Browse entries in the PDBbind-CN Database
HEADER 1MV0_COMPLEX COMPND 1MV0_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 81 GLY ARG LEU ASP LEU PRO PRO GLY PHE MET PHE LYS VAL SEQRES 2 B 81 GLN ALA GLN HIS ASP TYR THR ALA THR ASP THR ASP GLU SEQRES 3 B 81 LEU GLN LEU LYS ALA GLY ASP VAL VAL LEU VAL ILE PRO SEQRES 4 B 81 PHE GLN ASN PRO GLU GLU GLN ASP GLU GLY TRP LEU MET SEQRES 5 B 81 GLY VAL LYS GLU SER ASP TRP ASN GLN HIS LYS LYS LEU SEQRES 6 B 81 GLU LYS CYS ARG GLY VAL PHE PRO GLU ASN PHE THR GLU SEQRES 7 B 81 ARG VAL PRO HET LEU A 82 219 ATOM 1 N GLY B 402 -29.692 -5.565 -13.484 1.00 0.00 N ATOM 2 CA GLY B 402 -28.655 -6.569 -13.317 1.00 0.00 C ATOM 3 C GLY B 402 -29.209 -7.975 -13.557 1.00 0.00 C ATOM 4 O GLY B 402 -30.301 -8.131 -14.100 1.00 0.00 O ATOM 5 HA3 GLY B 402 -28.261 -6.509 -12.303 1.00 0.00 H ATOM 6 HA2 GLY B 402 -27.853 -6.375 -14.029 1.00 0.00 H ATOM 7 HN3 GLY B 402 -30.458 -5.743 -12.803 1.00 0.00 H ATOM 8 HN2 GLY B 402 -30.068 -5.615 -14.452 1.00 0.00 H ATOM 9 HN1 GLY B 402 -29.289 -4.621 -13.316 1.00 0.00 H ATOM 10 N ARG B 403 -28.430 -8.962 -13.140 1.00 0.00 N ATOM 11 CA ARG B 403 -28.829 -10.350 -13.303 1.00 0.00 C ATOM 12 C ARG B 403 -29.973 -10.689 -12.346 1.00 0.00 C ATOM 13 O ARG B 403 -30.519 -9.805 -11.688 1.00 0.00 O ATOM 14 CB ARG B 403 -27.655 -11.295 -13.040 1.00 0.00 C ATOM 15 CG ARG B 403 -27.385 -11.429 -11.540 1.00 0.00 C ATOM 16 CD ARG B 403 -26.700 -10.175 -10.992 1.00 0.00 C ATOM 17 NE ARG B 403 -27.714 -9.152 -10.653 1.00 0.00 N ATOM 18 CZ ARG B 403 -27.463 -8.060 -9.917 1.00 0.00 C ATOM 19 NH1 ARG B 403 -26.231 -7.844 -9.439 1.00 0.00 N ATOM 20 NH2 ARG B 403 -28.445 -7.185 -9.660 1.00 0.00 N ATOM 21 HA ARG B 403 -29.162 -10.481 -14.333 1.00 0.00 H ATOM 22 HB2 ARG B 403 -27.889 -12.278 -13.450 1.00 0.00 H ATOM 23 HB3 ARG B 403 -26.764 -10.902 -13.529 1.00 0.00 H ATOM 24 HG2 ARG B 403 -28.331 -11.575 -11.019 1.00 0.00 H ATOM 25 HG3 ARG B 403 -26.740 -12.291 -11.369 1.00 0.00 H ATOM 26 HD2 ARG B 403 -26.021 -9.775 -11.746 1.00 0.00 H ATOM 27 HD3 ARG B 403 -26.135 -10.434 -10.097 1.00 0.00 H ATOM 28 HE ARG B 403 -28.682 -9.289 -11.008 1.00 0.00 H ATOM 29 HH12 ARG B 403 -26.036 -6.997 -8.868 1.00 0.00 H ATOM 30 HH11 ARG B 403 -25.469 -8.523 -9.639 1.00 0.00 H ATOM 31 HH22 ARG B 403 -28.250 -6.338 -9.089 1.00 0.00 H ATOM 32 HH21 ARG B 403 -29.402 -7.353 -10.032 1.00 0.00 H ATOM 33 H ARG B 403 -27.519 -8.740 -12.689 1.00 0.00 H ATOM 34 N LEU B 404 -30.302 -11.972 -12.299 1.00 0.00 N ATOM 35 CA LEU B 404 -31.371 -12.439 -11.433 1.00 0.00 C ATOM 36 C LEU B 404 -30.828 -13.520 -10.497 1.00 0.00 C ATOM 37 O LEU B 404 -31.152 -13.540 -9.311 1.00 0.00 O ATOM 38 CB LEU B 404 -32.574 -12.891 -12.263 1.00 0.00 C ATOM 39 CG LEU B 404 -32.346 -14.103 -13.168 1.00 0.00 C ATOM 40 CD1 LEU B 404 -33.564 -15.029 -13.161 1.00 0.00 C ATOM 41 CD2 LEU B 404 -31.967 -13.666 -14.585 1.00 0.00 C ATOM 42 HA LEU B 404 -31.734 -11.626 -10.804 1.00 0.00 H ATOM 43 HB2 LEU B 404 -33.382 -13.136 -11.574 1.00 0.00 H ATOM 44 HB3 LEU B 404 -32.877 -12.055 -12.894 1.00 0.00 H ATOM 45 HG LEU B 404 -31.506 -14.672 -12.771 1.00 0.00 H ATOM 46 HD21 LEU B 404 -32.771 -13.062 -15.005 1.00 0.00 H ATOM 47 HD22 LEU B 404 -31.050 -13.078 -14.549 1.00 0.00 H ATOM 48 HD23 LEU B 404 -31.811 -14.548 -15.206 1.00 0.00 H ATOM 49 HD11 LEU B 404 -33.746 -15.380 -12.145 1.00 0.00 H ATOM 50 HD12 LEU B 404 -34.436 -14.483 -13.520 1.00 0.00 H ATOM 51 HD13 LEU B 404 -33.374 -15.882 -13.813 1.00 0.00 H ATOM 52 H LEU B 404 -29.787 -12.655 -12.891 1.00 0.00 H ATOM 53 N ASP B 405 -30.009 -14.394 -11.066 1.00 0.00 N ATOM 54 CA ASP B 405 -29.419 -15.476 -10.298 1.00 0.00 C ATOM 55 C ASP B 405 -27.926 -15.202 -10.103 1.00 0.00 C ATOM 56 O ASP B 405 -27.310 -14.503 -10.906 1.00 0.00 O ATOM 57 CB ASP B 405 -29.562 -16.812 -11.028 1.00 0.00 C ATOM 58 CG ASP B 405 -30.940 -17.070 -11.641 1.00 0.00 C ATOM 59 OD1 ASP B 405 -31.907 -16.452 -11.144 1.00 0.00 O ATOM 60 OD2 ASP B 405 -30.996 -17.878 -12.592 1.00 0.00 O ATOM 61 HA ASP B 405 -29.937 -15.531 -9.341 1.00 0.00 H ATOM 62 HB2 ASP B 405 -28.824 -16.840 -11.830 1.00 0.00 H ATOM 63 HB3 ASP B 405 -29.353 -17.611 -10.316 1.00 0.00 H ATOM 64 H ASP B 405 -29.786 -14.303 -12.078 1.00 0.00 H ATOM 65 N LEU B 406 -27.388 -15.766 -9.031 1.00 0.00 N ATOM 66 CA LEU B 406 -25.980 -15.590 -8.720 1.00 0.00 C ATOM 67 C LEU B 406 -25.162 -16.648 -9.465 1.00 0.00 C ATOM 68 O LEU B 406 -25.697 -17.676 -9.876 1.00 0.00 O ATOM 69 CB LEU B 406 -25.761 -15.597 -7.206 1.00 0.00 C ATOM 70 CG LEU B 406 -25.032 -16.817 -6.639 1.00 0.00 C ATOM 71 CD1 LEU B 406 -24.382 -16.491 -5.293 1.00 0.00 C ATOM 72 CD2 LEU B 406 -25.970 -18.022 -6.546 1.00 0.00 C ATOM 73 HA LEU B 406 -25.632 -14.616 -9.064 1.00 0.00 H ATOM 74 HB2 LEU B 406 -25.180 -14.712 -6.949 1.00 0.00 H ATOM 75 HB3 LEU B 406 -26.739 -15.540 -6.727 1.00 0.00 H ATOM 76 HG LEU B 406 -24.230 -17.086 -7.327 1.00 0.00 H ATOM 77 HD21 LEU B 406 -26.807 -17.779 -5.892 1.00 0.00 H ATOM 78 HD22 LEU B 406 -26.343 -18.268 -7.540 1.00 0.00 H ATOM 79 HD23 LEU B 406 -25.425 -18.874 -6.140 1.00 0.00 H ATOM 80 HD11 LEU B 406 -23.662 -15.683 -5.425 1.00 0.00 H ATOM 81 HD12 LEU B 406 -25.151 -16.182 -4.585 1.00 0.00 H ATOM 82 HD13 LEU B 406 -23.871 -17.376 -4.914 1.00 0.00 H ATOM 83 H LEU B 406 -27.983 -16.343 -8.403 1.00 0.00 H ATOM 84 N PRO B 407 -23.844 -16.351 -9.619 1.00 0.00 N ATOM 85 CA PRO B 407 -22.947 -17.264 -10.307 1.00 0.00 C ATOM 86 C PRO B 407 -22.608 -18.467 -9.425 1.00 0.00 C ATOM 87 O PRO B 407 -22.283 -18.308 -8.249 1.00 0.00 O ATOM 88 CB PRO B 407 -21.729 -16.426 -10.662 1.00 0.00 C ATOM 89 CG PRO B 407 -21.786 -15.204 -9.759 1.00 0.00 C ATOM 90 CD PRO B 407 -23.175 -15.142 -9.145 1.00 0.00 C ATOM 91 HA PRO B 407 -23.392 -17.696 -11.204 1.00 0.00 H ATOM 92 HD3 PRO B 407 -23.115 -15.137 -8.057 1.00 0.00 H ATOM 93 HD2 PRO B 407 -23.705 -14.251 -9.482 1.00 0.00 H ATOM 94 HG3 PRO B 407 -21.598 -14.303 -10.342 1.00 0.00 H ATOM 95 HG2 PRO B 407 -21.036 -15.289 -8.972 1.00 0.00 H ATOM 96 HB2 PRO B 407 -20.814 -16.990 -10.480 1.00 0.00 H ATOM 97 HB3 PRO B 407 -21.767 -16.126 -11.709 1.00 0.00 H ATOM 98 N PRO B 408 -22.697 -19.676 -10.043 1.00 0.00 N ATOM 99 CA PRO B 408 -22.403 -20.905 -9.327 1.00 0.00 C ATOM 100 C PRO B 408 -20.896 -21.079 -9.131 1.00 0.00 C ATOM 101 O PRO B 408 -20.107 -20.728 -10.008 1.00 0.00 O ATOM 102 CB PRO B 408 -23.023 -22.008 -10.169 1.00 0.00 C ATOM 103 CG PRO B 408 -23.234 -21.410 -11.551 1.00 0.00 C ATOM 104 CD PRO B 408 -23.079 -19.902 -11.434 1.00 0.00 C ATOM 105 HA PRO B 408 -22.815 -20.912 -8.318 1.00 0.00 H ATOM 106 HD3 PRO B 408 -22.303 -19.541 -12.110 1.00 0.00 H ATOM 107 HD2 PRO B 408 -24.019 -19.400 -11.661 1.00 0.00 H ATOM 108 HG3 PRO B 408 -24.233 -21.653 -11.912 1.00 0.00 H ATOM 109 HG2 PRO B 408 -22.492 -21.807 -12.244 1.00 0.00 H ATOM 110 HB2 PRO B 408 -22.352 -22.865 -10.225 1.00 0.00 H ATOM 111 HB3 PRO B 408 -23.976 -22.321 -9.742 1.00 0.00 H ATOM 112 N GLY B 409 -20.540 -21.619 -7.975 1.00 0.00 N ATOM 113 CA GLY B 409 -19.141 -21.843 -7.652 1.00 0.00 C ATOM 114 C GLY B 409 -18.532 -20.616 -6.971 1.00 0.00 C ATOM 115 O GLY B 409 -17.532 -20.726 -6.264 1.00 0.00 O ATOM 116 HA3 GLY B 409 -18.592 -22.051 -8.570 1.00 0.00 H ATOM 117 HA2 GLY B 409 -19.062 -22.699 -6.982 1.00 0.00 H ATOM 118 H GLY B 409 -21.273 -21.887 -7.288 1.00 0.00 H ATOM 119 N PHE B 410 -19.161 -19.474 -7.208 1.00 0.00 N ATOM 120 CA PHE B 410 -18.693 -18.227 -6.627 1.00 0.00 C ATOM 121 C PHE B 410 -18.163 -18.449 -5.209 1.00 0.00 C ATOM 122 O PHE B 410 -18.672 -19.295 -4.477 1.00 0.00 O ATOM 123 CB PHE B 410 -19.896 -17.283 -6.567 1.00 0.00 C ATOM 124 CG PHE B 410 -19.754 -16.160 -5.538 1.00 0.00 C ATOM 125 CD1 PHE B 410 -19.009 -15.060 -5.830 1.00 0.00 C ATOM 126 CD2 PHE B 410 -20.374 -16.261 -4.331 1.00 0.00 C ATOM 127 CE1 PHE B 410 -18.878 -14.018 -4.875 1.00 0.00 C ATOM 128 CE2 PHE B 410 -20.242 -15.218 -3.376 1.00 0.00 C ATOM 129 CZ PHE B 410 -19.497 -14.119 -3.668 1.00 0.00 C ATOM 130 HA PHE B 410 -17.883 -17.816 -7.229 1.00 0.00 H ATOM 131 HB2 PHE B 410 -20.028 -16.832 -7.551 1.00 0.00 H ATOM 132 HB3 PHE B 410 -20.780 -17.869 -6.316 1.00 0.00 H ATOM 133 HD2 PHE B 410 -20.972 -17.142 -4.097 1.00 0.00 H ATOM 134 HE2 PHE B 410 -20.738 -15.299 -2.409 1.00 0.00 H ATOM 135 HZ PHE B 410 -19.396 -13.319 -2.935 1.00 0.00 H ATOM 136 HE1 PHE B 410 -18.281 -13.137 -5.109 1.00 0.00 H ATOM 137 HD1 PHE B 410 -18.513 -14.979 -6.797 1.00 0.00 H ATOM 138 H PHE B 410 -20.002 -19.470 -7.819 1.00 0.00 H ATOM 139 N MET B 411 -17.145 -17.673 -4.864 1.00 0.00 N ATOM 140 CA MET B 411 -16.540 -17.773 -3.547 1.00 0.00 C ATOM 141 C MET B 411 -16.918 -16.572 -2.678 1.00 0.00 C ATOM 142 O MET B 411 -17.697 -16.704 -1.735 1.00 0.00 O ATOM 143 CB MET B 411 -15.019 -17.843 -3.688 1.00 0.00 C ATOM 144 CG MET B 411 -14.604 -19.013 -4.582 1.00 0.00 C ATOM 145 SD MET B 411 -12.861 -19.344 -4.387 1.00 0.00 S ATOM 146 CE MET B 411 -12.361 -19.390 -6.100 1.00 0.00 C ATOM 147 HA MET B 411 -16.911 -18.678 -3.065 1.00 0.00 H ATOM 148 HB2 MET B 411 -14.658 -16.913 -4.127 1.00 0.00 H ATOM 149 HB3 MET B 411 -14.575 -17.973 -2.701 1.00 0.00 H ATOM 150 HG2 MET B 411 -14.810 -18.763 -5.623 1.00 0.00 H ATOM 151 HG3 MET B 411 -15.173 -19.900 -4.303 1.00 0.00 H ATOM 152 HE1 MET B 411 -12.907 -20.180 -6.616 1.00 0.00 H ATOM 153 HE2 MET B 411 -12.581 -18.430 -6.567 1.00 0.00 H ATOM 154 HE3 MET B 411 -11.291 -19.588 -6.160 1.00 0.00 H ATOM 155 H MET B 411 -16.774 -16.982 -5.547 1.00 0.00 H ATOM 156 N PHE B 412 -16.349 -15.427 -3.026 1.00 0.00 N ATOM 157 CA PHE B 412 -16.614 -14.204 -2.289 1.00 0.00 C ATOM 158 C PHE B 412 -16.350 -12.972 -3.157 1.00 0.00 C ATOM 159 O PHE B 412 -15.975 -13.098 -4.321 1.00 0.00 O ATOM 160 CB PHE B 412 -15.659 -14.186 -1.094 1.00 0.00 C ATOM 161 CG PHE B 412 -14.206 -14.499 -1.454 1.00 0.00 C ATOM 162 CD1 PHE B 412 -13.376 -13.501 -1.860 1.00 0.00 C ATOM 163 CD2 PHE B 412 -13.744 -15.775 -1.368 1.00 0.00 C ATOM 164 CE1 PHE B 412 -12.027 -13.792 -2.194 1.00 0.00 C ATOM 165 CE2 PHE B 412 -12.395 -16.066 -1.702 1.00 0.00 C ATOM 166 CZ PHE B 412 -11.565 -15.068 -2.108 1.00 0.00 C ATOM 167 HA PHE B 412 -17.658 -14.177 -1.976 1.00 0.00 H ATOM 168 HB2 PHE B 412 -15.694 -13.195 -0.641 1.00 0.00 H ATOM 169 HB3 PHE B 412 -16.000 -14.927 -0.371 1.00 0.00 H ATOM 170 HD2 PHE B 412 -14.409 -16.575 -1.043 1.00 0.00 H ATOM 171 HE2 PHE B 412 -12.025 -17.089 -1.633 1.00 0.00 H ATOM 172 HZ PHE B 412 -10.529 -15.291 -2.364 1.00 0.00 H ATOM 173 HE1 PHE B 412 -11.362 -12.992 -2.519 1.00 0.00 H ATOM 174 HD1 PHE B 412 -13.746 -12.478 -1.929 1.00 0.00 H ATOM 175 H PHE B 412 -15.702 -15.404 -3.840 1.00 0.00 H ATOM 176 N LYS B 413 -16.556 -11.809 -2.556 1.00 0.00 N ATOM 177 CA LYS B 413 -16.345 -10.556 -3.260 1.00 0.00 C ATOM 178 C LYS B 413 -15.013 -9.946 -2.818 1.00 0.00 C ATOM 179 O LYS B 413 -14.610 -10.095 -1.666 1.00 0.00 O ATOM 180 CB LYS B 413 -17.543 -9.624 -3.065 1.00 0.00 C ATOM 181 CG LYS B 413 -17.629 -8.598 -4.197 1.00 0.00 C ATOM 182 CD LYS B 413 -17.850 -7.189 -3.644 1.00 0.00 C ATOM 183 CE LYS B 413 -16.516 -6.485 -3.387 1.00 0.00 C ATOM 184 NZ LYS B 413 -16.627 -5.569 -2.230 1.00 0.00 N ATOM 185 HA LYS B 413 -16.276 -10.729 -4.334 1.00 0.00 H ATOM 186 HB2 LYS B 413 -18.458 -10.217 -3.050 1.00 0.00 H ATOM 187 HB3 LYS B 413 -17.436 -9.100 -2.115 1.00 0.00 H ATOM 188 HG2 LYS B 413 -16.700 -8.616 -4.766 1.00 0.00 H ATOM 189 HG3 LYS B 413 -18.460 -8.859 -4.852 1.00 0.00 H ATOM 190 HD2 LYS B 413 -18.426 -6.609 -4.365 1.00 0.00 H ATOM 191 HD3 LYS B 413 -18.404 -7.256 -2.708 1.00 0.00 H ATOM 192 HE2 LYS B 413 -16.236 -5.913 -4.272 1.00 0.00 H ATOM 193 HE3 LYS B 413 -15.750 -7.232 -3.181 1.00 0.00 H ATOM 194 HZ1 LYS B 413 -17.355 -4.853 -2.425 1.00 0.00 H ATOM 195 HZ2 LYS B 413 -16.891 -6.112 -1.383 1.00 0.00 H ATOM 196 HZ3 