Browse entries in the PDBbind-CN Database
HEADER 4X8P_COMPLEX COMPND 4X8P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 115 SER ARG VAL LEU LEU ALA LEU HIS ASP ARG ALA PRO GLN SEQRES 2 A 115 LEU LYS ILE SER ASP ASP ARG LEU THR VAL VAL GLY GLU SEQRES 3 A 115 LYS GLY TYR SER MET VAL ARG ALA SER HIS GLY VAL ARG SEQRES 4 A 115 LYS GLY ALA TRP TYR PHE GLU ILE THR VAL ASP GLU MET SEQRES 5 A 115 PRO PRO ASP THR ALA ALA ARG LEU GLY TRP SER GLN PRO SEQRES 6 A 115 LEU GLY ASN LEU GLN ALA PRO LEU GLY TYR ASP LYS PHE SEQRES 7 A 115 SER TYR SER TRP ARG SER LYS LYS GLY THR LYS PHE HIS SEQRES 8 A 115 GLN SER ILE GLY LYS HIS TYR SER SER GLY TYR GLY GLN SEQRES 9 A 115 GLY ASP VAL LEU GLY PHE TYR ILE ASN LEU PRO SEQRES 1 A 61 GLY SER GLU ILE ILE PHE TYR LYS ASN GLY VAL ASN GLN SEQRES 2 A 61 GLY VAL ALA TYR LYS ASP ILE PHE GLU GLY VAL TYR PHE SEQRES 3 A 61 PRO ALA ILE SER LEU TYR LYS SER CYS THR VAL SER ILE SEQRES 4 A 61 ASN PHE GLY PRO CYS PHE LYS TYR PRO PRO LYS ASP LEU SEQRES 5 A 61 THR TYR ARG PRO MET SER ASP MET GLY HET GLU A 299 195 ATOM 1 N SER A 285 -14.259 14.299 20.441 1.00 30.20 N ATOM 2 CA SER A 285 -13.330 14.576 19.338 1.00 30.62 C ATOM 3 C SER A 285 -12.374 13.384 19.135 1.00 32.40 C ATOM 4 O SER A 285 -11.722 12.924 20.076 1.00 31.97 O ATOM 5 CB SER A 285 -12.561 15.876 19.570 1.00 35.90 C ATOM 6 OG SER A 285 -11.658 16.187 18.516 1.00 46.06 O ATOM 7 HG SER A 285 -11.192 17.036 18.722 1.00 0.00 H ATOM 8 HN3 SER A 285 -13.719 14.142 21.316 1.00 0.00 H ATOM 9 HN2 SER A 285 -14.816 13.449 20.218 1.00 0.00 H ATOM 10 HN1 SER A 285 -14.897 15.110 20.567 1.00 0.00 H ATOM 11 N ARG A 286 -12.337 12.872 17.901 1.00 25.41 N ATOM 12 CA ARG A 286 -11.571 11.691 17.513 1.00 23.34 C ATOM 13 C ARG A 286 -10.290 12.041 16.764 1.00 22.22 C ATOM 14 O ARG A 286 -10.227 13.069 16.092 1.00 21.57 O ATOM 15 CB ARG A 286 -12.464 10.775 16.641 1.00 22.50 C ATOM 16 H ARG A 286 -12.894 13.349 17.164 1.00 0.00 H ATOM 17 N VAL A 287 -9.270 11.178 16.891 1.00 15.76 N ATOM 18 CA VAL A 287 -8.001 11.277 16.164 1.00 13.92 C ATOM 19 C VAL A 287 -8.308 10.603 14.808 1.00 16.07 C ATOM 20 O VAL A 287 -8.870 9.497 14.774 1.00 14.32 O ATOM 21 CB VAL A 287 -6.797 10.626 16.926 1.00 16.89 C ATOM 22 CG1 VAL A 287 -5.470 10.869 16.190 1.00 16.11 C ATOM 23 CG2 VAL A 287 -6.701 11.151 18.356 1.00 16.31 C ATOM 24 H VAL A 287 -9.388 10.383 17.551 1.00 0.00 H ATOM 25 N LEU A 288 -8.067 11.328 13.701 1.00 11.88 N ATOM 26 CA LEU A 288 -8.398 10.858 12.357 1.00 11.37 C ATOM 27 C LEU A 288 -7.315 11.250 11.355 1.00 16.76 C ATOM 28 O LEU A 288 -6.408 11.999 11.701 1.00 16.46 O ATOM 29 CB LEU A 288 -9.744 11.494 11.906 1.00 11.20 C ATOM 30 CG LEU