 28 17.197 137.323 -4.992 1.00 0.08 H HETATM 2380 C11 KAV A 28 19.440 136.115 -4.135 1.00 0.36 C HETATM 2381 F12 KAV A 28 19.617 135.187 -5.105 1.00 -0.24 F HETATM 2382 F13 KAV A 28 19.415 137.294 -4.782 1.00 -0.24 F HETATM 2383 F14 KAV A 28 20.492 135.928 -3.260 1.00 -0.24 F HETATM 2384 H2 KAV A 28 18.809 134.744 -1.931 1.00 0.08 H HETATM 2385 H1 KAV A 28 16.564 134.641 -0.919 1.00 0.06 H HETATM 2386 N4 KAV A 28 14.300 135.790 -1.734 1.00 -0.21 N HETATM 2387 C3 KAV A 28 13.988 135.608 -0.367 1.00 0.25 C HETATM 2388 N2 KAV A 28 12.834 135.050 0.106 1.00 -0.22 N HETATM 2389 C1 KAV A 28 11.687 134.510 -0.636 1.00 0.05 C HETATM 2390 H9 KAV A 28 11.870 134.609 -1.716 1.00 0.06 H HETATM 2391 H10 KAV A 28 10.779 135.069 -0.365 1.00 0.06 H HETATM 2392 H11 KAV A 28 11.553 133.448 -0.382 1.00 0.06 H HETATM 2393 C34 KAV A 28 12.896 135.065 1.479 1.00 0.07 C HETATM 2394 C16 KAV A 28 14.148 135.633 1.791 1.00 0.01 C HETATM 2395 C17 KAV A 28 14.529 135.763 3.140 1.00 -0.03 C HETATM 2396 C18 KAV A 28 13.661 135.315 4.142 1.00 0.10 C HETATM 2397 O19 KAV A 28 13.992 135.480 5.480 1.00 -0.24 O HETATM 2398 C20 KAV A 28 14.910 134.794 6.153 1.00 0.19 C HETATM 2399 C21 KAV A 28 15.085 135.109 7.484 1.00 0.04 C HETATM 2400 C22 KAV A 28 16.015 134.319 8.183 1.00 0.15 C HETATM 2401 N23 KAV A 28 16.316 134.514 9.560 1.00 -0.21 N HETATM 2402 C24 KAV A 28 16.076 135.584 10.342 1.00 0.21 C HETATM 2403 C26 KAV A 28 16.528 135.602 11.776 1.00 0.06 C HETATM 2404 C28 KAV A 28 15.992 136.708 12.674 1.00 -0.03 C HETATM 2405 C27 KAV A 28 17.432 136.772 12.153 1.00 -0.03 C HETATM 2406 H15 KAV A 28 17.711 137.519 11.395 1.00 0.03 H HETATM 2407 H16 KAV A 28 18.275 136.617 12.843 1.00 0.03 H HETATM 2408 H7 KAV A 28 15.800 136.508 13.739 1.00 0.03 H HETATM 2409 H8 KAV A 28 15.237 137.410 12.291 1.00 0.03 H HETATM 2410 H6 KAV A 28 16.696 134.585 12.161 1.00 0.05 H HETATM 2411 O25 KAV A 28 15.485 136.540 9.920 1.00 -0.38 O HETATM 2412 H14 KAV A 28 16.771 133.747 10.012 1.00 0.23 H HETATM 2413 N29 KAV A 28 16.724 133.356 7.518 1.00 -0.27 N HETATM 2414 C30 KAV A 28 16.543 133.111 6.234 1.00 0.06 C HETATM 2415 N31 KAV A 28 15.634 133.829 5.559 1.00 -0.26 N HETATM 2416 H17 KAV A 28 17.120 132.342 5.733 1.00 0.10 H HETATM 2417 H5 KAV A 28 14.540 135.915 7.962 1.00 0.06 H HETATM 2418 C32 KAV A 28 12.405 134.748 3.804 1.00 -0.04 C HETATM 2419 C33 KAV A 28 12.012 134.620 2.484 1.00 -0.05 C HETATM 2420 H19 KAV A 28 11.050 134.189 2.229 1.00 0.05 H HETATM 2421 H18 KAV A 28 11.743 134.410 4.593 1.00 0.05 H HETATM 2422 H4 KAV A 28 15.484 136.205 3.400 1.00 0.04 H HETATM 2423 N15 KAV A 28 14.744 135.937 0.640 1.00 -0.30 N HETATM 2424 H12 KAV A 28 13.495 135.851 -2.374 1.00 0.24 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 772 773 779 780 781 CONECT 779 772 CONECT 780 772 CONECT 781 772 CONECT 1523 1524 1528 1529 1530 CONECT 1528 1523 CONECT 1529 1523 CONECT 1530 1523 