LYS B 413 -15.712 -5.101 -2.071 1.00 0.00 H ATOM 197 H LYS B 413 -16.873 -11.793 -1.566 1.00 0.00 H ATOM 198 N VAL B 414 -14.367 -9.271 -3.758 1.00 0.00 N ATOM 199 CA VAL B 414 -13.089 -8.639 -3.481 1.00 0.00 C ATOM 200 C VAL B 414 -13.135 -7.181 -3.941 1.00 0.00 C ATOM 201 O VAL B 414 -14.051 -6.781 -4.658 1.00 0.00 O ATOM 202 CB VAL B 414 -11.958 -9.437 -4.134 1.00 0.00 C ATOM 203 CG1 VAL B 414 -12.186 -10.942 -3.974 1.00 0.00 C ATOM 204 CG2 VAL B 414 -11.801 -9.060 -5.608 1.00 0.00 C ATOM 205 HA VAL B 414 -12.889 -8.635 -2.409 1.00 0.00 H ATOM 206 HB VAL B 414 -11.030 -9.182 -3.623 1.00 0.00 H ATOM 207 HG11 VAL B 414 -12.224 -11.192 -2.914 1.00 0.00 H ATOM 208 HG12 VAL B 414 -13.128 -11.218 -4.448 1.00 0.00 H ATOM 209 HG13 VAL B 414 -11.368 -11.485 -4.447 1.00 0.00 H ATOM 210 HG21 VAL B 414 -12.730 -9.272 -6.137 1.00 0.00 H ATOM 211 HG22 VAL B 414 -11.571 -7.998 -5.687 1.00 0.00 H ATOM 212 HG23 VAL B 414 -10.991 -9.642 -6.046 1.00 0.00 H ATOM 213 H VAL B 414 -14.782 -9.193 -4.709 1.00 0.00 H ATOM 214 N GLN B 415 -12.135 -6.426 -3.511 1.00 0.00 N ATOM 215 CA GLN B 415 -12.049 -5.021 -3.870 1.00 0.00 C ATOM 216 C GLN B 415 -10.625 -4.670 -4.305 1.00 0.00 C ATOM 217 O GLN B 415 -9.662 -5.001 -3.615 1.00 0.00 O ATOM 218 CB GLN B 415 -12.504 -4.130 -2.713 1.00 0.00 C ATOM 219 CG GLN B 415 -12.137 -2.667 -2.969 1.00 0.00 C ATOM 220 CD GLN B 415 -13.391 -1.800 -3.089 1.00 0.00 C ATOM 221 OE1 GLN B 415 -14.147 -1.623 -2.148 1.00 0.00 O ATOM 222 NE2 GLN B 415 -13.570 -1.270 -4.296 1.00 0.00 N ATOM 223 HA GLN B 415 -12.720 -4.840 -4.710 1.00 0.00 H ATOM 224 HB2 GLN B 415 -13.585 -4.212 -2.603 1.00 0.00 H ATOM 225 HB3 GLN B 415 -12.021 -4.463 -1.795 1.00 0.00 H ATOM 226 HG2 GLN B 415 -11.529 -2.302 -2.142 1.00 0.00 H ATOM 227 HG3 GLN B 415 -11.566 -2.599 -3.895 1.00 0.00 H ATOM 228 HE22 GLN B 415 -12.885 -1.462 -5.055 1.00 0.00 H ATOM 229 HE21 GLN B 415 -14.395 -0.664 -4.481 1.00 0.00 H ATOM 230 H GLN B 415 -11.400 -6.846 -2.907 1.00 0.00 H ATOM 231 N ALA B 416 -10.536 -4.004 -5.447 1.00 0.00 N ATOM 232 CA ALA B 416 -9.246 -3.604 -5.982 1.00 0.00 C ATOM 233 C ALA B 416 -8.713 -2.413 -5.183 1.00 0.00 C ATOM 234 O ALA B 416 -9.487 -1.670 -4.581 1.00 0.00 O ATOM 235 CB ALA B 416 -9.386 -3.290 -7.473 1.00 0.00 C ATOM 236 HA ALA B 416 -8.524 -4.415 -5.886 1.00 0.00 H ATOM 237 HB1 ALA B 416 -9.738 -4.178 -7.998 1.00 0.00 H ATOM 238 HB2 ALA B 416 -10.102 -2.479 -7.607 1.00 0.00 H ATOM 239 HB3 ALA B 416 -8.417 -2.990 -7.872 1.00 0.00 H ATOM 240 H ALA B 416 -11.403 -3.764 -5.968 1.00 0.00 H ATOM 241 N GLN B 417 -7.396 -2.269 -5.203 1.00 0.00 N ATOM 242 CA GLN B 417 -6.752 -1.181 -4.488 1.00 0.00 C ATOM 243 C GLN B 417 -5.859 -0.378 -5.436 1.00 0.00 C ATOM 244 O GLN B 417 -5.207 0.578 -5.019 1.00 0.00 O ATOM 245 CB GLN B 417 -5.951 -1.708 -3.295 1.00 0.00 C ATOM 246 CG GLN B 417 -6.625 -2.937 -2.682 1.00 0.00 C ATOM 247 CD GLN B 417 -6.013 -3.276 -1.321 1.00 0.00 C ATOM 248 OE1 GLN B 417 -5.969 -2.463 -0.412 1.00 0.00 O ATOM 249 NE2 GLN B 417 -5.547 -4.518 -1.231 1.00 0.00 N ATOM 250 HA GLN B 417 -7.526 -0.518 -4.100 1.00 0.00 H ATOM 251 HB2 GLN B 417 -4.950 -1.980 -3.630 1.00 0.00 H ATOM 252 HB3 GLN B 417 -5.880 -0.926 -2.539 1.00 0.00 H ATOM 253 HG2 GLN B 417 -7.688 -2.734 -2.555 1.00 0.00 H ATOM 254 HG3 GLN B 417 -6.496 -3.786 -3.353 1.00 0.00 H ATOM 255 HE22 GLN B 417 -5.617 -5.160 -2.046 1.00 0.00 H ATOM 256 HE21 GLN B 417 -5.113 -4.848 -0.345 1.00 0.00 H ATOM 257 H GLN B 417 -6.815 -2.945 -5.739 1.00 0.00 H ATOM 258 N HIS B 418 -5.859 -0.795 -6.693 1.00 0.00 N ATOM 259 CA HIS B 418 -5.058 -0.126 -7.704 1.00 0.00 C ATOM 260 C HIS B 418 -5.800 -0.144 -9.042 1.00 0.00 C ATOM 261 O HIS B 418 -6.814 -0.826 -9.184 1.00 0.00 O ATOM 262 CB HIS B 418 -3.663 -0.749 -7.791 1.00 0.00 C ATOM 263 CG HIS B 418 -2.804 -0.504 -6.573 1.00 0.00 C ATOM 264 ND1 HIS B 418 -1.923 0.559 -6.479 1.00 0.00 N ATOM 265 CD2 HIS B 418 -2.701 -1.195 -5.402 1.00 0.00 C ATOM 266 CE1 HIS B 418 -1.322 0.500 -5.300 1.00 0.00 C ATOM 267 NE2 HIS B 418 -1.805 -0.588 -4.634 1.00 0.00 N ATOM 268 HA HIS B 418 -4.910 0.917 -7.425 1.00 0.00 H ATOM 269 HB2 HIS B 418 -3.775 -1.825 -7.921 1.00 0.00 H ATOM 270 HB3 HIS B 418 -3.154 -0.331 -8.659 1.00 0.00 H ATOM 271 HD2 HIS B 418 -3.260 -2.094 -5.141 1.00 0.00 H ATOM 272 HE1 HIS B 418 -0.573 1.198 -4.927 1.00 0.00 H ATOM 273 H HIS B 418 -6.441 -1.614 -6.961 1.00 0.00 H ATOM 274 N ASP B 419 -5.266 0.613 -9.988 1.00 0.00 N ATOM 275 CA ASP B 419 -5.864 0.693 -11.310 1.00 0.00 C ATOM 276 C ASP B 419 -4.936 0.026 -12.327 1.00 0.00 C ATOM 277 O ASP B 419 -3.944 0.619 -12.749 1.00 0.00 O ATOM 278 CB ASP B 419 -6.065 2.148 -11.737 1.00 0.00 C ATOM 279 CG ASP B 419 -4.778 2.962 -11.887 1.00 0.00 C ATOM 280 OD1 ASP B 419 -4.087 3.126 -10.859 1.00 0.00 O ATOM 281 OD2 ASP B 419 -4.515 3.401 -13.028 1.00 0.00 O ATOM 282 HA ASP B 419 -6.831 0.191 -11.273 1.00 0.00 H ATOM 283 HB2 ASP B 419 -6.581 2.151 -12.697 1.00 0.00 H ATOM 284 HB3 ASP B 419 -6.689 2.637 -10.989 1.00 0.00 H ATOM 285 H ASP B 419 -4.405 1.159 -9.782 1.00 0.00 H ATOM 286 N TYR B 420 -5.290 -1.197 -12.690 1.00 0.00 N ATOM 287 CA TYR B 420 -4.501 -1.951 -13.649 1.00 0.00 C ATOM 288 C TYR B 420 -5.299 -2.222 -14.926 1.00 0.00 C ATOM 289 O TYR B 420 -6.216 -3.042 -14.927 1.00 0.00 O ATOM 290 CB TYR B 420 -4.177 -3.285 -12.973 1.00 0.00 C ATOM 291 CG TYR B 420 -4.058 -4.462 -13.943 1.00 0.00 C ATOM 292 CD1 TYR B 420 -2.947 -4.581 -14.752 1.00 0.00 C ATOM 293 CD2 TYR B 420 -5.063 -5.406 -14.008 1.00 0.00 C ATOM 294 CE1 TYR B 420 -2.835 -5.689 -15.665 1.00 0.00 C ATOM 295 CE2 TYR B 420 -4.952 -6.514 -14.921 1.00 0.00 C ATOM 296 CZ TYR B 420 -3.844 -6.601 -15.704 1.00 0.00 C ATOM 297 OH TYR B 420 -3.739 -7.647 -16.567 1.00 0.00 O ATOM 298 HA TYR B 420 -3.606 -1.395 -13.929 1.00 0.00 H ATOM 299 HB3 TYR B 420 -4.969 -3.508 -12.258 1.00 0.00 H ATOM 300 HB2 TYR B 420 -3.230 -3.180 -12.443 1.00 0.00 H ATOM 301 HD2 TYR B 420 -5.941 -5.313 -13.368 1.00 0.00 H ATOM 302 HE2 TYR B 420 -5.739 -7.266 -14.983 1.00 0.00 H ATOM 303 HE1 TYR B 420 -1.962 -5.795 -16.310 1.00 0.00 H ATOM 304 HD1 TYR B 420 -2.153 -3.836 -14.700 1.00 0.00 H ATOM 305 HH TYR B 420 -4.497 -7.626 -17.203 1.00 0.00 H ATOM 306 H TYR B 420 -6.146 -1.625 -12.282 1.00 0.00 H ATOM 307 N THR B 421 -4.922 -1.516 -15.982 1.00 0.00 N ATOM 308 CA THR B 421 -5.592 -1.670 -17.262 1.00 0.00 C ATOM 309 C THR B 421 -5.155 -2.971 -17.939 1.00 0.00 C ATOM 310 O THR B 421 -3.995 -3.118 -18.320 1.00 0.00 O ATOM 311 CB THR B 421 -5.303 -0.423 -18.100 1.00 0.00 C ATOM 312 OG1 THR B 421 -6.194 0.559 -17.579 1.00 0.00 O ATOM 313 CG2 THR B 421 -5.736 -0.584 -19.558 1.00 0.00 C ATOM 314 HA THR B 421 -6.672 -1.752 -17.136 1.00 0.00 H ATOM 315 HB THR B 421 -4.237 -0.199 -18.061 1.00 0.00 H ATOM 316 HG1 THR B 421 -6.071 1.409 -18.072 1.00 0.00 H ATOM 317 HG23 THR B 421 -5.102 -1.326 -20.044 1.00 0.00 H ATOM 318 HG21 THR B 421 -6.775 -0.913 -19.593 1.00 0.00 H ATOM 319 HG22 THR B 421 -5.639 0.372 -20.072 1.00 0.00 H ATOM 320 H THR B 421 -4.135 -0.842 -15.893 1.00 0.00 H ATOM 321 N ALA B 422 -6.109 -3.883 -18.067 1.00 0.00 N ATOM 322 CA ALA B 422 -5.838 -5.167 -18.691 1.00 0.00 C ATOM 323 C ALA B 422 -6.596 -5.255 -20.017 1.00 0.00 C ATOM 324 O ALA B 422 -7.825 -5.214 -20.038 1.00 0.00 O ATOM 325 CB ALA B 422 -6.216 -6.293 -17.727 1.00 0.00 C ATOM 326 HA ALA B 422 -4.776 -5.270 -18.912 1.00 0.00 H ATOM 327 HB1 ALA B 422 -5.628 -6.201 -16.814 1.00 0.00 H ATOM 328 HB2 ALA B 422 -7.277 -6.222 -17.486 1.00 0.00 H ATOM 329 HB3 ALA B 422 -6.012 -7.255 -18.197 1.00 0.00 H ATOM 330 H ALA B 422 -7.066 -3.676 -17.715 1.00 0.00 H ATOM 331 N THR B 423 -5.831 -5.373 -21.093 1.00 0.00 N ATOM 332 CA THR B 423 -6.415 -5.466 -22.420 1.00 0.00 C ATOM 333 C THR B 423 -6.051 -6.802 -23.070 1.00 0.00 C ATOM 334 O THR B 423 -4.987 -6.933 -23.675 1.00 0.00 O ATOM 335 CB THR B 423 -5.952 -4.251 -23.227 1.00 0.00 C ATOM 336 OG1 THR B 423 -4.539 -4.233 -23.047 1.00 0.00 O ATOM 337 CG2 THR B 423 -6.422 -2.929 -22.616 1.00 0.00 C ATOM 338 HA THR B 423 -7.504 -5.448 -22.375 1.00 0.00 H ATOM 339 HB THR B 423 -6.323 -4.331 -24.249 1.00 0.00 H ATOM 340 HG1 THR B 423 -4.153 -5.078 -23.390 1.00 0.00 H ATOM 341 HG23 THR B 423 -7.505 -2.852 -22.708 1.00 0.00 H ATOM 342 HG21 THR B 423 -6.143 -2.897 -21.563 1.00 0.00 H ATOM 343 HG22 THR B 423 -5.952 -2.099 -23.143 1.00 0.00 H ATOM 344 H THR B 423 -4.797 -5.399 -20.986 1.00 0.00 H ATOM 345 N ASP B 424 -6.954 -7.761 -22.925 1.00 0.00 N ATOM 346 CA ASP B 424 -6.740 -9.082 -23.490 1.00 0.00 C ATOM 347 C ASP B 424 -8.068 -9.625 -24.022 1.00 0.00 C ATOM 348 O ASP B 424 -9.076 -8.921 -24.019 1.00 0.00 O ATOM 349 CB ASP B 424 -6.222 -10.057 -22.431 1.00 0.00 C ATOM 350 CG ASP B 424 -5.231 -11.103 -22.944 1.00 0.00 C ATOM 351 OD1 ASP B 424 -4.432 -10.740 -23.834 1.00 0.00 O ATOM 352 OD2 ASP B 424 -5.295 -12.244 -22.436 1.00 0.00 O ATOM 353 HA ASP B 424 -6.003 -8.992 -24.288 1.00 0.00 H ATOM 354 HB2 ASP B 424 -5.729 -9.478 -21.650 1.00 0.00 H ATOM 355 HB3 ASP B 424 -7.078 -10.582 -22.007 1.00 0.00 H ATOM 356 H ASP B 424 -7.829 -7.565 -22.399 1.00 0.00 H ATOM 357 N THR B 425 -8.024 -10.872 -24.467 1.00 0.00 N ATOM 358 CA THR B 425 -9.212 -11.518 -25.001 1.00 0.00 C ATOM 359 C THR B 425 -10.020 -12.164 -23.875 1.00 0.00 C ATOM 360 O THR B 425 -11.111 -12.682 -24.107 1.00 0.00 O ATOM 361 CB THR B 425 -8.766 -12.511 -26.076 1.00 0.00 C ATOM 362 OG1 THR B 425 -9.953 -12.773 -26.820 1.00 0.00 O ATOM 363 CG2 THR B 425 -8.383 -13.873 -25.493 1.00 0.00 C ATOM 364 HA THR B 425 -9.882 -10.794 -25.464 1.00 0.00 H ATOM 365 HB THR B 425 -7.917 -12.098 -26.621 1.00 0.00 H ATOM 366 HG1 THR B 425 -10.640 -13.157 -26.219 1.00 0.00 H ATOM 367 HG23 THR B 425 -7.474 -13.770 -24.900 1.00 0.00 H ATOM 368 HG21 THR B 425 -9.192 -14.236 -24.860 1.00 0.00 H ATOM 369 HG22 THR B 425 -8.211 -14.579 -26.305 1.00 0.00 H ATOM 370 H THR B 425 -7.127 -11.397 -24.434 1.00 0.00 H ATOM 371 N ASP B 426 -9.454 -12.112 -22.678 1.00 0.00 N ATOM 372 CA ASP B 426 -10.108 -12.687 -21.515 1.00 0.00 C ATOM 373 C ASP B 426 -9.469 -12.121 -20.245 1.00 0.00 C ATOM 374 O ASP B 426 -9.300 -12.837 -19.259 1.00 0.00 O ATOM 375 CB ASP B 426 -9.946 -14.208 -21.488 1.00 0.00 C ATOM 376 CG ASP B 426 -11.165 -14.979 -20.978 1.00 0.00 C ATOM 377 OD1 ASP B 426 -12.085 -15.192 -21.797 1.00 0.00 O ATOM 378 OD2 ASP B 426 -11.150 -15.338 -19.781 1.00 0.00 O ATOM 379 HA ASP B 426 -11.168 -12.438 -21.566 1.00 0.00 H ATOM 380 HB2 ASP B 426 -9.734 -14.544 -22.503 1.00 0.00 H ATOM 381 HB3 ASP B 426 -9.100 -14.447 -20.843 1.00 0.00 H ATOM 382 H ASP B 426 -8.527 -11.653 -22.569 1.00 0.00 H ATOM 383 N GLU B 427 -9.133 -10.841 -20.309 1.00 0.00 N ATOM 384 CA GLU B 427 -8.517 -10.171 -19.176 1.00 0.00 C ATOM 385 C GLU B 427 -9.586 -9.504 -18.309 1.00 0.00 C ATOM 386 O GLU B 427 -10.744 -9.404 -18.712 1.00 0.00 O ATOM 387 CB GLU B 427 -7.475 -9.153 -19.642 1.00 0.00 C ATOM 388 CG GLU B 427 -6.066 -9.582 -19.228 1.00 0.00 C ATOM 389 CD GLU B 427 -6.026 -9.984 -17.752 1.00 0.00 C ATOM 390 OE1 GLU B 427 -6.292 -9.096 -16.915 1.00 0.00 O ATOM 391 OE2 GLU B 427 -5.731 -11.171 -17.496 1.00 0.00 O ATOM 392 HA GLU B 427 -8.002 -10.918 -18.572 1.00 0.00 H ATOM 393 HB2 GLU B 427 -7.518 -9.070 -20.728 1.00 0.00 H ATOM 394 HB3 GLU B 427 -7.698 -8.184 -19.196 1.00 0.00 H ATOM 395 HG2 GLU B 427 -5.758 -10.432 -19.838 1.00 0.00 H ATOM 396 HG3 GLU B 427 -5.378 -8.752 -19.390 1.00 0.00 H ATOM 397 H GLU B 427 -9.313 -10.308 -21.183 1.00 0.00 H ATOM 398 N LEU B 428 -9.160 -9.065 -17.134 1.00 0.00 N ATOM 399 CA LEU B 428 -10.067 -8.410 -16.206 1.00 0.00 C ATOM 400 C LEU B 428 -9.490 -7.049 -15.810 1.00 0.00 C ATOM 401 O LEU B 428 -8.450 -6.978 -15.157 1.00 0.00 O ATOM 402 CB LEU B 428 -10.365 -9.322 -15.014 1.00 0.00 C ATOM 403 CG LEU B 428 -11.804 -9.299 -14.495 1.00 0.00 C ATOM 404 