A 288 -10.987 11.302 12.804 1.00 14.98 C ATOM 31 CD1 LEU A 288 -12.031 12.380 12.536 1.00 13.66 C ATOM 32 CD2 LEU A 288 -11.576 9.882 12.659 1.00 14.81 C ATOM 33 H LEU A 288 -7.626 12.264 13.806 1.00 0.00 H ATOM 34 N LEU A 289 -7.410 10.762 10.110 1.00 13.64 N ATOM 35 CA LEU A 289 -6.518 11.232 9.047 1.00 13.10 C ATOM 36 C LEU A 289 -6.951 12.671 8.782 1.00 14.75 C ATOM 37 O LEU A 289 -8.159 12.937 8.749 1.00 12.29 O ATOM 38 CB LEU A 289 -6.614 10.369 7.779 1.00 12.94 C ATOM 39 CG LEU A 289 -6.036 8.936 7.946 1.00 18.05 C ATOM 40 CD1 LEU A 289 -6.291 8.087 6.706 1.00 17.63 C ATOM 41 CD2 LEU A 289 -4.528 8.959 8.361 1.00 16.27 C ATOM 42 H LEU A 289 -8.127 10.040 9.896 1.00 0.00 H ATOM 43 N ALA A 290 -5.982 13.618 8.760 1.00 12.53 N ATOM 44 CA ALA A 290 -6.289 15.048 8.595 1.00 12.20 C ATOM 45 C ALA A 290 -6.734 15.416 7.179 1.00 15.51 C ATOM 46 O ALA A 290 -5.994 15.175 6.219 1.00 15.86 O ATOM 47 CB ALA A 290 -5.098 15.905 9.009 1.00 12.89 C ATOM 48 H ALA A 290 -4.989 13.325 8.863 1.00 0.00 H ATOM 49 N LEU A 291 -7.927 16.039 7.061 1.00 10.63 N ATOM 50 CA LEU A 291 -8.455 16.535 5.792 1.00 10.57 C ATOM 51 C LEU A 291 -7.629 17.743 5.294 1.00 14.06 C ATOM 52 O LEU A 291 -7.428 17.892 4.093 1.00 12.72 O ATOM 53 CB LEU A 291 -9.947 16.912 5.917 1.00 11.63 C ATOM 54 CG LEU A 291 -10.995 15.765 5.983 1.00 15.89 C ATOM 55 CD1 LEU A 291 -12.391 16.319 6.268 1.00 16.04 C ATOM 56 CD2 LEU A 291 -11.068 15.015 4.675 1.00 18.09 C ATOM 57 H LEU A 291 -8.500 16.173 7.919 1.00 0.00 H ATOM 58 N HIS A 292 -7.095 18.555 6.234 1.00 10.32 N ATOM 59 CA HIS A 292 -6.290 19.738 5.969 1.00 10.26 C ATOM 60 C HIS A 292 -4.809 19.463 5.686 1.00 15.56 C ATOM 61 O HIS A 292 -4.135 20.342 5.165 1.00 15.26 O ATOM 62 CB HIS A 292 -6.351 20.685 7.183 1.00 10.33 C ATOM 63 CG HIS A 292 -7.722 21.175 7.531 1.00 13.36 C ATOM 64 ND1 HIS A 292 -8.497 21.880 6.622 1.00 14.16 N ATOM 65 CD2 HIS A 292 -8.392 21.090 8.702 1.00 14.54 C ATOM 66 CE1 HIS A 292 -9.593 22.212 7.275 1.00 13.66 C ATOM 67 NE2 HIS A 292 -9.589 21.736 8.518 1.00 14.17 N ATOM 68 H HIS A 292 -7.275 18.314 7.230 1.00 0.00 H ATOM 69 N ASP A 293 -4.289 18.310 6.122 1.00 10.88 N ATOM 70 CA ASP A 293 -2.858 17.991 6.088 1.00 9.60 C ATOM 71 C ASP A 293 -2.578 16.675 5.359 1.00 13.54 C ATOM 72 O ASP A 293 -2.153 15.675 5.954 1.00 12.38 O ATOM 73 CB ASP A 293 -2.379 17.956 7.545 1.00 10.66 C ATOM 74 CG ASP A 293 -0.918 18.137 7.783 1.00 12.66 C ATOM 75 OD1 ASP A 293 -0.248 18.749 6.924 1.00 14.09 O ATOM 76 OD2 ASP A 293 -0.430 17.659 8.827 1.00 16.20 O ATOM 77 H ASP A 293 -4.939 17.596 6.509 1.00 0.00 H ATOM 78 N ARG A 294 -2.815 16.703 4.045 1.00 10.98 N ATOM 79 CA ARG A 294 -2.694 15.563 3.153 1.00 11.50 C ATOM 80 C ARG A 294 -2.349 15.992 1.745 1.00 16.22 C ATOM 81 O ARG A 294 -2.600 17.140 1.364 1.00 14.95 O ATOM 82 CB ARG A 294 -4.042 14.782 3.110 1.00 8.97 C ATOM 83 CG ARG A 294 -5.224 15.594 2.618 1.00 12.54 C ATOM 84 CD ARG A 294 -6.539 14.870 2.775 1.00 12.27 C ATOM 85 NE ARG A 294 -7.653 15.804 2.612 1.00 17.68 N ATOM 86 CZ ARG A 294 -8.552 15.773 1.634 1.00 21.10 C ATOM 87 NH1 ARG A 294 -8.498 14.830 0.699 1.00 8.90 N ATOM 88 NH2 ARG A 294 -9.522 16.675 1.591 1.00 5.87 N ATOM 89 HE ARG A 294 -7.750 16.557 3.323 1.00 0.00 H ATOM 90 HH12 ARG A 294 -9.205 14.812 -0.063 1.00 0.00 H ATOM 91 HH11 ARG A 294 -7.748 14.110 0.730 1.00 0.00 H ATOM 92 HH22 ARG A 294 -10.224 16.648 0.824 1.00 0.00 H ATOM 93 HH21 ARG A 294 -9.581 17.410 2.324 1.00 0.00 H ATOM 94 H ARG A 294 -3.108 17.610 3.629 1.00 0.00 H ATOM 95 N ALA A 295 -1.831 15.038 0.949 1.00 12.49 N ATOM 96 CA ALA A 295 -1.607 15.246 -0.475 1.00 11.47 C ATOM 97 C ALA A 295 -2.983 15.110 -1.158 1.00 13.25 C ATOM 98 O ALA A 295 -3.736 14.195 -0.816 1.00 10.25 O ATOM 99 CB ALA A 295 -0.660 14.199 -1.021 1.00 11.91 C ATOM 100 H ALA A 295 -1.582 14.119 1.366 1.00 0.00 H ATOM 101 N PRO A 296 -3.328 16.039 -2.086 1.00 11.91 N ATOM 102 CA PRO A 296 -4.643 15.968 -2.781 1.00 11.94 C ATOM 103 C PRO A 296 -4.980 14.697 -3.577 1.00 16.16 C ATOM 104 O PRO A 296 -6.163 14.433 -3.813 1.00 15.46 O ATOM 105 CB PRO A 296 -4.612 17.164 -3.740 1.00 13.81 C ATOM 106 CG PRO A 296 -3.154 17.579 -3.837 1.00 18.19 C ATOM 107 CD PRO A 296 -2.523 17.198 -2.538 1.00 12.94 C ATOM 108 N GLN A 297 -3.959 13.970 -4.074 1.00 12.32 N ATOM 109 CA GLN A 297 -4.159 12.781 -4.904 1.00 12.32 C ATOM 110 C GLN A 297 -4.621 11.536 -4.114 1.00 16.13 C ATOM 111 O GLN A 297 -5.270 10.666 -4.685 1.00 14.33 O ATOM 112 CB GLN A 297 -2.929 12.486 -5.814 1.00 13.47 C ATOM 113 CG GLN A 297 -1.612 12.163 -5.076 1.00 12.33 C ATOM 114 CD GLN A 297 -0.786 13.396 -4.829 1.00 14.87 C ATOM 115 OE1 GLN A 297 -1.286 14.435 -4.407 1.00 13.09 O ATOM 116 NE2 GLN A 297 0.500 13.330 -5.127 1.00 8.00 N ATOM 117 HE22 GLN A 297 0.906 12.441 -5.483 1.00 0.00 H ATOM 118 HE21 GLN A 297 1.106 14.167 -5.005 1.00 0.00 H ATOM 119 H GLN A 297 -2.986 14.267 -3.858 1.00 0.00 H ATOM 120 N LEU A 298 -4.301 11.474 -2.805 1.00 13.06 N ATOM 121 CA LEU A 298 -4.694 10.371 -1.937 1.00 11.97 C ATOM 122 C LEU A 298 -6.193 10.311 -1.783 1.00 17.19 C ATOM 123 O LEU A 298 -6.877 11.340 -1.752 1.00 16.67 O ATOM 124 CB LEU A 298 -4.043 10.460 -0.546 1.00 11.02 C ATOM 125 CG LEU A 298 -2.533 10.377 -0.475 1.00 14.31 C ATOM 126 CD1 LEU A 298 -2.053 10.762 0.902 1.00 14.75 C ATOM 127 CD2 LEU A 298 -2.029 