CONECT 1594 1595 1607 1608 1609 CONECT 1607 1594 CONECT 1608 1594 CONECT 1609 1594 CONECT 1978 1979 1989 1990 1991 CONECT 1989 1978 CONECT 1990 1978 CONECT 1991 1978 CONECT 2031 2032 2041 2042 2043 CONECT 2041 2031 CONECT 2042 2031 CONECT 2043 2031 CONECT 2372 2373 2377 2386 CONECT 2373 2372 2374 2385 CONECT 2374 2373 2375 2384 CONECT 2375 2374 2376 2380 CONECT 2376 2375 2377 2379 CONECT 2377 2372 2376 2378 CONECT 2378 2377 CONECT 2379 2376 CONECT 2380 2375 2381 2382 2383 CONECT 2381 2380 CONECT 2382 2380 CONECT 2383 2380 CONECT 2384 2374 CONECT 2385 2373 CONECT 2386 2372 2387 2424 CONECT 2387 2386 2388 2423 CONECT 2388 2387 2389 2393 CONECT 2389 2388 2390 2391 2392 CONECT 2390 2389 CONECT 2391 2389 CONECT 2392 2389 CONECT 2393 2388 2394 2419 CONECT 2394 2393 2395 2423 CONECT 2395 2394 2396 2422 CONECT 2396 2395 2397 2418 CONECT 2397 2396 2398 CONECT 2398 2397 2399 2415 CONECT 2399 2398 2400 2417 CONECT 2400 2399 2401 2413 CONECT 2401 2400 2402 2412 CONECT 2402 2401 2403 2411 CONECT 2403 2402 2404 2405 2410 CONECT 2404 2403 2405 2408 2409 CONECT 2405 2403 2404 2406 2407 CONECT 2406 2405 CONECT 2407 2405 CONECT 2408 2404 CONECT 2409 2404 CONECT 2410 2403 CONECT 2411 2402 CONECT 2412 2401 CONECT 2413 2400 2414 CONECT 2414 2413 2415 2416 CONECT 2415 2398 2414 CONECT 2416 2414 CONECT 2417 2399 CONECT 2418 2396 2419 2421 CONECT 2419 2393 2418 2420 CONECT 2420 2419 CONECT 2421 2418 CONECT 2422 2395 CONECT 2423 2387 2394 CONECT 2424 2386 MASTER 0 0 0 0 0 0 0 0 2418 6 77 20 END
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Structure:
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Related entries of code: 6n3l
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
6n3o
RCSB PDB
PDBbind
317aa, >6N3O_1|Chain... at 99%
6n3n
RCSB PDB
PDBbind
317aa, >6N3N_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6n3n
RCSB PDB
PDBbind
KAV
Entry Information
PDB ID
6n3l
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
GCN2
Ligand Name
KAV
EC.Number
E.C.-.-.-.-
Resolution
2.61(Å)
Affinity (Kd/Ki/IC50)
IC50=27nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Acs Med.Chem.Lett. Vol. 10: pp. 1498-1503
Ligand Properties
Formula
C
2
3
H
1
9
F
3
N
6
O
2
Molecular Weight
468.431
Exact Mass
468.152
No. of atoms
53
No. of bonds
57
Polar Surface Area
93.96
LOGP Value
4.31 (
Computed with XLOGP3
)
5.41 (
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: 5
Canonical SMILES
O=C(C1CC1)Nc1ncnc(c1)Oc1ccc2c(c1)nc(n2C)Nc1ccc(cc1)C(F)(F)F
InChI String
InChI=1S/C23H19F3N6O2/c1-32-18-9-8-16(34-20-11-19(27-12-28-20)31-21(33)13-2-3-13)10-17(18)30-22(32)29-15-6-4-14(5-7-15)23(24,25)26/h4-13H,2-3H2,1H3,(H,29,30)(H,27,28,31,33)
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):
Q9P2K8
Entrez Gene ID
NCBI Entrez Gene ID:
440275
ASD
Information of known allosteric effects of PDB entries
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