CD1 LEU B 428 -12.304 -7.863 -14.330 1.00 0.00 C ATOM 405 CD2 LEU B 428 -12.724 -10.127 -15.394 1.00 0.00 C ATOM 406 HA LEU B 428 -11.029 -8.222 -16.683 1.00 0.00 H ATOM 407 HB2 LEU B 428 -10.133 -10.345 -15.310 1.00 0.00 H ATOM 408 HB3 LEU B 428 -9.710 -9.025 -14.195 1.00 0.00 H ATOM 409 HG LEU B 428 -11.819 -9.760 -13.508 1.00 0.00 H ATOM 410 HD21 LEU B 428 -12.709 -9.716 -16.404 1.00 0.00 H ATOM 411 HD22 LEU B 428 -12.376 -11.160 -15.415 1.00 0.00 H ATOM 412 HD23 LEU B 428 -13.740 -10.093 -15.001 1.00 0.00 H ATOM 413 HD11 LEU B 428 -11.667 -7.337 -13.619 1.00 0.00 H ATOM 414 HD12 LEU B 428 -12.271 -7.355 -15.294 1.00 0.00 H ATOM 415 HD13 LEU B 428 -13.329 -7.877 -13.960 1.00 0.00 H ATOM 416 H LEU B 428 -8.162 -9.191 -16.872 1.00 0.00 H ATOM 417 N GLN B 429 -10.190 -6.003 -16.223 1.00 0.00 N ATOM 418 CA GLN B 429 -9.761 -4.648 -15.918 1.00 0.00 C ATOM 419 C GLN B 429 -10.147 -4.280 -14.484 1.00 0.00 C ATOM 420 O GLN B 429 -11.277 -4.518 -14.060 1.00 0.00 O ATOM 421 CB GLN B 429 -10.348 -3.650 -16.918 1.00 0.00 C ATOM 422 CG GLN B 429 -9.462 -2.408 -17.035 1.00 0.00 C ATOM 423 CD GLN B 429 -9.565 -1.791 -18.432 1.00 0.00 C ATOM 424 OE1 GLN B 429 -10.111 -0.717 -18.626 1.00 0.00 O ATOM 425 NE2 GLN B 429 -9.012 -2.528 -19.391 1.00 0.00 N ATOM 426 HA GLN B 429 -8.675 -4.602 -16.004 1.00 0.00 H ATOM 427 HB2 GLN B 429 -10.425 -4.127 -17.895 1.00 0.00 H ATOM 428 HB3 GLN B 429 -11.341 -3.350 -16.582 1.00 0.00 H ATOM 429 HG2 GLN B 429 -9.779 -1.672 -16.296 1.00 0.00 H ATOM 430 HG3 GLN B 429 -8.426 -2.689 -16.845 1.00 0.00 H ATOM 431 HE22 GLN B 429 -8.562 -3.436 -19.155 1.00 0.00 H ATOM 432 HE21 GLN B 429 -9.029 -2.197 -20.377 1.00 0.00 H ATOM 433 H GLN B 429 -11.059 -6.153 -16.774 1.00 0.00 H ATOM 434 N LEU B 430 -9.186 -3.703 -13.777 1.00 0.00 N ATOM 435 CA LEU B 430 -9.411 -3.299 -12.399 1.00 0.00 C ATOM 436 C LEU B 430 -9.069 -1.815 -12.246 1.00 0.00 C ATOM 437 O LEU B 430 -8.127 -1.324 -12.866 1.00 0.00 O ATOM 438 CB LEU B 430 -8.642 -4.210 -11.441 1.00 0.00 C ATOM 439 CG LEU B 430 -9.251 -5.591 -11.193 1.00 0.00 C ATOM 440 CD1 LEU B 430 -10.537 -5.484 -10.371 1.00 0.00 C ATOM 441 CD2 LEU B 430 -9.475 -6.336 -12.511 1.00 0.00 C ATOM 442 HA LEU B 430 -10.462 -3.414 -12.135 1.00 0.00 H ATOM 443 HB2 LEU B 430 -7.642 -4.355 -11.849 1.00 0.00 H ATOM 444 HB3 LEU B 430 -8.571 -3.700 -10.481 1.00 0.00 H ATOM 445 HG LEU B 430 -8.542 -6.176 -10.608 1.00 0.00 H ATOM 446 HD21 LEU B 430 -10.154 -5.762 -13.141 1.00 0.00 H ATOM 447 HD22 LEU B 430 -8.521 -6.461 -13.023 1.00 0.00 H ATOM 448 HD23 LEU B 430 -9.909 -7.314 -12.305 1.00 0.00 H ATOM 449 HD11 LEU B 430 -10.315 -5.022 -9.409 1.00 0.00 H ATOM 450 HD12 LEU B 430 -11.262 -4.874 -10.910 1.00 0.00 H ATOM 451 HD13 LEU B 430 -10.948 -6.481 -10.210 1.00 0.00 H ATOM 452 H LEU B 430 -8.257 -3.537 -14.215 1.00 0.00 H ATOM 453 N LYS B 431 -9.853 -1.143 -11.416 1.00 0.00 N ATOM 454 CA LYS B 431 -9.645 0.274 -11.172 1.00 0.00 C ATOM 455 C LYS B 431 -9.570 0.522 -9.664 1.00 0.00 C ATOM 456 O LYS B 431 -10.486 0.163 -8.926 1.00 0.00 O ATOM 457 CB LYS B 431 -10.719 1.103 -11.879 1.00 0.00 C ATOM 458 CG LYS B 431 -12.120 0.673 -11.441 1.00 0.00 C ATOM 459 CD LYS B 431 -12.938 0.173 -12.633 1.00 0.00 C ATOM 460 CE LYS B 431 -12.430 -1.188 -13.114 1.00 0.00 C ATOM 461 NZ LYS B 431 -11.423 -1.016 -14.186 1.00 0.00 N ATOM 462 HA LYS B 431 -8.695 0.598 -11.596 1.00 0.00 H ATOM 463 HB2 LYS B 431 -10.576 2.155 -11.634 1.00 0.00 H ATOM 464 HB3 LYS B 431 -10.624 0.966 -12.956 1.00 0.00 H ATOM 465 HG2 LYS B 431 -12.034 -0.128 -10.706 1.00 0.00 H ATOM 466 HG3 LYS B 431 -12.630 1.525 -10.990 1.00 0.00 H ATOM 467 HD2 LYS B 431 -13.982 0.079 -12.335 1.00 0.00 H ATOM 468 HD3 LYS B 431 -12.857 0.892 -13.448 1.00 0.00 H ATOM 469 HE2 LYS B 431 -13.268 -1.769 -13.499 1.00 0.00 H ATOM 470 HE3 LYS B 431 -11.976 -1.718 -12.277 1.00 0.00 H ATOM 471 HZ1 LYS B 431 -11.854 -0.513 -14.988 1.00 0.00 H ATOM 472 HZ2 LYS B 431 -10.620 -0.465 -13.821 1.00 0.00 H ATOM 473 HZ3 LYS B 431 -11.090 -1.950 -14.500 1.00 0.00 H ATOM 474 H LYS B 431 -10.629 -1.637 -10.932 1.00 0.00 H ATOM 475 N ALA B 432 -8.470 1.135 -9.251 1.00 0.00 N ATOM 476 CA ALA B 432 -8.264 1.435 -7.845 1.00 0.00 C ATOM 477 C ALA B 432 -9.616 1.701 -7.181 1.00 0.00 C ATOM 478 O ALA B 432 -10.174 2.789 -7.313 1.00 0.00 O ATOM 479 CB ALA B 432 -7.306 2.621 -7.711 1.00 0.00 C ATOM 480 HA ALA B 432 -7.807 0.587 -7.335 1.00 0.00 H ATOM 481 HB1 ALA B 432 -6.351 2.369 -8.173 1.00 0.00 H ATOM 482 HB2 ALA B 432 -7.734 3.491 -8.210 1.00 0.00 H ATOM 483 HB3 ALA B 432 -7.152 2.845 -6.655 1.00 0.00 H ATOM 484 H ALA B 432 -7.743 1.405 -9.944 1.00 0.00 H ATOM 485 N GLY B 433 -10.105 0.687 -6.481 1.00 0.00 N ATOM 486 CA GLY B 433 -11.381 0.798 -5.795 1.00 0.00 C ATOM 487 C GLY B 433 -12.509 0.197 -6.636 1.00 0.00 C ATOM 488 O GLY B 433 -13.527 0.847 -6.871 1.00 0.00 O ATOM 489 HA3 GLY B 433 -11.596 1.850 -5.609 1.00 0.00 H ATOM 490 HA2 GLY B 433 -11.323 0.267 -4.845 1.00 0.00 H ATOM 491 H GLY B 433 -9.567 -0.201 -6.422 1.00 0.00 H ATOM 492 N ASP B 434 -12.291 -1.037 -7.066 1.00 0.00 N ATOM 493 CA ASP B 434 -13.276 -1.733 -7.877 1.00 0.00 C ATOM 494 C ASP B 434 -13.840 -2.914 -7.085 1.00 0.00 C ATOM 495 O ASP B 434 -13.320 -3.260 -6.025 1.00 0.00 O ATOM 496 CB ASP B 434 -12.646 -2.280 -9.159 1.00 0.00 C ATOM 497 CG ASP B 434 -13.612 -2.445 -10.334 1.00 0.00 C ATOM 498 OD1 ASP B 434 -14.163 -1.410 -10.767 1.00 0.00 O ATOM 499 OD2 ASP B 434 -13.778 -3.604 -10.774 1.00 0.00 O ATOM 500 HA ASP B 434 -14.062 -1.024 -8.136 1.00 0.00 H ATOM 501 HB2 ASP B 434 -11.854 -1.597 -9.465 1.00 0.00 H ATOM 502 HB3 ASP B 434 -12.216 -3.256 -8.935 1.00 0.00 H ATOM 503 H ASP B 434 -11.401 -1.515 -6.819 1.00 0.00 H ATOM 504 N VAL B 435 -14.894 -3.502 -7.631 1.00 0.00 N ATOM 505 CA VAL B 435 -15.534 -4.637 -6.989 1.00 0.00 C ATOM 506 C VAL B 435 -15.486 -5.843 -7.929 1.00 0.00 C ATOM 507 O VAL B 435 -15.914 -5.756 -9.079 1.00 0.00 O ATOM 508 CB VAL B 435 -16.957 -4.266 -6.565 1.00 0.00 C ATOM 509 CG1 VAL B 435 -16.942 -3.345 -5.344 1.00 0.00 C ATOM 510 CG2 VAL B 435 -17.725 -3.628 -7.724 1.00 0.00 C ATOM 511 HA VAL B 435 -15.000 -4.912 -6.079 1.00 0.00 H ATOM 512 HB VAL B 435 -17.474 -5.184 -6.286 1.00 0.00 H ATOM 513 HG11 VAL B 435 -16.450 -3.852 -4.514 1.00 0.00 H ATOM 514 HG12 VAL B 435 -16.399 -2.431 -5.586 1.00 0.00 H ATOM 515 HG13 VAL B 435 -17.966 -3.097 -5.065 1.00 0.00 H ATOM 516 HG21 VAL B 435 -17.209 -2.724 -8.046 1.00 0.00 H ATOM 517 HG22 VAL B 435 -17.779 -4.333 -8.554 1.00 0.00 H ATOM 518 HG23 VAL B 435 -18.733 -3.374 -7.395 1.00 0.00 H ATOM 519 H VAL B 435 -15.269 -3.146 -8.533 1.00 0.00 H ATOM 520 N VAL B 436 -14.961 -6.941 -7.405 1.00 0.00 N ATOM 521 CA VAL B 436 -14.853 -8.164 -8.183 1.00 0.00 C ATOM 522 C VAL B 436 -15.277 -9.353 -7.319 1.00 0.00 C ATOM 523 O VAL B 436 -15.116 -9.327 -6.100 1.00 0.00 O ATOM 524 CB VAL B 436 -13.435 -8.305 -8.740 1.00 0.00 C ATOM 525 CG1 VAL B 436 -13.289 -9.597 -9.547 1.00 0.00 C ATOM 526 CG2 VAL B 436 -13.053 -7.087 -9.583 1.00 0.00 C ATOM 527 HA VAL B 436 -15.524 -8.131 -9.041 1.00 0.00 H ATOM 528 HB VAL B 436 -12.748 -8.357 -7.896 1.00 0.00 H ATOM 529 HG11 VAL B 436 -13.499 -10.451 -8.904 1.00 0.00 H ATOM 530 HG12 VAL B 436 -13.993 -9.585 -10.379 1.00 0.00 H ATOM 531 HG13 VAL B 436 -12.272 -9.671 -9.931 1.00 0.00 H ATOM 532 HG21 VAL B 436 -13.749 -6.991 -10.417 1.00 0.00 H ATOM 533 HG22 VAL B 436 -13.099 -6.190 -8.965 1.00 0.00 H ATOM 534 HG23 VAL B 436 -12.040 -7.215 -9.966 1.00 0.00 H ATOM 535 H VAL B 436 -14.621 -6.928 -6.422 1.00 0.00 H ATOM 536 N LEU B 437 -15.810 -10.367 -7.984 1.00 0.00 N ATOM 537 CA LEU B 437 -16.259 -11.563 -7.292 1.00 0.00 C ATOM 538 C LEU B 437 -15.365 -12.740 -7.685 1.00 0.00 C ATOM 539 O LEU B 437 -15.155 -12.997 -8.869 1.00 0.00 O ATOM 540 CB LEU B 437 -17.747 -11.807 -7.554 1.00 0.00 C ATOM 541 CG LEU B 437 -18.449 -10.777 -8.442 1.00 0.00 C ATOM 542 CD1 LEU B 437 -19.797 -11.307 -8.934 1.00 0.00 C ATOM 543 CD2 LEU B 437 -18.589 -9.435 -7.720 1.00 0.00 C ATOM 544 HA LEU B 437 -16.165 -11.437 -6.213 1.00 0.00 H ATOM 545 HB2 LEU B 437 -17.847 -12.782 -8.031 1.00 0.00 H ATOM 546 HB3 LEU B 437 -18.258 -11.821 -6.591 1.00 0.00 H ATOM 547 HG LEU B 437 -17.830 -10.605 -9.322 1.00 0.00 H ATOM 548 HD21 LEU B 437 -19.176 -9.572 -6.812 1.00 0.00 H ATOM 549 HD22 LEU B 437 -17.599 -9.058 -7.461 1.00 0.00 H ATOM 550 HD23 LEU B 437 -19.091 -8.722 -8.374 1.00 0.00 H ATOM 551 HD11 LEU B 437 -19.639 -12.218 -9.511 1.00 0.00 H ATOM 552 HD12 LEU B 437 -20.435 -11.524 -8.077 1.00 0.00 H ATOM 553 HD13 LEU B 437 -20.274 -10.555 -9.563 1.00 0.00 H ATOM 554 H LEU B 437 -15.909 -10.306 -9.018 1.00 0.00 H ATOM 555 N VAL B 438 -14.862 -13.425 -6.668 1.00 0.00 N ATOM 556 CA VAL B 438 -13.995 -14.569 -6.892 1.00 0.00 C ATOM 557 C VAL B 438 -14.848 -15.786 -7.258 1.00 0.00 C ATOM 558 O VAL B 438 -15.699 -16.209 -6.477 1.00 0.00 O ATOM 559 CB VAL B 438 -13.112 -14.806 -5.665 1.00 0.00 C ATOM 560 CG1 VAL B 438 -12.517 -16.215 -5.680 1.00 0.00 C ATOM 561 CG2 VAL B 438 -12.012 -13.747 -5.569 1.00 0.00 C ATOM 562 HA VAL B 438 -13.322 -14.379 -7.728 1.00 0.00 H ATOM 563 HB VAL B 438 -13.740 -14.718 -4.779 1.00 0.00 H ATOM 564 HG11 VAL B 438 -13.323 -16.949 -5.678 1.00 0.00 H ATOM 565 HG12 VAL B 438 -11.911 -16.343 -6.577 1.00 0.00 H ATOM 566 HG13 VAL B 438 -11.894 -16.355 -4.796 1.00 0.00 H ATOM 567 HG21 VAL B 438 -11.389 -13.790 -6.462 1.00 0.00 H ATOM 568 HG22 VAL B 438 -12.466 -12.759 -5.488 1.00 0.00 H ATOM 569 HG23 VAL B 438 -11.400 -13.940 -4.688 1.00 0.00 H ATOM 570 H VAL B 438 -15.091 -13.139 -5.695 1.00 0.00 H ATOM 571 N ILE B 439 -14.591 -16.313 -8.446 1.00 0.00 N ATOM 572 CA ILE B 439 -15.324 -17.472 -8.924 1.00 0.00 C ATOM 573 C ILE B 439 -14.334 -18.576 -9.304 1.00 0.00 C ATOM 574 O ILE B 439 -13.183 -18.295 -9.635 1.00 0.00 O ATOM 575 CB ILE B 439 -16.269 -17.077 -10.061 1.00 0.00 C ATOM 576 CG1 ILE B 439 -15.485 -16.625 -11.294 1.00 0.00 C ATOM 577 CG2 ILE B 439 -17.270 -16.016 -9.598 1.00 0.00 C ATOM 578 CD1 ILE B 439 -15.306 -15.106 -11.305 1.00 0.00 C ATOM 579 HA ILE B 439 -15.961 -17.871 -8.135 1.00 0.00 H ATOM 580 HB ILE B 439 -16.843 -17.958 -10.350 1.00 0.00 H ATOM 581 HG12 ILE B 439 -14.504 -17.100 -11.286 1.00 0.00 H ATOM 582 HG13 ILE B 439 -16.026 -16.927 -12.191 1.00 0.00 H ATOM 583 HD11 ILE B 439 -16.285 -14.626 -11.318 1.00 0.00 H ATOM 584 HD12 ILE B 439 -14.761 -14.799 -10.412 1.00 0.00 H ATOM 585 HD13 ILE B 439 -14.745 -14.814 -12.193 1.00 0.00 H ATOM 586 HG21 ILE B 439 -17.861 -16.412 -8.772 1.00 0.00 H ATOM 587 HG22 ILE B 439 -16.730 -15.129 -9.267 1.00 0.00 H ATOM 588 HG23 ILE B 439 -17.929 -15.754 -10.426 1.00 0.00 H ATOM 589 H ILE B 439 -13.853 -15.890 -9.045 1.00 0.00 H ATOM 590 N PRO B 440 -14.831 -19.840 -9.241 1.00 0.00 N ATOM 591 CA PRO B 440 -14.004 -20.987 -9.574 1.00 0.00 C ATOM 592 C PRO B 440 -13.809 -21.101 -11.088 1.00 0.00 C ATOM 593 O PRO B 440 -14.768 -21.318 -11.826 1.00 0.00 O ATOM 594 CB PRO B 440 -14.729 -22.182 -8.977 1.00 0.00 C ATOM 595 CG PRO B 440 -16.159 -21.725 -8.738 1.00 0.00 C ATOM 596 CD PRO B 440 -16.189 -20.210 -8.854 1.00 0.00 C ATOM 597 HA PRO B 440 -12.994 -20.909 -9.171 1.00 0.00 H ATOM 598 HD3 PRO B 440 -16.904 -19.897 -9.614 1.00 0.00 H ATOM 599 HD2 PRO B 440 -16.454 -19.756 -7.899 1.00 0.00 H ATOM 600 HG3 PRO B 440 -16.484 -22.027 -7.742 1.00 0.00 H ATOM 601 HG2 PRO B 440 -16.819 -22.167 -9.484 1.00 0.00 H ATOM 602 HB2 PRO B 440 -14.710 -23.023 -9.671 1.00 0.00 H ATOM 603 HB3 PRO B 440 -14.263 -22.478 -8.037 1.00 0.00 H ATOM 604 N PHE B 441 -12.560 -20.951 -11.504 1.00 0.00 N ATOM 605 CA PHE B 441 -12.227 -21.034 -12.916 1.00 0.00 C ATOM 606 C PHE B 441 -12.649 -22.384 -13.500 1.00 0.00 C ATOM 607 O PHE B 441 -13.207 -23.223 -12.795 1.00 0.00 O ATOM 608 CB PHE B 441 -10.707 -20.897 -13.026 1.00 0.00 C ATOM 609 CG PHE B 441 -9.939 -21.534 -11.865 1.00 0.00 C ATOM 610 CD1 PHE B 441 -10.420 -22.657 -11.267 1.00 0.00 C ATOM 611 CD2 PHE B 441 -8.777 -20.978 -11.432 1.00 0.00 C ATOM 612 CE1 PHE B 441 -9.708 -23.248 -10.190 1.00 0.00 C ATOM 613 CE2 PHE B 441 -8.064 -21.569 -10.355 1.00 0.00 C ATOM 614 CZ PHE B 441 -8.545 -22.691 -9.757 1.00 0.00 C ATOM 615 HA PHE B 441 -12.747 -20.251 -13.468 1.00 0.00 H ATOM 616 HB2 PHE B 441 -10.386 -21.373 -13.952 1.00 0.00 H ATOM 617 HB3 PHE B 441 -10.460 -19.836 -13.060 1.00 0.00 H ATOM 618 HD2 PHE B 441 -8.392 -20.078 -11.911 1.00 0.00 H ATOM 619 HE2 PHE B 441 -7.132 -21.123 -10.008 1.00 0.00 H ATOM 620 HZ PHE B 441 -7.998 -23.145 -8.930 1.00 0.00 H ATOM 621 HE1 PHE B 441 -10.093 -24.148 -9.710 1.00 0.00 H ATOM 622 HD1 PHE B 441 -11.352 -23.103 -11.614 1.00 0.00 H ATOM 623 H PHE B 441 -11.807 -20.771 -10.810 1.00 0.00 H ATOM 624 N GLN B 442 -12.367 -22.551 -14.784 1.00 0.00 N ATOM 625 CA GLN B 442 -12.711 -23.784 -15.472 1.00 0.00 C ATOM 626 C GLN B 442 -11.653 -24.855 -15.201 1.00 0.00 C ATOM 627 O GLN B 442 -11.805 -26.002 -15.619 1.00 0.00 O ATOM 628 CB GLN B 442 -12.879 -23.545 -16.974 1.00 0.00 C ATOM 629 CG GLN B 442 -11.547 -23.156 -17.619 1.00 0.00 C ATOM 630 CD GLN B 442 -11.452 -21.640 -17.806 1.00 0.00 C ATOM 631 OE1 GLN B 442 -12.340 -20.998 -18.342 1.00 0.00 O ATOM 632 NE2 GLN B 442 -10.328 -21.107 -17.337 1.00 0.00 N ATOM 633 HA GLN B 442 -13.666 -24.139 -15.086 1.00 0.00 H ATOM 634 HB2 GLN B 442 -13.249 -24.458 -17.441 1.00 0.00 H ATOM 635 HB3 GLN B 442 -13.599 -22.741 -17.129 1.00 0.00 H ATOM 636 HG2 GLN B 442 -10.730 -23.489 -16.979 1.00 0.00 H ATOM 637 HG3 GLN B 442 -11.466 -23.641 -18.592 1.00 0.00 H ATOM 638 HE22 GLN B 442 -9.611 -21.714 -16.891 1.00 0.00 H ATOM 639 HE21 GLN B 442 -10.165 -20.083 -17.417 1.00 0.00 H ATOM 640 H GLN B 442 -11.892 -21.788 -15.307 1.00 0.00 H ATOM 641 N ASN B 443 -10.604 -24.444 -14.504 1.00 0.00 N ATOM 642 CA ASN B 443 -9.522 -25.355 -14.172 1.00 0.00 C ATOM 643 C ASN B 443 -8.378 -24.568 -13.529 1.00 0.00 C ATOM 644 O ASN B 443 -8.192 -23.387 -13.819 1.00 0.00 O ATOM 645 CB ASN B 443 -8.976 -26.042 -15.425 1.00 0.00 C ATOM 646 CG ASN B 443 -9.156 -27.559 -15.340 1.00 0.00 C ATOM 647 OD1 ASN B 443 -10.254 -28.074 -15.205 1.00 0.00 O ATOM 648 ND2 ASN B 443 -8.019 -28.244 -15.427 1.00 0.00 N ATOM 649 HA ASN B 443 -9.914 -26.109 -13.489 1.00 0.00 H ATOM 650 HB2 ASN B 443 -9.510 -25.668 -16.299 1.00 0.00 H ATOM 651 HB3 ASN B 443 -7.915 -25.813 -15.524 1.00 0.00 H ATOM 652 HD22 ASN B 443 -7.116 -27.741 -15.541 1.00 0.00 H ATOM 653 HD21 ASN B 443 -8.033 -29.283 -15.381 1.00 0.00 H ATOM 654 H ASN B 443 -10.554 -23.454 -14.190 1.00 0.00 H ATOM 655 N PRO B 444 -7.622 -25.272 -12.645 1.00 0.00 N ATOM 656 CA PRO B 444 -6.501 -24.652 -11.958 1.00 0.00 C ATOM 657 C PRO B 444 -5.307 -24.483 -12.899 1.00 0.00 C ATOM 658 O PRO B 444 -4.386 -23.721 -12.609 1.00 0.00 O ATOM 659 CB PRO B 444 -6.206 -25.568 -10.781 1.00 0.00 C ATOM 660 CG PRO B 444 -6.860 -26.899 -11.114 1.00 0.00 C ATOM 661 CD PRO B 444 -7.812 -26.672 -12.278 1.00 0.00 C ATOM 662 HA PRO B 444 -6.725 -23.642 -11.613 1.00 0.00 H ATOM 663 HD3 PRO B 444 -7.561 -27.326 -13.113 1.00 0.00 H ATOM 664 HD2 PRO B 444 -8.843 -26.853 -11.973 1.00 0.00 H ATOM 665 HG3 PRO B 444 -7.412 -27.268 -10.250 1.00 0.00 H ATOM 666 HG2 PRO B 444 -6.098 -27.627 -11.394 1.00 0.00 H ATOM 667 HB2 PRO B 444 -5.130 -25.694 -10.659 1.00 0.00 H ATOM 668 HB3 PRO B 444 -6.629 -25.156 -9.865 1.00 0.00 H ATOM 669 N GLU B 445 -5.360 -25.208 -14.007 1.00 0.00 N ATOM 670 CA GLU B 445 -4.293 -25.148 -14.992 1.00 0.00 C ATOM 671 C GLU B 445 -4.344 -23.820 -15.749 1.00 0.00 C ATOM 672 O GLU B 445 -3.337 -23.376 -16.298 1.00 0.00 O ATOM 673 CB GLU B 445 -4.372 -26.333 -15.957 1.00 0.00 C ATOM 674 CG GLU B 445 -4.212 -27.659 -15.211 1.00 0.00 C ATOM 675 CD GLU B 445 -2.865 -28.310 -15.531 1.00 0.00 C ATOM 676 OE1 GLU B 445 -1.860 -27.850 -14.946 1.00 0.00 O ATOM 677 OE2 GLU B 445 -2.870 -29.251 -16.353 1.00 0.00 O ATOM 678 HA GLU B 445 -3.338 -25.209 -14.470 1.00 0.00 H ATOM 679 HB2 GLU B 445 -5.339 -26.320 -16.459 1.00 0.00 H ATOM 680 HB3 GLU B 445 -3.578 -26.243 -16.699 1.00 0.00 H ATOM 681 HG2 GLU B 445 -4.273 -27.474 -14.138 1.00 0.00 H ATOM 682 HG3 GLU B 445 -5.014 -28.334 -15.508 1.00 0.00 H ATOM 683 H GLU B 445 -6.177 -25.829 -14.174 1.00 0.00 H ATOM 684 N GLU B 446 -5.526 -23.222 -15.753 1.00 0.00 N ATOM 685 CA GLU B 446 -5.721 -21.953 -16.433 1.00 0.00 C ATOM 686 C GLU B 446 -5.334 -20.793 -15.512 1.00 0.00 C ATOM 687 O GLU B 446 -4.905 -19.740 -15.981 1.00 0.00 O ATOM 688 CB GLU B 446 -7.164 -21.807 -16.921 1.00 0.00 C ATOM 689 CG GLU B 446 -7.553 -22.971 -17.835 1.00 0.00 C ATOM 690 CD GLU B 446 -7.773 -22.491 -19.271 1.00 0.00 C ATOM 691 OE1 GLU B 446 -6.802 -21.953 -19.844 1.00 0.00 O ATOM 692 OE2 GLU B 446 -8.908 -22.672 -19.762 1.00 0.00 O ATOM 693 HA GLU B 446 -5.072 -21.929 -17.309 1.00 0.00 H ATOM 694 HB2 GLU B 446 -7.832 -21.791 -16.060 1.00 0.00 H ATOM 695 HB3 GLU B 446 -7.261 -20.872 -17.473 1.00 0.00 H ATOM 696 HG2 GLU B 446 -6.755 -23.714 -17.825 1.00 0.00 H ATOM 697 HG3 GLU B 446 -8.473 -23.423 -17.465 1.00 0.00 H ATOM 698 H GLU B 446 -6.327 -23.668 -15.262 1.00 0.00 H ATOM 699 N GLN B 447 -5.501 -21.026 -14.219 1.00 0.00 N ATOM 700 CA GLN B 447 -5.173 -20.015 -13.228 1.00 0.00 C ATOM 701 C GLN B 447 -3.724 -19.555 -13.398 1.00 0.00 C ATOM 702 O GLN B 447 -2.815 -20.378 -13.499 1.00 0.00 O ATOM 703 CB GLN B 447 -5.421 -20.535 -11.811 1.00 0.00 C ATOM 704 CG GLN B 447 -5.663 -19.380 -10.837 1.00 0.00 C ATOM 705 CD GLN B 447 -5.259 -19.768 -9.414 1.00 0.00 C ATOM 706 OE1 GLN B 447 -5.166 -20.933 -9.063 1.00 0.00 O ATOM 707 NE2 GLN B 447 -5.024 -18.730 -8.616 1.00 0.00 N ATOM 708 HA GLN B 447 -5.826 -19.157 -13.384 1.00 0.00 H ATOM 709 HB2 GLN B 447 -6.296 -21.185 -11.818 1.00 0.00 H ATOM 710 HB3 GLN B 447 -4.551 -21.103 -11.482 1.00 0.00 H ATOM 711 HG2 GLN B 447 -5.075 -18.518 -11.152 1.00 0.00 H ATOM 712 HG3 GLN B 447 -6.721 -19.119 -10.849 1.00 0.00 H ATOM 713 HE22 GLN B 447 -5.122 -17.761 -8.981 1.00 0.00 H ATOM 714 HE21 GLN B 447 -4.742 -18.887 -7.627 1.00 0.00 H ATOM 715 H GLN B 447 -5.872 -21.946 -13.908 1.00 0.00 H ATOM 716 N ASP B 448 -3.552 -18.241 -13.424 1.00 0.00 N ATOM 717 CA ASP B 448 -2.229 -17.663 -13.579 1.00 0.00 C ATOM 718 C ASP B 448 -1.593 -17.477 -12.200 1.00 0.00 C ATOM 719 O ASP B 448 -2.297 -17.366 -11.198 1.00 0.00 O ATOM 720 CB ASP B 448 -2.303 -16.291 -14.254 1.00 0.00 C ATOM 721 CG ASP B 448 -0.997 -15.494 -14.244 1.00 0.00 C ATOM 722 OD1 ASP B 448 0.032 -16.087 -14.635 1.00 0.00 O ATOM 723 OD2 ASP B 448 -1.057 -14.311 -13.846 1.00 0.00 O ATOM 724 HA ASP B 448 -1.637 -18.338 -14.197 1.00 0.00 H ATOM 725 HB2 ASP B 448 -2.600 -16.440 -15.292 1.00 0.00 H ATOM 726 HB3 ASP B 448 -3.063 -15.702 -13.741 1.00 0.00 H ATOM 727 H ASP B 448 -4.377 -17.615 -13.332 1.00 0.00 H ATOM 728 N GLU B 449 -0.268 -17.450 -12.193 1.00 0.00 N ATOM 729 CA GLU B 449 0.471 -17.280 -10.954 1.00 0.00 C ATOM 730 C GLU B 449 0.389 -15.827 -10.482 1.00 0.00 C ATOM 731 O GLU B 449 0.956 -14.934 -11.109 1.00 0.00 O ATOM 732 CB GLU B 449 1.926 -17.722 -11.118 1.00 0.00 C ATOM 733 CG GLU B 449 2.766 -16.616 -11.759 1.00 0.00 C ATOM 734 CD GLU B 449 4.072 -17.177 -12.326 1.00 0.00 C ATOM 735 OE1 GLU B 449 4.018 -18.303 -12.867 1.00 0.00 O ATOM 736 OE2 GLU B 449 5.094 -16.468 -12.205 1.00 0.00 O ATOM 737 HA GLU B 449 0.017 -17.915 -10.193 1.00 0.00 H ATOM 738 HB2 GLU B 449 2.339 -17.961 -10.138 1.00 0.00 H ATOM 739 HB3 GLU B 449 1.960 -18.608 -11.751 1.00 0.00 H ATOM 740 HG2 GLU B 449 2.195 -16.157 -12.566 1.00 0.00 H ATOM 741 HG3 GLU B 449 2.999 -15.863 -11.006 1.00 0.00 H ATOM 742 H GLU B 449 0.251 -17.552 -13.089 1.00 0.00 H ATOM 743 N GLY B 450 -0.322 -15.636 -9.380 1.00 0.00 N ATOM 744 CA GLY B 450 -0.485 -14.306 -8.817 1.00 0.00 C ATOM 745 C GLY B 450 -1.805 -13.678 -9.267 1.00 0.00 C ATOM 746 O GLY B 450 -2.170 -12.596 -8.811 1.00 0.00 O ATOM 747 HA3 GLY B 450 0.341 -13.675 -9.147 1.00 0.00 H ATOM 748 HA2 GLY B 450 -0.476 -14.375 -7.729 1.00 0.00 H ATOM 749 H GLY B 450 -0.770 -16.449 -8.911 1.00 0.00 H ATOM 750 N TRP B 451 -2.486 -14.384 -10.158 1.00 0.00 N ATOM 751 CA TRP B 451 -3.758 -13.909 -10.675 1.00 0.00 C ATOM 752 C TRP B 451 -4.743 -15.080 -10.658 1.00 0.00 C ATOM 753 O TRP B 451 -4.352 -16.228 -10.869 1.00 0.00 O ATOM 754 CB TRP B 451 -3.589 -13.291 -12.065 1.00 0.00 C ATOM 755 CG TRP B 451 -2.330 -12.434 -12.215 1.00 0.00 C ATOM 756 CD1 TRP B 451 -1.075 -12.742 -11.860 1.00 0.00 C ATOM 757 CD2 TRP B 451 -2.256 -11.108 -12.779 1.00 0.00 C ATOM 758 NE1 TRP B 451 -0.201 -11.714 -12.152 1.00 0.00 N ATOM 759 CE2 TRP B 451 -0.942 -10.689 -12.729 1.00 0.00 C ATOM 760 CE3 TRP B 451 -3.266 -10.288 -13.313 1.00 0.00 C ATOM 761 CZ2 TRP B 451 -0.517 -9.440 -13.197 1.00 0.00 C ATOM 762 CZ3 TRP B 451 -2.825 -9.043 -13.776 1.00 0.00 C ATOM 763 CH2 TRP B 451 -1.505 -8.607 -13.733 1.00 0.00 C ATOM 764 HA TRP B 451 -4.155 -13.111 -10.048 1.00 0.00 H ATOM 765 HB2 TRP B 451 -3.544 -14.098 -12.796 1.00 0.00 H ATOM 766 HB3 TRP B 451 -4.457 -12.665 -12.270 1.00 0.00 H ATOM 767 HE1 TRP B 451 0.823 -11.708 -11.973 1.00 0.00 H ATOM 768 HD1 TRP B 451 -0.781 -13.685 -11.399 1.00 0.00 H ATOM 769 HZ2 TRP B 451 0.528 -9.133 -13.147 1.00 0.00 H ATOM 770 HH2 TRP B 451 -1.241 -7.621 -14.115 1.00 0.00 H ATOM 771 HZ3 TRP B 451 -3.568 -8.368 -14.200 1.00 0.00 H ATOM 772 HE3 TRP B 451 -4.310 -10.598 -13.362 1.00 0.00 H ATOM 773 H TRP B 451 -2.104 -15.292 -10.492 1.00 0.00 H ATOM 774 N LEU B 452 -6.001 -14.751 -10.405 1.00 0.00 N ATOM 775 CA LEU B 452 -7.044 -15.761 -10.359 1.00 0.00 C ATOM 776 C LEU B 452 -8.211 -15.324 -11.247 1.00 0.00 C ATOM 777 O LEU B 452 -8.231 -14.198 -11.742 1.00 0.00 O ATOM 778 CB LEU B 452 -7.447 -16.049 -8.911 1.00 0.00 C ATOM 779 CG LEU B 452 -6.805 -15.157 -7.846 1.00 0.00 C ATOM 780 CD1 LEU B 452 -7.726 -15.000 -6.635 1.00 0.00 C ATOM 781 CD2 LEU B 452 -5.423 -15.682 -7.452 1.00 0.00 C ATOM 782 HA LEU B 452 -6.677 -16.707 -10.758 1.00 0.00 H ATOM 783 HB2 LEU B 452 -8.528 -15.933 -8.836 1.00 0.00 H ATOM 784 HB3 LEU B 452 -7.177 -17.081 -8.689 1.00 0.00 H ATOM 785 HG LEU B 452 -6.662 -14.164 -8.272 1.00 0.00 H ATOM 786 HD21 LEU B 452 -5.520 -16.691 -7.052 1.00 0.00 H ATOM 787 HD22 LEU B 452 -4.778 -15.698 -8.330 1.00 0.00 H ATOM 788 HD23 LEU B 452 -4.990 -15.029 -6.694 1.00 0.00 H ATOM 789 HD11 LEU B 452 -8.666 -14.547 -6.951 1.00 0.00 H ATOM 790 HD12 LEU B 452 -7.922 -15.980 -6.200 1.00 0.00 H ATOM 791 HD13 LEU B 452 -7.245 -14.361 -5.894 1.00 0.00 H ATOM 792 H LEU B 452 -6.246 -13.754 -10.237 1.00 0.00 H ATOM 793 N MET B 453 -9.155 -16.237 -11.421 1.00 0.00 N ATOM 794 CA MET B 453 -10.323 -15.960 -12.240 1.00 0.00 C ATOM 795 C MET B 453 -11.429 -15.302 -11.412 1.00 0.00 C ATOM 796 O MET B 453 -12.002 -15.931 -10.524 1.00 0.00 O ATOM 797 CB MET B 453 -10.844 -17.265 -12.844 1.00 0.00 C ATOM 798 CG MET B 453 -12.226 -17.065 -13.471 1.00 0.00 C ATOM 799 SD MET B 453 -12.201 -17.578 -15.180 1.00 0.00 S ATOM 800 CE MET B 453 -11.012 -16.418 -15.834 1.00 0.00 C ATOM 801 HA MET B 453 -10.032 -15.273 -13.035 1.00 0.00 H ATOM 802 HB2 MET B 453 -10.149 -17.605 -13.612 1.00 0.00 H ATOM 803 HB3 MET B 453 -10.914 -18.019 -12.060 1.00 0.00 H ATOM 804 HG2 MET B 453 -12.500 -16.011 -13.414 1.00 0.00 H ATOM 805 HG3 MET B 453 -12.959 -17.659 -12.926 1.00 0.00 H ATOM 806 HE1 MET B 453 -11.376 -15.402 -15.681 1.00 0.00 H ATOM 807 HE2 MET B 453 -10.060 -16.546 -15.319 1.00 0.00 H ATOM 808 HE3 MET B 453 -10.877 -16.600 -16.900 1.00 0.00 H ATOM 809 H MET B 453 -9.059 -17.166 -10.964 1.00 0.00 H ATOM 810 N GLY B 454 -11.696 -14.045 -11.733 1.00 0.00 N ATOM 811 CA GLY B 454 -12.722 -13.294 -11.030 1.00 0.00 C ATOM 812 C GLY B 454 -13.581 -12.490 -12.009 1.00 0.00 C ATOM 813 O GLY B 454 -13.211 -12.320 -13.169 1.00 0.00 O ATOM 814 HA3 GLY B 454 -12.245 -12.610 -10.328 1.00 0.00 H ATOM 815 HA2 GLY B 454 -13.360 -13.988 -10.482 1.00 0.00 H ATOM 816 H GLY B 454 -11.163 -13.588 -12.500 1.00 0.00 H ATOM 817 N VAL B 455 -14.710 -12.016 -11.504 1.00 0.00 N ATOM 818 CA VAL B 455 -15.623 -11.232 -12.318 1.00 0.00 C ATOM 819 C VAL B 455 -15.938 -9.917 -11.602 1.00 0.00 C ATOM 820 O VAL B 455 -16.045 -9.884 -10.377 1.00 0.00 O ATOM 821 CB VAL B 455 -16.874 -12.052 -12.639 1.00 0.00 C ATOM 822 CG1 VAL B 455 -17.765 -12.200 -11.404 1.00 0.00 C ATOM 823 CG2 VAL B 455 -17.650 -11.435 -13.804 1.00 0.00 C ATOM 824 HA VAL B 455 -15.162 -10.980 -13.273 1.00 0.00 H ATOM 825 HB VAL B 455 -16.552 -13.049 -12.941 1.00 0.00 H ATOM 826 HG11 VAL B 455 -17.209 -12.705 -10.614 1.00 0.00 H ATOM 827 HG12 VAL B 455 -18.073 -11.213 -11.059 1.00 0.00 H ATOM 828 HG13 VAL B 455 -18.646 -12.787 -11.662 1.00 0.00 H ATOM 829 HG21 VAL B 455 -17.954 -10.422 -13.541 1.00 0.00 H ATOM 830 HG22 VAL B 455 -17.013 -11.407 -14.688 1.00 0.00 H ATOM 831 HG23 VAL B 455 -18.534 -12.038 -14.010 1.00 0.00 H ATOM 832 H VAL B 455 -14.947 -12.208 -10.510 1.00 0.00 H ATOM 833 N LYS B 456 -16.077 -8.866 -12.396 1.00 0.00 N ATOM 834 CA LYS B 456 -16.377 -7.552 -11.853 1.00 0.00 C ATOM 835 C LYS B 456 -17.869 -7.469 -11.527 1.00 0.00 C ATOM 836 O LYS B 456 -18.664 -8.261 -12.031 1.00 0.00 O ATOM 837 CB LYS B 456 -15.893 -6.456 -12.805 1.00 0.00 C ATOM 838 CG LYS B 456 -14.610 -5.805 -12.285 1.00 0.00 C ATOM 839 CD LYS B 456 -14.246 -4.572 -13.114 1.00 0.00 C ATOM 840 CE LYS B 456 -14.245 -4.897 -14.609 1.00 0.00 C ATOM 841 NZ LYS B 456 -15.577 -4.632 -15.197 1.00 0.00 N ATOM 842 HA LYS B 456 -15.837 -7.392 -10.920 1.00 0.00 H ATOM 843 HB2 LYS B 456 -15.699 -6.894 -13.784 1.00 0.00 H ATOM 844 HB3 LYS B 456 -16.668 -5.695 -12.896 1.00 0.00 H ATOM 845 HG2 LYS B 456 -14.757 -5.506 -11.247 1.00 0.00 H ATOM 846 HG3 LYS B 456 -13.795 -6.527 -12.342 1.00 0.00 H ATOM 847 HD2 LYS B 456 -14.974 -3.784 -12.921 1.00 0.00 H ATOM 848 HD3 LYS B 456 -13.254 -4.227 -12.823 1.00 0.00 H ATOM 849 HE2 LYS B 456 -13.994 -5.949 -14.748 1.00 0.00 H ATOM 850 HE3 LYS B 456 -13.501 -4.278 -15.111 1.00 0.00 H ATOM 851 HZ1 LYS B 456 -16.288 -5.224 -14.722 1.00 0.00 H ATOM 852 HZ2 LYS B 456 -15.818 -3.628 -15.069 1.00 0.00 H ATOM 853 HZ3 LYS B 456 -15.558 -4.858 -16.212 1.00 0.00 H ATOM 854 H LYS B 456 -15.970 -8.983 -13.424 1.00 0.00 H ATOM 855 N GLU B 457 -18.205 -6.502 -10.686 1.00 0.00 N ATOM 856 CA GLU B 457 -19.588 -6.305 -10.286 1.00 0.00 C ATOM 857 C GLU B 457 -20.467 -6.065 -11.515 1.00 0.00 C ATOM 858 O GLU B 457 -21.577 -6.587 -11.600 1.00 0.00 O ATOM 859 CB GLU B 457 -19.712 -5.150 -9.290 1.00 0.00 C ATOM 860 CG GLU B 457 -21.179 -4.848 -8.980 1.00 0.00 C ATOM 861 CD GLU B 457 -21.392 -4.641 -7.479 1.00 0.00 C ATOM 862 OE1 GLU B 457 -20.947 -5.525 -6.716 1.00 0.00 O ATOM 863 OE2 GLU B 457 -21.994 -3.603 -7.129 1.00 0.00 O ATOM 864 HA GLU B 457 -19.934 -7.210 -9.787 1.00 0.00 H ATOM 865 HB2 GLU B 457 -19.200 -5.419 -8.366 1.00 0.00 H ATOM 866 HB3 GLU B 457 -19.247 -4.261 -9.715 1.00 0.00 H ATOM 867 HG2 GLU B 457 -21.477 -3.944 -9.510 1.00 0.00 H ATOM 868 HG3 GLU B 457 -21.794 -5.683 -9.315 1.00 0.00 H ATOM 869 H GLU B 457 -17.468 -5.874 -10.306 1.00 0.00 H ATOM 870 N SER B 458 -19.937 -5.274 -12.437 1.00 0.00 N ATOM 871 CA SER B 458 -20.659 -4.959 -13.658 1.00 0.00 C ATOM 872 C SER B 458 -20.907 -6.236 -14.464 1.00 0.00 C ATOM 873 O SER B 458 -21.988 -6.423 -15.020 1.00 0.00 O ATOM 874 CB SER B 458 -19.894 -3.938 -14.502 1.00 0.00 C ATOM 875 OG SER B 458 -20.746 -2.906 -14.992 1.00 0.00 O ATOM 876 HA SER B 458 -21.618 -4.518 -13.385 1.00 0.00 H ATOM 877 HB2 SER B 458 -19.439 -4.451 -15.349 1.00 0.00 H ATOM 878 HB3 SER B 458 -19.113 -3.489 -13.889 1.00 0.00 H ATOM 879 HG SER B 458 -20.214 -2.269 -15.531 1.00 0.00 H ATOM 880 H SER B 458 -18.990 -4.873 -12.284 1.00 0.00 H ATOM 881 N ASP B 459 -19.887 -7.080 -14.502 1.00 0.00 N ATOM 882 CA ASP B 459 -19.980 -8.334 -15.231 1.00 0.00 C ATOM 883 C ASP B 459 -21.085 -9.195 -14.616 1.00 0.00 C ATOM 884 O ASP B 459 -21.759 -9.944 -15.322 1.00 0.00 O ATOM 885 CB ASP B 459 -18.669 -9.118 -15.148 1.00 0.00 C ATOM 886 CG ASP B 459 -17.530 -8.566 -16.009 1.00 0.00 C ATOM 887 OD1 ASP B 459 -17.772 -7.539 -16.679 1.00 0.00 O ATOM 888 OD2 ASP B 459 -16.444 -9.184 -15.977 1.00 0.00 O ATOM 889 HA ASP B 459 -20.196 -8.103 -16.274 1.00 0.00 H ATOM 890 HB2 ASP B 459 -18.339 -9.117 -14.109 1.00 0.00 H ATOM 891 HB3 ASP B 459 -18.867 -10.142 -15.464 1.00 0.00 H ATOM 892 H ASP B 459 -19.006 -6.842 -14.003 1.00 0.00 H ATOM 893 N TRP B 460 -21.237 -9.060 -13.307 1.00 0.00 N ATOM 894 CA TRP B 460 -22.249 -9.816 -12.589 1.00 0.00 C ATOM 895 C TRP B 460 -23.591 -9.595 -13.290 1.00 0.00 C ATOM 896 O TRP B 460 -24.320 -10.549 -13.559 1.00 0.00 O ATOM 897 CB TRP B 460 -22.277 -9.429 -11.109 1.00 0.00 C ATOM 898 CG TRP B 460 -23.048 -10.409 -10.224 1.00 0.00 C ATOM 899 CD1 TRP B 460 -23.994 -11.284 -10.591 1.00 0.00 C ATOM 900 CD2 TRP B 460 -22.900 -10.580 -8.798 1.00 0.00 C ATOM 901 NE1 TRP B 460 -24.464 -12.003 -9.511 1.00 0.00 N ATOM 902 CE2 TRP B 460 -23.778 -11.561 -8.386 1.00 0.00 C ATOM 903 CE3 TRP B 460 -22.051 -9.926 -7.887 1.00 0.00 C ATOM 904 CZ2 TRP B 460 -23.892 -11.977 -7.054 1.00 0.00 C ATOM 905 CZ3 TRP B 460 -22.178 -10.353 -6.560 1.00 0.00 C ATOM 906 CH2 TRP B 460 -23.057 -11.340 -6.129 1.00 0.00 C ATOM 907 HA TRP B 460 -22.018 -10.881 -12.606 1.00 0.00 H ATOM 908 HB2 TRP B 460 -21.250 -9.377 -10.749 1.00 0.00 H ATOM 909 HB3 TRP B 460 -22.742 -8.447 -11.020 1.00 0.00 H ATOM 910 HE1 TRP B 460 -25.197 -12.740 -9.535 1.00 0.00 H ATOM 911 HD1 TRP B 460 -24.348 -11.412 -11.614 1.00 0.00 H ATOM 912 HZ2 TRP B 460 -24.594 -12.755 -6.754 1.00 0.00 H ATOM 913 HH2 TRP B 460 -23.096 -11.617 -5.075 1.00 0.00 H ATOM 914 HZ3 TRP B 460 -21.543 -9.878 -5.812 1.00 0.00 H ATOM 915 HE3 TRP B 460 -21.350 -9.148 -8.190 1.00 0.00 H ATOM 916 H TRP B 460 -20.623 -8.403 -12.785 1.00 0.00 H ATOM 917 N ASN B 461 -23.877 -8.331 -13.567 1.00 0.00 N ATOM 918 CA ASN B 461 -25.118 -7.973 -14.232 1.00 0.00 C ATOM 919 C ASN B 461 -25.200 -8.699 -15.576 1.00 0.00 C ATOM 920 O ASN B 461 -26.292 -8.951 -16.084 1.00 0.00 O ATOM 921 CB ASN B 461 -25.183 -6.468 -14.502 1.00 0.00 C ATOM 922 CG ASN B 461 -25.200 -5.676 -13.194 1.00 0.00 C ATOM 923 OD1 ASN B 461 -26.242 -5.360 -12.643 1.00 0.00 O ATOM 924 ND2 ASN B 461 -23.992 -5.373 -12.729 1.00 0.00 N ATOM 925 HA ASN B 461 -25.944 -8.259 -13.581 1.00 0.00 H ATOM 926 HB2 ASN B 461 -24.312 -6.173 -15.086 1.00 0.00 H ATOM 927 HB3 ASN B 461 -26.089 -6.246 -15.065 1.00 0.00 H ATOM 928 HD22 ASN B 461 -23.144 -5.674 -13.250 1.00 0.00 H ATOM 929 HD21 ASN B 461 -23.895 -4.835 -11.844 1.00 0.00 H ATOM 930 H ASN B 461 -23.203 -7.584 -13.304 1.00 0.00 H ATOM 931 N GLN B 462 -24.031 -9.016 -16.113 1.00 0.00 N ATOM 932 CA GLN B 462 -23.957 -9.707 -17.389 1.00 0.00 C ATOM 933 C GLN B 462 -23.880 -11.220 -17.169 1.00 0.00 C ATOM 934 O GLN B 462 -23.488 -11.962 -18.068 1.00 0.00 O ATOM 935 CB GLN B 462 -22.767 -9.212 -18.213 1.00 0.00 C ATOM 936 CG GLN B 462 -23.222 -8.237 -19.301 1.00 0.00 C ATOM 937 CD GLN B 462 -24.329 -7.316 -18.784 1.00 0.00 C ATOM 938 OE1 GLN B 462 -25.349 -7.112 -19.420 1.00 0.00 O ATOM 939 NE2 GLN B 462 -24.070 -6.772 -17.598 1.00 0.00 N ATOM 940 HA GLN B 462 -24.864 -9.486 -17.953 1.00 0.00 H ATOM 941 HB2 GLN B 462 -22.062 -8.707 -17.553 1.00 0.00 H ATOM 942 HB3 GLN B 462 -22.277 -10.066 -18.681 1.00 0.00 H ATOM 943 HG2 GLN B 462 -22.372 -7.631 -19.616 1.00 0.00 H ATOM 944 HG3 GLN B 462 -23.598 -8.803 -20.153 1.00 0.00 H ATOM 945 HE22 GLN B 462 -23.178 -6.990 -17.110 1.00 0.00 H ATOM 946 HE21 GLN B 462 -24.759 -6.129 -17.159 1.00 0.00 H ATOM 947 H GLN B 462 -23.153 -8.767 -15.614 1.00 0.00 H ATOM 948 N HIS B 463 -24.260 -11.631 -15.969 1.00 0.00 N ATOM 949 CA HIS B 463 -24.239 -13.041 -15.619 1.00 0.00 C ATOM 950 C HIS B 463 -24.839 -13.862 -16.762 1.00 0.00 C ATOM 951 O HIS B 463 -24.532 -15.044 -16.910 1.00 0.00 O ATOM 952 CB HIS B 463 -24.944 -13.281 -14.283 1.00 0.00 C ATOM 953 CG HIS B 463 -25.942 -14.414 -14.310 1.00 0.00 C ATOM 954 ND1 HIS B 463 -25.767 -15.584 -13.591 1.00 0.00 N ATOM 955 CD2 HIS B 463 -27.126 -14.542 -14.974 1.00 0.00 C ATOM 956 CE1 HIS B 463 -26.805 -16.374 -13.821 1.00 0.00 C ATOM 957 NE2 HIS B 463 -27.646 -15.727 -14.678 1.00 0.00 N ATOM 958 HA HIS B 463 -23.209 -13.370 -15.483 1.00 0.00 H ATOM 959 HB2 HIS B 463 -24.187 -13.508 -13.532 1.00 0.00 H ATOM 960 HB3 HIS B 463 -25.469 -12.368 -14.003 1.00 0.00 H ATOM 961 HD2 HIS B 463 -27.570 -13.798 -15.635 1.00 0.00 H ATOM 962 HE1 HIS B 463 -26.960 -17.367 -13.399 1.00 0.00 H ATOM 963 H HIS B 463 -24.578 -10.934 -15.266 1.00 0.00 H ATOM 964 N LYS B 464 -25.684 -13.204 -17.541 1.00 0.00 N ATOM 965 CA LYS B 464 -26.330 -13.858 -18.666 1.00 0.00 C ATOM 966 C LYS B 464 -25.261 -14.397 -19.619 1.00 0.00 C ATOM 967 O LYS B 464 -25.472 -15.409 -20.285 1.00 0.00 O ATOM 968 CB LYS B 464 -27.329 -12.911 -19.335 1.00 0.00 C ATOM 969 CG LYS B 464 -28.728 -13.082 -18.739 1.00 0.00 C ATOM 970 CD LYS B 464 -29.613 -13.933 -19.651 1.00 0.00 C ATOM 971 CE LYS B 464 -30.900 -14.349 -18.935 1.00 0.00 C ATOM 972 NZ LYS B 464 -31.568 -15.448 -19.667 1.00 0.00 N ATOM 973 HA LYS B 464 -26.915 -14.712 -18.326 1.00 0.00 H ATOM 974 HB2 LYS B 464 -27.001 -11.882 -19.186 1.00 0.00 H ATOM 975 HB3 LYS B 464 -27.367 -13.128 -20.403 1.00 0.00 H ATOM 976 HG2 LYS B 464 -28.645 -13.569 -17.767 1.00 0.00 H ATOM 977 HG3 LYS B 464 -29.185 -12.100 -18.614 1.00 0.00 H ATOM 978 HD2 LYS B 464 -29.870 -13.355 -20.539 1.00 0.00 H ATOM 979 HD3 LYS B 464 -29.064 -14.827 -19.947 1.00 0.00 H ATOM 980 HE2 LYS B 464 -31.573 -13.493 -18.880 1.00 0.00 H ATOM 981 HE3 LYS B 464 -30.658 -14.685 -17.927 1.00 0.00 H ATOM 982 HZ1 LYS B 464 -31.803 -15.130 -20.629 1.00 0.00 H ATOM 983 HZ2 LYS B 464 -30.929 -16.267 -19.718 1.00 0.00 H ATOM 984 HZ3 LYS B 464 -32.439 -15.717 -19.167 1.00 0.00 H ATOM 985 H LYS B 464 -25.888 -12.203 -17.344 1.00 0.00 H ATOM 986 N LYS B 465 -24.137 -13.696 -19.655 1.00 0.00 N ATOM 987 CA LYS B 465 -23.035 -14.092 -20.515 1.00 0.00 C ATOM 988 C LYS B 465 -21.727 -14.026 -19.724 1.00 0.00 C ATOM 989 O LYS B 465 -20.710 -13.565 -20.237 1.00 0.00 O ATOM 990 CB LYS B 465 -23.024 -13.250 -21.792 1.00 0.00 C ATOM 991 CG LYS B 465 -23.248 -14.124 -23.028 1.00 0.00 C ATOM 992 CD LYS B 465 -22.644 -13.477 -24.275 1.00 0.00 C ATOM 993 CE LYS B 465 -23.207 -14.110 -25.549 1.00 0.00 C ATOM 994 NZ LYS B 465 -22.484 -13.610 -26.740 1.00 0.00 N ATOM 995 HA LYS B 465 -23.158 -15.125 -20.842 1.00 0.00 H ATOM 996 HB2 LYS B 465 -23.817 -12.504 -21.734 1.00 0.00 H ATOM 997 HB3 LYS B 465 -22.060 -12.748 -21.880 1.00 0.00 H ATOM 998 HG2 LYS B 465 -22.780 -15.095 -22.868 1.00 0.00 H ATOM 999 HG3 LYS B 465 -24.319 -14.259 -23.180 1.00 0.00 H ATOM 1000 HD2 LYS B 465 -22.877 -12.412 -24.273 1.00 0.00 H ATOM 1001 HD3 LYS B 465 -21.562 -13.611 -24.258 1.00 0.00 H ATOM 1002 HE2 LYS B 465 -24.264 -13.858 -25.638 1.00 0.00 H ATOM 1003 HE3 LYS B 465 -23.097 -15.193 -25.491 1.00 0.00 H ATOM 1004 HZ1 LYS B 465 -22.590 -12.577 -26.800 1.00 0.00 H ATOM 1005 HZ2 LYS B 465 -21.476 -13.852 -26.659 1.00 0.00 H ATOM 1006 HZ3 LYS B 465 -22.880 -14.051 -27.595 1.00 0.00 H ATOM 1007 H LYS B 465 -24.042 -12.849 -19.058 1.00 0.00 H ATOM 1008 N LEU B 466 -21.797 -14.495 -18.487 1.00 0.00 N ATOM 1009 CA LEU B 466 -20.631 -14.497 -17.620 1.00 0.00 C ATOM 1010 C LEU B 466 -19.482 -15.226 -18.319 1.00 0.00 C ATOM 1011 O LEU B 466 -18.316 -14.897 -18.111 1.00 0.00 O ATOM 1012 CB LEU B 466 -20.984 -15.076 -16.248 1.00 0.00 C ATOM 1013 CG LEU B 466 -20.774 -16.582 -16.083 1.00 0.00 C ATOM 1014 CD1 LEU B 466 -19.421 -16.879 -15.433 1.00 0.00 C ATOM 1015 CD2 LEU B 466 -21.932 -17.215 -15.309 1.00 0.00 C ATOM 1016 HA LEU B 466 -20.294 -13.478 -17.432 1.00 0.00 H ATOM 1017 HB2 LEU B 466 -20.370 -14.570 -15.504 1.00 0.00 H ATOM 1018 HB3 LEU B 466 -22.035 -14.862 -16.056 1.00 0.00 H ATOM 1019 HG LEU B 466 -20.762 -17.036 -17.074 1.00 0.00 H ATOM 1020 HD21 LEU B 466 -21.998 -16.760 -14.321 1.00 0.00 H ATOM 1021 HD22 LEU B 466 -22.863 -17.048 -15.850 1.00 0.00 H ATOM 1022 HD23 LEU B 466 -21.756 -18.286 -15.206 1.00 0.00 H ATOM 1023 HD11 LEU B 466 -18.623 -16.481 -16.060 1.00 0.00 H ATOM 1024 HD12 LEU B 466 -19.381 -16.410 -14.450 1.00 0.00 H ATOM 1025 HD13 LEU B 466 -19.299 -17.957 -15.328 1.00 0.00 H ATOM 1026 H LEU B 466 -22.700 -14.867 -18.131 1.00 0.00 H ATOM 1027 N GLU B 467 -19.853 -16.204 -19.133 1.00 0.00 N ATOM 1028 CA GLU B 467 -18.868 -16.983 -19.863 1.00 0.00 C ATOM 1029 C GLU B 467 -18.045 -16.075 -20.779 1.00 0.00 C ATOM 1030 O GLU B 467 -16.952 -16.445 -21.207 1.00 0.00 O ATOM 1031 CB GLU B 467 -19.537 -18.104 -20.661 1.00 0.00 C ATOM 1032 CG GLU B 467 -20.153 -19.149 -19.728 1.00 0.00 C ATOM 1033 CD GLU B 467 -20.961 -20.181 -20.517 1.00 0.00 C ATOM 1034 OE1 GLU B 467 -21.603 -19.764 -21.505 1.00 0.00 O ATOM 1035 OE2 GLU B 467 -20.918 -21.364 -20.115 1.00 0.00 O ATOM 1036 HA GLU B 467 -18.194 -17.446 -19.142 1.00 0.00 H ATOM 1037 HB2 GLU B 467 -20.321 -17.678 -21.286 1.00 0.00 H ATOM 1038 HB3 GLU B 467 -18.791 -18.586 -21.293 1.00 0.00 H ATOM 1039 HG2 GLU B 467 -19.356 -19.658 -19.187 1.00 0.00 H ATOM 1040 HG3 GLU B 467 -20.811 -18.649 -19.017 1.00 0.00 H ATOM 1041 H GLU B 467 -20.864 -16.417 -19.251 1.00 0.00 H ATOM 1042 N LYS B 468 -18.600 -14.904 -21.052 1.00 0.00 N ATOM 1043 CA LYS B 468 -17.932 -13.940 -21.909 1.00 0.00 C ATOM 1044 C LYS B 468 -17.583 -12.694 -21.093 1.00 0.00 C ATOM 1045 O LYS B 468 -17.133 -11.691 -21.646 1.00 0.00 O ATOM 1046 CB LYS B 468 -18.780 -13.646 -23.148 1.00 0.00 C ATOM 1047 CG LYS B 468 -19.202 -14.941 -23.844 1.00 0.00 C ATOM 1048 CD LYS B 468 -18.749 -14.951 -25.305 1.00 0.00 C ATOM 1049 CE LYS B 468 -17.787 -16.110 -25.574 1.00 0.00 C ATOM 1050 NZ LYS B 468 -18.390 -17.075 -26.521 1.00 0.00 N ATOM 1051 HA LYS B 468 -16.994 -14.349 -22.283 1.00 0.00 H ATOM 1052 HB2 LYS B 468 -19.672 -13.096 -22.848 1.00 0.00 H ATOM 1053 HB3 LYS B 468 -18.198 -13.041 -23.843 1.00 0.00 H ATOM 1054 HG2 LYS B 468 -18.752 -15.788 -23.325 1.00 0.00 H ATOM 1055 HG3 LYS B 468 -20.288 -15.029 -23.807 1.00 0.00 H ATOM 1056 HD2 LYS B 468 -19.623 -15.056 -25.948 1.00 0.00 H ATOM 1057 HD3 LYS B 468 -18.246 -14.010 -25.529 1.00 0.00 H ATOM 1058 HE2 LYS B 468 -17.566 -16.618 -24.635 1.00 0.00 H ATOM 1059 HE3 LYS B 468 -16.863 -15.718 -26.000 1.00 0.00 H ATOM 1060 HZ1 LYS B 468 -19.270 -17.453 -26.116 1.00 0.00 H ATOM 1061 HZ2 LYS B 468 -18.599 -16.593 -27.419 1.00 0.00 H ATOM 1062 HZ3 LYS B 468 -17.723 -17.854 -26.692 1.00 0.00 H ATOM 1063 H LYS B 468 -19.529 -14.671 -20.646 1.00 0.00 H ATOM 1064 N CYS B 469 -17.802 -12.798 -19.790 1.00 0.00 N ATOM 1065 CA CYS B 469 -17.517 -11.691 -18.893 1.00 0.00 C ATOM 1066 C CYS B 469 -16.365 -12.103 -17.974 1.00 0.00 C ATOM 1067 O CYS B 469 -15.814 -11.273 -17.253 1.00 0.00 O ATOM 1068 CB CYS B 469 -18.757 -11.272 -18.100 1.00 0.00 C ATOM 1069 SG CYS B 469 -19.114 -9.500 -18.388 1.00 0.00 S ATOM 1070 HA CYS B 469 -17.224 -10.816 -19.473 1.00 0.00 H ATOM 1071 HB2 CYS B 469 -18.579 -11.437 -17.037 1.00 0.00 H ATOM 1072 HB3 CYS B 469 -19.610 -11.869 -18.421 1.00 0.00 H ATOM 1073 HG CYS B 469 -18.035 -8.743 -17.979 1.00 0.00 H ATOM 1074 H CYS B 469 -18.183 -13.685 -19.404 1.00 0.00 H ATOM 1075 N ARG B 470 -16.034 -13.385 -18.031 1.00 0.00 N ATOM 1076 CA ARG B 470 -14.957 -13.917 -17.213 1.00 0.00 C ATOM 1077 C ARG B 470 -13.630 -13.252 -17.585 1.00 0.00 C ATOM 1078 O ARG B 470 -13.466 -12.770 -18.704 1.00 0.00 O ATOM 1079 CB ARG B 470 -14.828 -15.431 -17.389 1.00 0.00 C ATOM 1080 CG ARG B 470 -16.149 -16.134 -17.072 1.00 0.00 C ATOM 1081 CD ARG B 470 -15.913 -17.394 -16.236 1.00 0.00 C ATOM 1082 NE ARG B 470 -15.999 -18.596 -17.095 1.00 0.00 N ATOM 1083 CZ ARG B 470 -16.178 -19.840 -16.631 1.00 0.00 C ATOM 1084 NH1 ARG B 470 -16.291 -20.053 -15.313 1.00 0.00 N ATOM 1085 NH2 ARG B 470 -16.244 -20.870 -17.484 1.00 0.00 N ATOM 1086 HA ARG B 470 -15.195 -13.703 -16.171 1.00 0.00 H ATOM 1087 HB2 ARG B 470 -14.547 -15.648 -18.420 1.00 0.00 H ATOM 1088 HB3 ARG B 470 -14.055 -15.804 -16.717 1.00 0.00 H ATOM 1089 HG2 ARG B 470 -16.792 -15.452 -16.515 1.00 0.00 H ATOM 1090 HG3 ARG B 470 -16.638 -16.412 -18.006 1.00 0.00 H ATOM 1091 HD2 ARG B 470 -16.669 -17.455 -15.453 1.00 0.00 H ATOM 1092 HD3 ARG B 470 -14.924 -17.345 -15.781 1.00 0.00 H ATOM 1093 HE ARG B 470 -15.915 -18.467 -18.124 1.00 0.00 H ATOM 1094 HH12 ARG B 470 -16.430 -21.019 -14.952 1.00 0.00 H ATOM 1095 HH11 ARG B 470 -16.240 -19.253 -14.651 1.00 0.00 H ATOM 1096 HH22 ARG B 470 -16.383 -21.836 -17.124 1.00 0.00 H ATOM 1097 HH21 ARG B 470 -16.156 -20.704 -18.507 1.00 0.00 H ATOM 1098 H ARG B 470 -16.553 -14.020 -18.671 1.00 0.00 H ATOM 1099 N GLY B 471 -12.717 -13.248 -16.624 1.00 0.00 N ATOM 1100 CA GLY B 471 -11.411 -12.649 -16.836 1.00 0.00 C ATOM 1101 C GLY B 471 -10.440 -13.042 -15.721 1.00 0.00 C ATOM 1102 O GLY B 471 -10.804 -13.783 -14.809 1.00 0.00 O ATOM 1103 HA3 GLY B 471 -11.515 -11.564 -16.853 1.00 0.00 H ATOM 1104 HA2 GLY B 471 -11.013 -12.990 -17.792 1.00 0.00 H ATOM 1105 H GLY B 471 -12.939 -13.680 -15.705 1.00 0.00 H ATOM 1106 N VAL B 472 -9.223 -12.529 -15.831 1.00 0.00 N ATOM 1107 CA VAL B 472 -8.197 -12.818 -14.844 1.00 0.00 C ATOM 1108 C VAL B 472 -7.698 -11.507 -14.234 1.00 0.00 C ATOM 1109 O VAL B 472 -7.612 -10.491 -14.923 1.00 0.00 O ATOM 1110 CB VAL B 472 -7.078 -13.646 -15.479 1.00 0.00 C ATOM 1111 CG1 VAL B 472 -5.809 -13.600 -14.625 1.00 0.00 C ATOM 1112 CG2 VAL B 472 -7.529 -15.089 -15.715 1.00 0.00 C ATOM 1113 HA VAL B 472 -8.607 -13.419 -14.032 1.00 0.00 H ATOM 1114 HB VAL B 472 -6.845 -13.206 -16.449 1.00 0.00 H ATOM 1115 HG11 VAL B 472 -5.472 -12.568 -14.533 1.00 0.00 H ATOM 1116 HG12 VAL B 472 -6.024 -14.003 -13.635 1.00 0.00 H ATOM 1117 HG13 VAL B 472 -5.031 -14.197 -15.100 1.00 0.00 H ATOM 1118 HG21 VAL B 472 -7.803 -15.543 -14.763 1.00 0.00 H ATOM 1119 HG22 VAL B 472 -8.390 -15.094 -16.383 1.00 0.00 H ATOM 1120 HG23 VAL B 472 -6.714 -15.654 -16.167 1.00 0.00 H ATOM 1121 H VAL B 472 -8.999 -11.910 -16.636 1.00 0.00 H ATOM 1122 N PHE B 473 -7.384 -11.571 -12.949 1.00 0.00 N ATOM 1123 CA PHE B 473 -6.894 -10.401 -12.239 1.00 0.00 C ATOM 1124 C PHE B 473 -5.910 -10.800 -11.138 1.00 0.00 C ATOM 1125 O PHE B 473 -6.013 -11.887 -10.572 1.00 0.00 O ATOM 1126 CB PHE B 473 -8.109 -9.725 -11.600 1.00 0.00 C ATOM 1127 CG PHE B 473 -8.698 -10.494 -10.416 1.00 0.00 C ATOM 1128 CD1 PHE B 473 -9.342 -11.673 -10.623 1.00 0.00 C ATOM 1129 CD2 PHE B 473 -8.576 -9.998 -9.155 1.00 0.00 C ATOM 1130 CE1 PHE B 473 -9.889 -12.387 -9.524 1.00 0.00 C ATOM 1131 CE2 PHE B 473 -9.123 -10.711 -8.056 1.00 0.00 C ATOM 1132 CZ PHE B 473 -9.767 -11.891 -8.263 1.00 0.00 C ATOM 1133 HA PHE B 473 -6.375 -9.737 -12.930 1.00 0.00 H ATOM 1134 HB2 PHE B 473 -7.808 -8.737 -11.252 1.00 0.00 H ATOM 1135 HB3 PHE B 473 -8.883 -9.621 -12.360 1.00 0.00 H ATOM 1136 HD2 PHE B 473 -8.058 -9.053 -8.989 1.00 0.00 H ATOM 1137 HE2 PHE B 473 -9.027 -10.313 -7.046 1.00 0.00 H ATOM 1138 HZ PHE B 473 -10.185 -12.439 -7.419 1.00 0.00 H ATOM 1139 HE1 PHE B 473 -10.406 -13.332 -9.691 1.00 0.00 H ATOM 1140 HD1 PHE B 473 -9.439 -12.071 -11.633 1.00 0.00 H ATOM 1141 H PHE B 473 -7.490 -12.472 -12.440 1.00 0.00 H ATOM 1142 N PRO B 474 -4.953 -9.875 -10.860 1.00 0.00 N ATOM 1143 CA PRO B 474 -3.950 -10.119 -9.837 1.00 0.00 C ATOM 1144 C PRO B 474 -4.549 -9.970 -8.437 1.00 0.00 C ATOM 1145 O PRO B 474 -5.001 -8.889 -8.062 1.00 0.00 O ATOM 1146 CB PRO B 474 -2.846 -9.114 -10.120 1.00 0.00 C ATOM 1147 CG PRO B 474 -3.473 -8.042 -10.997 1.00 0.00 C ATOM 1148 CD PRO B 474 -4.799 -8.577 -11.511 1.00 0.00 C ATOM 1149 HA PRO B 474 -3.560 -11.137 -9.864 1.00 0.00 H ATOM 1150 HD3 PRO B 474 -5.616 -7.909 -11.236 1.00 0.00 H ATOM 1151 HD2 PRO B 474 -4.774 -8.691 -12.595 1.00 0.00 H ATOM 1152 HG3 PRO B 474 -2.814 -7.817 -11.835 1.00 0.00 H ATOM 1153 HG2 PRO B 474 -3.640 -7.136 -10.414 1.00 0.00 H ATOM 1154 HB2 PRO B 474 -2.482 -8.678 -9.190 1.00 0.00 H ATOM 1155 HB3 PRO B 474 -2.019 -9.596 -10.642 1.00 0.00 H ATOM 1156 N GLU B 475 -4.533 -11.072 -7.701 1.00 0.00 N ATOM 1157 CA GLU B 475 -5.069 -11.078 -6.351 1.00 0.00 C ATOM 1158 C GLU B 475 -4.176 -10.253 -5.422 1.00 0.00 C ATOM 1159 O GLU B 475 -4.652 -9.690 -4.437 1.00 0.00 O ATOM 1160 CB GLU B 475 -5.229 -12.508 -5.831 1.00 0.00 C ATOM 1161 CG GLU B 475 -5.304 -12.531 -4.303 1.00 0.00 C ATOM 1162 CD GLU B 475 -6.270 -13.614 -3.817 1.00 0.00 C ATOM 1163 OE1 GLU B 475 -7.484 -13.319 -3.787 1.00 0.00 O ATOM 1164 OE2 GLU B 475 -5.771 -14.712 -3.487 1.00 0.00 O ATOM 1165 HA GLU B 475 -6.059 -10.621 -6.372 1.00 0.00 H ATOM 1166 HB2 GLU B 475 -6.145 -12.936 -6.240 1.00 0.00 H ATOM 1167 HB3 GLU B 475 -4.375 -13.103 -6.155 1.00 0.00 H ATOM 1168 HG2 GLU B 475 -4.311 -12.732 -3.900 1.00 0.00 H ATOM 1169 HG3 GLU B 475 -5.649 -11.560 -3.948 1.00 0.00 H ATOM 1170 H GLU B 475 -4.131 -11.946 -8.096 1.00 0.00 H ATOM 1171 N ASN B 476 -2.898 -10.208 -5.768 1.00 0.00 N ATOM 1172 CA ASN B 476 -1.935 -9.462 -4.976 1.00 0.00 C ATOM 1173 C ASN B 476 -2.133 -7.964 -5.218 1.00 0.00 C ATOM 1174 O ASN B 476 -1.494 -7.137 -4.570 1.00 0.00 O ATOM 1175 CB ASN B 476 -0.501 -9.819 -5.374 1.00 0.00 C ATOM 1176 CG ASN B 476 -0.367 -11.317 -5.657 1.00 0.00 C ATOM 1177 OD1 ASN B 476 -0.847 -12.160 -4.917 1.00 0.00 O ATOM 1178 ND2 ASN B 476 0.309 -11.600 -6.766 1.00 0.00 N ATOM 1179 HA ASN B 476 -2.093 -9.715 -3.927 1.00 0.00 H ATOM 1180 HB2 ASN B 476 -0.230 -9.261 -6.270 1.00 0.00 H ATOM 1181 HB3 ASN B 476 0.173 -9.548 -4.561 1.00 0.00 H ATOM 1182 HD22 ASN B 476 0.692 -10.831 -7.352 1.00 0.00 H ATOM 1183 HD21 ASN B 476 0.455 -12.590 -7.048 1.00 0.00 H ATOM 1184 H ASN B 476 -2.579 -10.714 -6.619 1.00 0.00 H ATOM 1185 N PHE B 477 -3.021 -7.661 -6.154 1.00 0.00 N ATOM 1186 CA PHE B 477 -3.312 -6.278 -6.489 1.00 0.00 C ATOM 1187 C PHE B 477 -4.720 -5.888 -6.035 1.00 0.00 C ATOM 1188 O PHE B 477 -5.152 -4.755 -6.243 1.00 0.00 O ATOM 1189 CB PHE B 477 -3.230 -6.160 -8.012 1.00 0.00 C ATOM 1190 CG PHE B 477 -4.253 -5.198 -8.618 1.00 0.00 C ATOM 1191 CD1 PHE B 477 -5.556 -5.571 -8.728 1.00 0.00 C ATOM 1192 CD2 PHE B 477 -3.860 -3.968 -9.047 1.00 0.00 C ATOM 1193 CE1 PHE B 477 -6.506 -4.678 -9.291 1.00 0.00 C ATOM 1194 CE2 PHE B 477 -4.810 -3.075 -9.610 1.00 0.00 C ATOM 1195 CZ PHE B 477 -6.113 -3.449 -9.719 1.00 0.00 C ATOM 1196 HA PHE B 477 -2.602 -5.618 -5.990 1.00 0.00 H ATOM 1197 HB2 PHE B 477 -2.232 -5.810 -8.276 1.00 0.00 H ATOM 1198 HB3 PHE B 477 -3.392 -7.148 -8.442 1.00 0.00 H ATOM 1199 HD2 PHE B 477 -2.816 -3.668 -8.959 1.00 0.00 H ATOM 1200 HE2 PHE B 477 -4.495 -2.090 -9.955 1.00 0.00 H ATOM 1201 HZ PHE B 477 -6.842 -2.763 -10.150 1.00 0.00 H ATOM 1202 HE1 PHE B 477 -7.550 -4.978 -9.380 1.00 0.00 H ATOM 1203 HD1 PHE B 477 -5.872 -6.556 -8.384 1.00 0.00 H ATOM 1204 H PHE B 477 -3.517 -8.425 -6.656 1.00 0.00 H ATOM 1205 N THR B 478 -5.397 -6.848 -5.423 1.00 0.00 N ATOM 1206 CA THR B 478 -6.747 -6.619 -4.936 1.00 0.00 C ATOM 1207 C THR B 478 -6.855 -7.010 -3.461 1.00 0.00 C ATOM 1208 O THR B 478 -5.893 -7.501 -2.873 1.00 0.00 O ATOM 1209 CB THR B 478 -7.713 -7.386 -5.840 1.00 0.00 C ATOM 1210 OG1 THR B 478 -7.002 -8.573 -6.179 1.00 0.00 O ATOM 1211 CG2 THR B 478 -7.936 -6.688 -7.184 1.00 0.00 C ATOM 1212 HA THR B 478 -7.009 -5.562 -4.980 1.00 0.00 H ATOM 1213 HB THR B 478 -8.669 -7.507 -5.331 1.00 0.00 H ATOM 1214 HG1 THR B 478 -6.164 -8.332 -6.648 1.00 0.00 H ATOM 1215 HG23 THR B 478 -8.480 -5.757 -7.023 1.00 0.00 H ATOM 1216 HG21 THR B 478 -6.972 -6.472 -7.644 1.00 0.00 H ATOM 1217 HG22 THR B 478 -8.514 -7.340 -7.839 1.00 0.00 H ATOM 1218 H THR B 478 -4.956 -7.780 -5.289 1.00 0.00 H ATOM 1219 N GLU B 479 -8.035 -6.778 -2.905 1.00 0.00 N ATOM 1220 CA GLU B 479 -8.282 -7.101 -1.510 1.00 0.00 C ATOM 1221 C GLU B 479 -9.565 -7.923 -1.374 1.00 0.00 C ATOM 1222 O GLU B 479 -10.533 -7.694 -2.097 1.00 0.00 O ATOM 1223 CB GLU B 479 -8.351 -5.832 -0.657 1.00 0.00 C ATOM 1224 CG GLU B 479 -7.813 -6.088 0.752 1.00 0.00 C ATOM 1225 CD GLU B 479 -8.368 -5.064 1.745 1.00 0.00 C ATOM 1226 OE1 GLU B 479 -9.558 -4.713 1.593 1.00 0.00 O ATOM 1227 OE2 GLU B 479 -7.589 -4.656 2.633 1.00 0.00 O ATOM 1228 HA GLU B 479 -7.449 -7.701 -1.144 1.00 0.00 H ATOM 1229 HB2 GLU B 479 -7.755 -5.051 -1.130 1.00 0.00 H ATOM 1230 HB3 GLU B 479 -9.388 -5.504 -0.589 1.00 0.00 H ATOM 1231 HG2 GLU B 479 -8.106 -7.089 1.070 1.00 0.00 H ATOM 1232 HG3 GLU B 479 -6.725 -6.017 0.737 1.00 0.00 H ATOM 1233 H GLU B 479 -8.796 -6.358 -3.476 1.00 0.00 H ATOM 1234 N ARG B 480 -9.530 -8.865 -0.442 1.00 0.00 N ATOM 1235 CA ARG B 480 -10.678 -9.723 -0.203 1.00 0.00 C ATOM 1236 C ARG B 480 -11.719 -8.991 0.647 1.00 0.00 C ATOM 1237 O ARG B 480 -11.367 -8.251 1.565 1.00 0.00 O ATOM 1238 CB ARG B 480 -10.263 -11.012 0.509 1.00 0.00 C ATOM 1239 CG ARG B 480 -9.259 -11.803 -0.331 1.00 0.00 C ATOM 1240 CD ARG B 480 -9.512 -13.307 -0.216 1.00 0.00 C ATOM 1241 NE ARG B 480 -8.259 -14.005 0.149 1.00 0.00 N ATOM 1242 CZ ARG B 480 -8.197 -15.288 0.532 1.00 0.00 C ATOM 1243 NH1 ARG B 480 -9.317 -16.020 0.604 1.00 0.00 N ATOM 1244 NH2 ARG B 480 -7.016 -15.838 0.844 1.00 0.00 N ATOM 1245 HA ARG B 480 -11.109 -9.979 -1.171 1.00 0.00 H ATOM 1246 HB2 ARG B 480 -9.807 -10.760 1.466 1.00 0.00 H ATOM 1247 HB3 ARG B 480 -11.147 -11.626 0.680 1.00 0.00 H ATOM 1248 HG2 ARG B 480 -9.354 -11.504 -1.375 1.00 0.00 H ATOM 1249 HG3 ARG B 480 -8.250 -11.583 0.018 1.00 0.00 H ATOM 1250 HD2 ARG B 480 -9.872 -13.687 -1.172 1.00 0.00 H ATOM 1251 HD3 ARG B 480 -10.264 -13.489 0.552 1.00 0.00 H ATOM 1252 HE ARG B 480 -7.371 -13.466 0.106 1.00 0.00 H ATOM 1253 HH12 ARG B 480 -9.269 -17.016 0.901 1.00 0.00 H ATOM 1254 HH11 ARG B 480 -10.234 -15.593 0.363 1.00 0.00 H ATOM 1255 HH22 ARG B 480 -6.968 -16.834 1.141 1.00 0.00 H ATOM 1256 HH21 ARG B 480 -6.147 -15.269 0.789 1.00 0.00 H ATOM 1257 H ARG B 480 -8.668 -8.992 0.126 1.00 0.00 H ATOM 1258 N VAL B 481 -12.980 -9.224 0.312 1.00 0.00 N ATOM 1259 CA VAL B 481 -14.074 -8.595 1.033 1.00 0.00 C ATOM 1260 C VAL B 481 -14.957 -9.679 1.655 1.00 0.00 C ATOM 1261 O VAL B 481 -15.522 -10.509 0.945 1.00 0.00 O ATOM 1262 CB VAL B 481 -14.844 -7.658 0.101 1.00 0.00 C ATOM 1263 CG1 VAL B 481 -15.876 -6.839 0.878 1.00 0.00 C ATOM 1264 CG2 VAL B 481 -13.889 -6.747 -0.672 1.00 0.00 C ATOM 1265 HA VAL B 481 -13.692 -7.979 1.847 1.00 0.00 H ATOM 1266 HB VAL B 481 -15.380 -8.271 -0.623 1.00 0.00 H ATOM 1267 HG11 VAL B 481 -16.584 -7.513 1.360 1.00 0.00 H ATOM 1268 HG12 VAL B 481 -15.368 -6.241 1.635 1.00 0.00 H ATOM 1269 HG13 VAL B 481 -16.409 -6.182 0.191 1.00 0.00 H ATOM 1270 HG21 VAL B 481 -13.313 -6.146 0.032 1.00 0.00 H ATOM 1271 HG22 VAL B 481 -13.212 -7.357 -1.270 1.00 0.00 H ATOM 1272 HG23 VAL B 481 -14.464 -6.092 -1.327 1.00 0.00 H ATOM 1273 H VAL B 481 -13.190 -9.866 -0.478 1.00 0.00 H ATOM 1274 N PRO B 482 -15.052 -9.634 3.011 1.00 0.00 N ATOM 1275 CA PRO B 482 -15.855 -10.602 3.738 1.00 0.00 C ATOM 1276 C PRO B 482 -17.347 -10.297 3.589 1.00 0.00 C ATOM 1277 O PRO B 482 -18.189 -11.034 4.102 1.00 0.00 O ATOM 1278 CB PRO B 482 -15.372 -10.515 5.176 1.00 0.00 C ATOM 1279 CG PRO B 482 -14.647 -9.184 5.292 1.00 0.00 C ATOM 1280 CD PRO B 482 -14.398 -8.664 3.885 1.00 0.00 C ATOM 1281 HA PRO B 482 -15.740 -11.616 3.355 1.00 0.00 H ATOM 1282 HD3 PRO B 482 -14.836 -7.674 3.757 1.00 0.00 H ATOM 1283 HD2 PRO B 482 -13.329 -8.617 3.676 1.00 0.00 H ATOM 1284 HG3 PRO B 482 -13.698 -9.323 5.809 1.00 0.00 H ATOM 1285 HG2 PRO B 482 -15.261 -8.474 5.846 1.00 0.00 H ATOM 1286 HB2 PRO B 482 -16.218 -10.548 5.863 1.00 0.00 H ATOM 1287 HB3 PRO B 482 -14.693 -11.338 5.399 1.00 0.00 H TER 1288 PRO B 482 HETATM 1289 N LEU A 1 1.325 0.000 0.000 1.00 0.24 N HETATM 1290 CA LEU A 1 2.073 0.000 -1.245 1.00 0.07 C HETATM 1291 CB LEU A 1 3.459 0.614 -1.038 1.00 0.01 C HETATM 1292 CG LEU A 1 3.544 2.137 -1.166 1.00 -0.04 C HETATM 1293 CD1 LEU A 1 4.806 2.674 -0.489 1.00 -0.06 C HETATM 1294 H8 LEU A 1 4.842 3.768 -0.596 1.00 0.02 H HETATM 1295 H9 LEU A 1 5.694 2.230 -0.963 1.00 0.02 H HETATM 1296 H10 LEU A 1 4.790 2.410 0.579 1.00 0.02 H HETATM 1297 CD2 LEU A 1 3.449 2.570 -2.630 1.00 -0.06 C HETATM 1298 H11 LEU A 1 2.529 2.162 -3.074 1.00 0.02 H HETATM 1299 H12 LEU A 1 4.322 2.191 -3.182 1.00 0.02 H HETATM 1300 H13 LEU A 1 3.428 3.668 -2.687 1.00 0.02 H HETATM 1301 H7 LEU A 1 2.679 2.565 -0.638 1.00 0.03 H HETATM 1302 H5 LEU A 1 4.137 0.175 -1.785 1.00 0.03 H HETATM 1303 H6 LEU A 1 3.800 0.342 -0.029 1.00 0.03 H HETATM 1304 C LEU A 1 2.109 -1.420 -1.814 1.00 0.23 C HETATM 1305 O LEU A 1 3.068 -2.158 -1.591 1.00 -0.39 O HETATM 1306 N LEU A 1 1.053 -1.760 -2.538 1.00 -0.26 N HETATM 1307 CA LEU A 1 0.951 -3.079 -3.140 1.00 0.13 C HETATM 1308 CB LEU A 1 -0.515 -3.458 -3.355 1.00 -0.01 C HETATM 1309 CG LEU A 1 -1.348 -3.664 -2.088 1.00 -0.04 C HETATM 1310 CD1 LEU A 1 -1.090 -2.546 -1.075 1.00 -0.06 C HETATM 1311 H19 LEU A 1 -1.700 -2.718 -0.176 1.00 0.02 H HETATM 1312 H20 LEU A 1 -1.360 -1.577 -1.521 1.00 0.02 H HETATM 1313 H21 LEU A 1 -0.025 -2.539 -0.800 1.00 0.02 H HETATM 1314 CD2 LEU A 1 -2.834 -3.801 -2.424 1.00 -0.06 C HETATM 1315 H22 LEU A 1 -2.972 -4.613 -3.153 1.00 0.02 H HETATM 1316 H23 LEU A 1 -3.201 -2.857 -2.853 1.00 0.02 H HETATM 1317 H24 LEU A 1 -3.397 -4.031 -1.508 1.00 0.02 H HETATM 1318 H18 LEU A 1 -1.026 -4.609 -1.626 1.00 0.03 H HETATM 1319 H16 LEU A 1 -0.539 -4.396 -3.930 1.00 0.03 H HETATM 1320 H17 LEU A 1 -0.987 -2.656 -3.941 1.00 0.03 H HETATM 1321 C LEU A 1 1.790 -3.117 -4.419 1.00 0.21 C HETATM 1322 O LEU A 1 1.559 -2.337 -5.341 1.00 -0.39 O HETATM 1323 N LEU A 1 2.773 -4.057 -4.433 1.00 -0.25 N HETATM 1324 CA LEU A 1 3.648 -4.207 -5.584 1.00 0.13 C HETATM 1325 C LEU A 1 2.921 -4.899 -6.739 1.00 0.20 C HETATM 1326 O LEU A 1 2.349 -5.973 -6.562 1.00 -0.39 O HETATM 1327 N LEU A 1 2.968 -4.254 -7.896 1.00 -0.26 N HETATM 1328 CA LEU A 1 2.319 -4.793 -9.079 1.00 0.16 C HETATM 1329 CB LEU A 1 2.298 -3.698 -10.147 1.00 0.09 C HETATM 1330 CG2 LEU A 1 3.691 -3.391 -10.699 1.00 -0.03 C HETATM 1331 H36 LEU A 1 3.618 -2.600 -11.460 1.00 0.03 H HETATM 1332 H37 LEU A 1 4.114 -4.299 -11.154 1.00 0.03 H HETATM 1333 H38 LEU A 1 4.343 -3.053 -9.880 1.00 0.03 H HETATM 1334 OG1 LEU A 1 1.613 -4.296 -11.244 1.00 -0.39 O HETATM 1335 H35 LEU A 1 2.073 -5.083 -11.512 1.00 0.21 H HETATM 1336 H34 LEU A 1 1.805 -2.787 -9.776 1.00 0.06 H HETATM 1337 C LEU A 1 3.022 -6.073 -9.536 1.00 0.21 C HETATM 1338 O LEU A 1 4.249 -6.117 -9.616 1.00 -0.39 O HETATM 1339 N LEU A 1 2.193 -7.110 -9.831 1.00 -0.25 N HETATM 1340 CA LEU A 1 2.722 -8.387 -10.279 1.00 0.13 C HETATM 1341 C LEU A 1 3.194 -8.306 -11.732 1.00 0.21 C HETATM 1342 O LEU A 1 2.963 -7.305 -12.408 1.00 -0.39 O HETATM 1343 N LEU A 1 3.863 -9.401 -12.181 1.00 -0.25 N HETATM 1344 CA LEU A 1 4.369 -9.464 -13.542 1.00 0.13 C HETATM 1345 C LEU A 1 3.233 -9.706 -14.538 1.00 0.20 C HETATM 1346 O LEU A 1 2.152 -10.151 -14.156 1.00 -0.39 O HETATM 1347 N LEU A 1 3.518 -9.404 -15.796 1.00 -0.26 N HETATM 1348 CA LEU A 1 2.534 -9.584 -16.850 1.00 0.13 C HETATM 1349 CB LEU A 1 3.060 -9.028 -18.175 1.00 -0.01 C HETATM 1350 CG LEU A 1 2.230 -7.911 -18.811 1.00 -0.04 C HETATM 1351 CD1 LEU A 1 3.112 -6.977 -19.641 1.00 -0.06 C HETATM 1352 H58 LEU A 1 2.491 -6.185 -20.086 1.00 0.02 H HETATM 1353 H59 LEU A 1 3.603 -7.551 -20.441 1.00 0.02 H HETATM 1354 H60 LEU A 1 3.877 -6.523 -18.993 1.00 0.02 H HETATM 1355 CD2 LEU A 1 1.073 -8.487 -19.631 1.00 -0.06 C HETATM 1356 H61 LEU A 1 0.468 -9.150 -18.995 1.00 0.02 H HETATM 1357 H62 LEU A 1 1.475 -9.059 -20.480 1.00 0.02 H HETATM 1358 H63 LEU A 1 0.445 -7.666 -20.006 1.00 0.02 H HETATM 1359 H57 LEU A 1 1.793 -7.315 -17.997 1.00 0.03 H HETATM 1360 H55 LEU A 1 3.110 -9.860 -18.893 1.00 0.03 H HETATM 1361 H56 LEU A 1 4.072 -8.636 -17.997 1.00 0.03 H HETATM 1362 C LEU A 1 2.130 -11.058 -16.919 1.00 0.20 C HETATM 1363 O LEU A 1 2.987 -11.938 -16.981 1.00 -0.39 O HETATM 1364 N LEU A 1 0.824 -11.282 -16.904 1.00 -0.26 N HETATM 1365 CA LEU A 1 0.296 -12.634 -16.964 1.00 0.15 C HETATM 1366 CB LEU A 1 -0.974 -12.768 -16.121 1.00 0.08 C HETATM 1367 OG LEU A 1 -2.090 -12.124 -16.731 1.00 -0.39 O HETATM 1368 H68 LEU A 1 -2.856 -12.229 -16.179 1.00 0.21 H HETATM 1369 H66 LEU A 1 -0.796 -12.312 -15.136 1.00 0.06 H HETATM 1370 H67 LEU A 1 -1.206 -13.836 -15.995 1.00 0.06 H HETATM 1371 C LEU A 1 0.011 -13.021 -18.417 1.00 0.21 C HETATM 1372 O LEU A 1 -0.158 -12.153 -19.272 1.00 -0.39 O HETATM 1373 N LEU A 1 -0.033 -14.358 -18.658 1.00 -0.25 N HETATM 1374 CA LEU A 1 -0.295 -14.870 -19.993 1.00 0.13 C HETATM 1375 C LEU A 1 -1.773 -14.720 -20.358 1.00 0.20 C HETATM 1376 O LEU A 1 -2.590 -14.353 -19.515 1.00 -0.39 O HETATM 1377 N LEU A 1 -2.071 -15.011 -21.615 1.00 -0.26 N HETATM 1378 CA LEU A 1 -3.437 -14.914 -22.102 1.00 0.15 C HETATM 1379 CB LEU A 1 -3.480 -14.939 -23.631 1.00 0.08 C HETATM 1380 OG LEU A 1 -2.880 -16.117 -24.163 1.00 -0.39 O HETATM 1381 H80 LEU A 1 -3.344 -16.881 -23.840 1.00 0.21 H HETATM 1382 H78 LEU A 1 -2.941 -14.061 -24.016 1.00 0.06 H HETATM 1383 H79 LEU A 1 -4.530 -14.897 -23.957 1.00 0.06 H HETATM 1384 C LEU A 1 -4.280 -16.055 -21.529 1.00 0.21 C HETATM 1385 O LEU A 1 -4.348 -17.135 -22.114 1.00 -0.39 O HETATM 1386 N LEU A 1 -4.900 -15.776 -20.392 1.00 -0.26 N HETATM 1387 CA LEU A 1 -5.735 -16.766 -19.733 1.00 0.13 C HETATM 1388 CB LEU A 1 -5.909 -16.439 -18.248 1.00 -0.01 C HETATM 1389 CG LEU A 1 -4.907 -17.219 -17.394 1.00 -0.02 C HETATM 1390 CD LEU A 1 -3.475 -16.992 -17.883 1.00 0.06 C HETATM 1391 NE LEU A 1 -2.581 -18.034 -17.332 1.00 -0.27 N HETATM 1392 CZ LEU A 1 -2.463 -19.269 -17.838 1.00 0.29 C HETATM 1393 NH2 LEU A 1 -1.626 -20.149 -17.272 1.00 -0.28 N HETATM 1394 H92 LEU A 1 -1.073 -19.876 -16.447 1.00 0.26 H HETATM 1395 H93 LEU A 1 -1.536 -21.098 -17.662 1.00 0.26 H HETATM 1396 NH1 LEU A 1 -3.183 -19.624 -18.911 1.00 -0.28 N HETATM 1397 H90 LEU A 1 -3.093 -20.573 -19.301 1.00 0.26 H HETATM 1398 H91 LEU A 1 -3.826 -18.948 -19.346 1.00 0.26 H HETATM 1399 H89 LEU A 1 -2.013 -17.795 -16.507 1.00 0.26 H HETATM 1400 H87 LEU A 1 -3.129 -16.002 -17.550 1.00 0.07 H HETATM 1401 H88 LEU A 1 -3.454 -17.038 -18.982 1.00 0.07 H HETATM 1402 H85 LEU A 1 -5.142 -18.292 -17.454 1.00 0.03 H HETATM 1403 H86 LEU A 1 -4.987 -16.884 -16.349 1.00 0.03 H HETATM 1404 H83 LEU A 1 -6.930 -16.706 -17.938 1.00 0.03 H HETATM 1405 H84 LEU A 1 -5.749 -15.361 -18.096 1.00 0.03 H HETATM 1406 C LEU A 1 -7.111 -16.829 -20.399 1.00 0.20 C HETATM 1407 O LEU A 1 -8.055 -16.187 -19.942 1.00 -0.39 O HETATM 1408 N LEU A 1 -7.180 -17.608 -21.468 1.00 -0.26 N HETATM 1409 CA LEU A 1 -8.425 -17.763 -22.201 1.00 0.13 C HETATM 1410 CB LEU A 1 -8.167 -18.250 -23.629 1.00 -0.01 C HETATM 1411 CG LEU A 1 -7.163 -19.405 -23.641 1.00 -0.02 C HETATM 1412 CD LEU A 1 -7.447 -20.366 -24.797 1.00 0.06 C HETATM 1413 NE LEU A 1 -6.201 -21.056 -25.200 1.00 -0.27 N HETATM 1414 CZ LEU A 1 -5.657 -22.079 -24.528 1.00 0.29 C HETATM 1415 NH2 LEU A 1 -4.524 -22.643 -24.968 1.00 -0.28 N HETATM 1416 H105 LEU A 1 -4.072 -22.290 -25.823 1.00 0.26 H HETATM 1417 H106 LEU A 1 -4.106 -23.429 -24.451 1.00 0.26 H HETATM 1418 NH1 LEU A 1 -6.246 -22.538 -23.415 1.00 -0.28 N HETATM 1419 H103 LEU A 1 -5.828 -23.325 -22.898 1.00 0.26 H HETATM 1420 H104 LEU A 1 -7.117 -22.104 -23.077 1.00 0.26 H HETATM 1421 H102 LEU A 1 -5.722 -20.729 -26.051 1.00 0.26 H HETATM 1422 H100 LEU A 1 -7.843 -19.799 -25.653 1.00 0.07 H HETATM 1423 H101 LEU A 1 -8.189 -21.112 -24.477 1.00 0.07 H HETATM 1424 H98 LEU A 1 -7.235 -19.954 -22.691 1.00 0.03 H HETATM 1425 H99 LEU A 1 -6.147 -18.998 -23.753 1.00 0.03 H HETATM 1426 H96 LEU A 1 -7.765 -17.418 -24.226 1.00 0.03 H HETATM 1427 H97 LEU A 1 -9.115 -18.593 -24.069 1.00 0.03 H HETATM 1428 C LEU A 1 -9.340 -18.760 -21.488 1.00 0.20 C HETATM 1429 O LEU A 1 -9.098 -19.966 -21.523 1.00 -0.39 O HETATM 1430 N LEU A 1 -10.373 -18.220 -20.857 1.00 -0.26 N HETATM 1431 CA LEU A 1 -11.326 -19.048 -20.138 1.00 0.15 C HETATM 1432 CB LEU A 1 -12.191 -18.203 -19.200 1.00 0.08 C HETATM 1433 OG LEU A 1 -11.407 -17.327 -18.394 1.00 -0.39 O HETATM 1434 H111 LEU A 1 -10.915 -16.739 -18.954 1.00 0.21 H HETATM 1435 H109 LEU A 1 -12.762 -18.875 -18.542 1.00 0.06 H HETATM 1436 H110 LEU A 1 -12.887 -17.602 -19.804 1.00 0.06 H HETATM 1437 C LEU A 1 -12.207 -19.812 -21.128 1.00 0.21 C HETATM 1438 O LEU A 1 -13.295 -19.355 -21.477 1.00 -0.39 O HETATM 1439 N LEU A 1 -11.706 -20.962 -21.552 1.00 -0.27 N HETATM 1440 CA LEU A 1 -12.434 -21.794 -22.495 1.00 0.13 C HETATM 1441 C LEU A 1 -12.257 -21.283 -23.926 1.00 0.25 C HETATM 1442 O LEU A 1 -12.272 -22.066 -24.875 1.00 -0.37 O HETATM 1443 O1 LEU A 1 -12.086 -19.983 -24.146 1.00 -0.29 O HETATM 1444 H115 LEU A 1 -12.098 -19.518 -23.317 1.00 0.25 H HETATM 1445 H113 LEU A 1 -13.503 -21.779 -22.237 1.00 0.08 H HETATM 1446 H114 LEU A 1 -12.056 -22.825 -22.432 1.00 0.08 H HETATM 1447 H112 LEU A 1 -10.813 -21.263 -21.218 1.00 0.19 H HETATM 1448 H108 LEU A 1 -10.767 -19.776 -19.532 1.00 0.08 H HETATM 1449 H107 LEU A 1 -10.498 -17.228 -20.876 1.00 0.19 H HETATM 1450 H95 LEU A 1 -8.928 -16.786 -22.246 1.00 0.08 H HETATM 1451 H94 LEU A 1 -6.363 -18.097 -21.775 1.00 0.19 H HETATM 1452 H82 LEU A 1 -5.250 -17.749 -19.824 1.00 0.08 H HETATM 1453 H81 LEU A 1 -4.792 -14.871 -19.981 1.00 0.19 H HETATM 1454 H77 LEU A 1 -3.861 -13.959 -21.759 1.00 0.08 H HETATM 1455 H76 LEU A 1 -1.345 -15.302 -22.238 1.00 0.19 H HETATM 1456 CB LEU A 1 0.164 -16.319 -19.955 1.00 -0.01 C HETATM 1457 CG LEU A 1 0.231 -16.697 -18.484 1.00 -0.03 C HETATM 1458 CD LEU A 1 0.163 -15.415 -17.670 1.00 0.04 C HETATM 1459 H74 LEU A 1 -0.680 -15.448 -16.965 1.00 0.05 H HETATM 1460 H75 LEU A 1 1.099 -15.258 -17.115 1.00 0.05 H HETATM 1461 H72 LEU A 1 -0.617 -17.349 -18.227 1.00 0.03 H HETATM 1462 H73 LEU A 1 1.175 -17.223 -18.276 1.00 0.03 H HETATM 1463 H70 LEU A 1 1.155 -16.419 -20.421 1.00 0.03 H HETATM 1464 H71 LEU A 1 -0.556 -16.962 -20.483 1.00 0.03 H HETATM 1465 H69 LEU A 1 0.302 -14.315 -20.731 1.00 0.08 H HETATM 1466 H65 LEU A 1 1.054 -13.321 -16.560 1.00 0.08 H HETATM 1467 H64 LEU A 1 0.192 -10.509 -16.851 1.00 0.19 H HETATM 1468 H54 LEU A 1 1.637 -9.006 -16.585 1.00 0.08 H HETATM 1469 H53 LEU A 1 4.424 -9.047 -16.024 1.00 0.19 H HETATM 1470 CB LEU A 1 5.397 -10.583 -13.529 1.00 -0.01 C HETATM 1471 CG LEU A 1 5.097 -11.410 -12.289 1.00 -0.03 C HETATM 1472 CD LEU A 1 4.156 -10.605 -11.408 1.00 0.04 C HETATM 1473 H51 LEU A 1 3.234 -11.171 -11.207 1.00 0.05 H HETATM 1474 H52 LEU A 1 4.643 -10.346 -10.456 1.00 0.05 H HETATM 1475 H49 LEU A 1 4.619 -12.358 -12.578 1.00 0.03 H HETATM 1476 H50 LEU A 1 6.030 -11.620 -11.745 1.00 0.03 H HETATM 1477 H47 LEU A 1 6.414 -10.168 -13.475 1.00 0.03 H HETATM 1478 H48 LEU A 1 5.301 -11.201 -14.434 1.00 0.03 H HETATM 1479 H46 LEU A 1 4.862 -8.516 -13.803 1.00 0.08 H HETATM 1480 CB LEU A 1 1.586 -9.376 -10.078 1.00 -0.01 C HETATM 1481 CG LEU A 1 0.321 -8.540 -9.964 1.00 -0.03 C HETATM 1482 CD LEU A 1 0.736 -7.094 -9.746 1.00 0.04 C HETATM 1483 H44 LEU A 1 0.309 -6.446 -10.526 1.00 0.05 H HETATM 1484 H45 LEU A 1 0.409 -6.742 -8.757 1.00 0.05 H HETATM 1485 H42 LEU A 1 -0.268 -8.625 -10.889 1.00 0.03 H HETATM 1486 H43 LEU A 1 -0.282 -8.888 -9.113 1.00 0.03 H HETATM 1487 H40 LEU A 1 1.744 -9.958 -9.158 1.00 0.03 H HETATM 1488 H41 LEU A 1 1.517 -10.059 -10.937 1.00 0.03 H HETATM 1489 H39 LEU A 1 3.578 -8.678 -9.653 1.00 0.08 H HETATM 1490 H33 LEU A 1 1.279 -5.051 -8.829 1.00 0.08 H HETATM 1491 H32 LEU A 1 3.457 -3.384 -7.956 1.00 0.19 H HETATM 1492 CB LEU A 1 4.839 -5.000 -5.071 1.00 -0.01 C HETATM 1493 CG LEU A 1 4.376 -5.662 -3.784 1.00 -0.03 C HETATM 1494 CD LEU A 1 3.076 -4.998 -3.360 1.00 0.04 C HETATM 1495 H30 LEU A 1 2.274 -5.744 -3.260 1.00 0.05 H HETATM 1496 H31 LEU A 1 3.205 -4.468 -2.405 1.00 0.05 H HETATM 1497 H28 LEU A 1 4.209 -6.736 -3.955 1.00 0.03 H HETATM 1498 H29 LEU A 1 5.137 -5.529 -3.001 1.00 0.03 H HETATM 1499 H26 LEU A 1 5.688 -4.330 -4.872 1.00 0.03 H HETATM 1500 H27 LEU A 1 5.137 -5.761 -5.807 1.00 0.03 H HETATM 1501 H25 LEU A 1 3.986 -3.219 -5.930 1.00 0.08 H HETATM 1502 H15 LEU A 1 1.380 -3.811 -2.440 1.00 0.08 H HETATM 1503 H14 LEU A 1 0.315 -1.099 -2.672 1.00 0.19 H HETATM 1504 H4 LEU A 1 1.538 0.634 -1.968 1.00 0.11 H HETATM 1505 H1 LEU A 1 1.300 0.935 0.377 1.00 0.20 H HETATM 1506 H2 LEU A 1 1.772 -0.617 0.660 1.00 0.20 H HETATM 1507 H3 LEU A 1 0.384 -0.318 -0.173 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1289 1290 1505 1506 1507 CONECT 1290 1289 1291 1304 1504 CONECT 1291 1290 1292 1302 1303 CONECT 1292 1291 1293 1297 1301 CONECT 1293 1292 1294 1295 1296 CONECT 1294 1293 CONECT 1295 1293 CONECT 1296 1293 CONECT 1297 1292 1298 1299 1300 CONECT 1298 1297 CONECT 1299 1297 CONECT 1300 1297 CONECT 1301 1292 CONECT 1302 1291 CONECT 1303 1291 CONECT 1304 1290 1305 1306 CONECT 1305 1304 CONECT 1306 1304 1307 1503 CONECT 1307 1306 1308 1321 1502 CONECT 1308 1307 1309 1319 1320 CONECT 1309 1308 1310 1314 1318 CONECT 1310 1309 1311 1312 1313 CONECT 1311 1310 CONECT 1312 1310 CONECT 1313 1310 CONECT 1314 1309 1315 1316 1317 CONECT 1315 1314 CONECT 1316 1314 CONECT 1317 1314 CONECT 1318 1309 CONECT 1319 1308 CONECT 1320 1308 CONECT 1321 1307 1322 1323 CONECT 1322 1321 CONECT 1323 1321 1324 1494 CONECT 1324 1323 1325 1492 1501 CONECT 1325 1324 1326 1327 CONECT 1326 1325 CONECT 1327 1325 1328 1491 CONECT 1328 1327 1329 1337 1490 CONECT 1329 1328 1330 1334 1336 CONECT 1330 1329 1331 1332 1333 CONECT 1331 1330 CONECT 1332 1330 CONECT 1333 1330 CONECT 1334 1329 1335 CONECT 1335 1334 CONECT 1336 1329 CONECT 1337 1328 1338 1339 CONECT 1338 1337 CONECT 1339 1337 1340 1482 CONECT 1340 1339 1341 1480 1489 CONECT 1341 1340 1342 1343 CONECT 1342 1341 CONECT 1343 1341 1344 1472 CONECT 1344 1343 1345 1470 1479 CONECT 1345 1344 1346 1347 CONECT 1346 1345 CONECT 1347 1345 1348 1469 CONECT 1348 1347 1349 1362 1468 CONECT 1349 1348 1350 1360 1361 CONECT 1350 1349 1351 1355 1359 CONECT 1351 1350 1352 1353 1354 CONECT 1352 1351 CONECT 1353 1351 CONECT 1354 1351 CONECT 1355 1350 1356 1357 1358 CONECT 1356 1355 CONECT 1357 1355 CONECT 1358 1355 CONECT 1359 1350 CONECT 1360 1349 CONECT 1361 1349 CONECT 1362 1348 1363 1364 CONECT 1363 1362 CONECT 1364 1362 1365 1467 CONECT 1365 1364 1366 1371 1466 CONECT 1366 1365 1367 1369 1370 CONECT 1367 1366 1368 CONECT 1368 1367 CONECT 1369 1366 CONECT 1370 1366 CONECT 1371 1365 1372 1373 CONECT 1372 1371 CONECT 1373 1371 1374 1458 CONECT 1374 1373 1375 1456 1465 CONECT 1375 1374 1376 1377 CONECT 1376 1375 CONECT 1377 1375 1378 1455 CONECT 1378 1377 1379 1384 1454 CONECT 1379 1378 1380 1382 1383 CONECT 1380 1379 1381 CONECT 1381 1380 CONECT 1382 1379 CONECT 1383 1379 CONECT 1384 1378 1385 1386 CONECT 1385 1384 CONECT 1386 1384 1387 1453 CONECT 1387 1386 1388 1406 1452 CONECT 1388 1387 1389 1404 1405 CONECT 1389 1388 1390 1402 1403 CONECT 1390 1389 1391 1400 1401 CONECT 1391 1390 1392 1399 CONECT 1392 1391 1393 1396 CONECT 1393 1392 1394 1395 CONECT 1394 1393 CONECT 1395 1393 CONECT 1396 1392 1397 1398 CONECT 1397 1396 CONECT 1398 1396 CONECT 1399 1391 CONECT 1400 1390 CONECT 1401 1390 CONECT 1402 1389 CONECT 1403 1389 CONECT 1404 1388 CONECT 1405 1388 CONECT 1406 1387 1407 1408 CONECT 1407 1406 CONECT 1408 1406 1409 1451 CONECT 1409 1408 1410 1428 1450 CONECT 1410 1409 1411 1426 1427 CONECT 1411 1410 1412 1424 1425 CONECT 1412 1411 1413 1422 1423 CONECT 1413 1412 1414 1421 CONECT 1414 1413 1415 1418 CONECT 1415 1414 1416 1417 CONECT 1416 1415 CONECT 1417 1415 CONECT 1418 1414 1419 1420 CONECT 1419 1418 CONECT 1420 1418 CONECT 1421 1413 CONECT 1422 1412 CONECT 1423 1412 CONECT 1424 1411 CONECT 1425 1411 CONECT 1426 1410 CONECT 1427 1410 CONECT 1428 1409 1429 1430 CONECT 1429 1428 CONECT 1430 1428 1431 1449 CONECT 1431 1430 1432 1437 1448 CONECT 1432 1431 1433 1435 1436 CONECT 1433 1432 1434 CONECT 1434 1433 CONECT 1435 1432 CONECT 1436 1432 CONECT 1437 1431 1438 1439 CONECT 1438 1437 CONECT 1439 1437 1440 1447 CONECT 1440 1439 1441 1445 1446 CONECT 1441 1440 1442 1443 CONECT 1442 1441 CONECT 1443 1441 1444 CONECT 1444 1443 CONECT 1445 1440 CONECT 1446 1440 CONECT 1447 1439 CONECT 1448 1431 CONECT 1449 1430 CONECT 1450 1409 CONECT 1451 1408 CONECT 1452 1387 CONECT 1453 1386 CONECT 1454 1378 CONECT 1455 1377 CONECT 1456 1374 1457 1463 1464 CONECT 1457 1456 1458 1461 1462 CONECT 1458 1373 1457 1459 1460 CONECT 1459 1458 CONECT 1460 1458 CONECT 1461 1457 CONECT 1462 1457 CONECT 1463 1456 CONECT 1464 1456 CONECT 1465 1374 CONECT 1466 1365 CONECT 1467 1364 CONECT 1468 1348 CONECT 1469 1347 CONECT 1470 1344 1471 1477 1478 CONECT 1471 1470 1472 1475 1476 CONECT 1472 1343 1471 1473 1474 CONECT 1473 1472 CONECT 1474 1472 CONECT 1475 1471 CONECT 1476 1471 CONECT 1477 1470 CONECT 1478 1470 CONECT 1479 1344 CONECT 1480 1340 1481 1487 1488 CONECT 1481 1480 1482 1485 1486 CONECT 1482 1339 1481 1483 1484 CONECT 1483 1482 CONECT 1484 1482 CONECT 1485 1481 CONECT 1486 1481 CONECT 1487 1480 CONECT 1488 1480 CONECT 1489 1340 CONECT 1490 1328 CONECT 1491 1327 CONECT 1492 1324 1493 1499 1500 CONECT 1493 1492 1494 1497 1498 CONECT 1494 1323 1493 1495 1496 CONECT 1495 1494 CONECT 1496 1494 CONECT 1497 1493 CONECT 1498 1493 CONECT 1499 1492 CONECT 1500 1492 CONECT 1501 1324 CONECT 1502 1307 CONECT 1503 1306 CONECT 1504 1290 CONECT 1505 1289 CONECT 1506 1289 CONECT 1507 1289 MASTER 0 0 0 0 0 0 0 0 1506 1 223 7 END
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Entry Information
PDB ID
1mv0
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Bin1C SH3 domain
Ligand Name
14-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=0.0933mM
Release Year
2003
Protein/NA Sequence
Check fasta file
Primary Reference
(2005) J.Mol.Biol. Vol. 351: pp. 182-194
Ligand Properties
Formula
C
6
5
H
1
1
5
N
2
0
O
1
9
Molecular Weight
1480.730
Exact Mass
1479.860
No. of atoms
219
No. of bonds
222
Polar Surface Area
621.02
LOGP Value
-3.47 (
Computed with XLOGP3
)
-6.52 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 15
No. of Hydrogen Bond Acceptors: 19
No. of Rotatable Bonds: 59
No. of Nitrogen and Oxygen Atoms: 39
No. of Rings: 4
Canonical SMILES
OC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)O)CO)CCC[NH+]=C(N)N)CCC[NH+]=C(N)N)CO)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(C)C)[NH3+])CC(C)C)CC(C)C
InChI String
InChI=1S/C65H112N20O19/c1-33(2)26-37(66)51(92)77-41(28-35(5)6)60(101)82-22-11-18-47(82)59(100)81-50(36(7)89)63(104)85-25-13-19-48(85)62(103)84-24-12-17-46(84)57(98)76-40(27-34(3)4)55(96)80-44(32-88)61(102)83-23-10-16-45(83)58(99)79-43(31-87)56(97)75-38(14-8-20-71-64(67)68)53(94)74-39(15-9-21-72-65(69)70)54(95)78-42(30-86)52(93)73-29-49(90)91/h33-48,50,86-89H,8-32,66H2,1-7H3,(H,73,93)(H,74,94)(H,75,97)(H,76,98)(H,77,92)(H,78,95)(H,79,99)(H,80,96)(H,81,100)(H,90,91)(H4,67,68,71)(H4,69,70,72)/p+3/t36-,37+,38+,39+,40+,41+,42+,43+,44+,45+,46+,47+,48+,50+/m1/s1
Links to External Databases
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UniProtKB AC
UniProt accession number (AC):
O00499
P01106
Entrez Gene ID
NCBI Entrez Gene ID:
274
4609
ASD
Information of known allosteric effects of PDB entries
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