8.982 -0.850 1.00 13.16 C ATOM 128 H LEU A 298 -3.746 12.252 -2.395 1.00 0.00 H ATOM 129 N LYS A 299 -6.706 9.095 -1.708 1.00 14.23 N ATOM 130 CA LYS A 299 -8.132 8.905 -1.560 1.00 13.91 C ATOM 131 C LYS A 299 -8.431 8.511 -0.109 1.00 17.79 C ATOM 132 O LYS A 299 -8.111 7.402 0.315 1.00 17.11 O ATOM 133 CB LYS A 299 -8.660 7.900 -2.611 1.00 15.82 C ATOM 134 CG LYS A 299 -8.529 8.448 -4.062 1.00 18.83 C ATOM 135 CD LYS A 299 -8.131 7.376 -5.076 1.00 31.52 C ATOM 136 CE LYS A 299 -6.638 7.186 -5.230 1.00 34.20 C ATOM 137 NZ LYS A 299 -6.317 6.019 -6.104 1.00 34.46 N ATOM 138 HZ1 LYS A 299 -6.716 5.154 -5.686 1.00 0.00 H ATOM 139 HZ2 LYS A 299 -6.727 6.171 -7.048 1.00 0.00 H ATOM 140 HZ3 LYS A 299 -5.285 5.922 -6.185 1.00 0.00 H ATOM 141 H LYS A 299 -6.078 8.267 -1.756 1.00 0.00 H ATOM 142 N ILE A 300 -9.017 9.451 0.643 1.00 15.18 N ATOM 143 CA ILE A 300 -9.395 9.285 2.049 1.00 15.19 C ATOM 144 C ILE A 300 -10.863 8.902 2.176 1.00 16.99 C ATOM 145 O ILE A 300 -11.718 9.497 1.522 1.00 17.42 O ATOM 146 CB ILE A 300 -8.928 10.485 2.955 1.00 18.78 C ATOM 147 CG1 ILE A 300 -7.378 10.453 3.150 1.00 20.13 C ATOM 148 CG2 ILE A 300 -9.590 10.460 4.355 1.00 16.87 C ATOM 149 CD1 ILE A 300 -6.628 11.298 2.289 1.00 31.32 C ATOM 150 H ILE A 300 -9.219 10.368 0.196 1.00 0.00 H ATOM 151 N SER A 301 -11.141 7.849 2.961 1.00 12.71 N ATOM 152 CA SER A 301 -12.496 7.348 3.193 1.00 12.80 C ATOM 153 C SER A 301 -13.335 8.356 3.975 1.00 15.14 C ATOM 154 O SER A 301 -12.780 9.208 4.658 1.00 16.57 O ATOM 155 CB SER A 301 -12.439 6.018 3.946 1.00 14.83 C ATOM 156 OG SER A 301 -11.909 6.212 5.247 1.00 12.09 O ATOM 157 HG SER A 301 -11.878 5.344 5.722 1.00 0.00 H ATOM 158 H SER A 301 -10.350 7.363 3.430 1.00 0.00 H ATOM 159 N ASP A 302 -14.657 8.256 3.888 1.00 10.91 N ATOM 160 CA ASP A 302 -15.602 9.124 4.615 1.00 10.84 C ATOM 161 C ASP A 302 -15.343 9.131 6.120 1.00 15.84 C ATOM 162 O ASP A 302 -15.404 10.204 6.734 1.00 15.54 O ATOM 163 CB ASP A 302 -17.065 8.741 4.312 1.00 11.79 C ATOM 164 CG ASP A 302 -17.482 8.820 2.833 1.00 19.86 C ATOM 165 OD1 ASP A 302 -16.680 9.306 2.004 1.00 18.39 O ATOM 166 OD2 ASP A 302 -18.611 8.396 2.511 1.00 24.75 O ATOM 167 H ASP A 302 -15.050 7.519 3.268 1.00 0.00 H ATOM 168 N ASP A 303 -14.978 7.952 6.704 1.00 12.40 N ATOM 169 CA ASP A 303 -14.675 7.857 8.138 1.00 12.97 C ATOM 170 C ASP A 303 -13.294 8.399 8.486 1.00 16.65 C ATOM 171 O ASP A 303 -13.002 8.497 9.667 1.00 16.02 O ATOM 172 CB ASP A 303 -14.889 6.420 8.708 1.00 14.89 C ATOM 173 CG ASP A 303 -13.925 5.336 8.244 1.00 16.91 C ATOM 174 OD1 ASP A 303 -13.025 5.637 7.440 1.00 15.90 O ATOM 175 OD2 ASP A 303 -14.087 4.187 8.667 1.00 22.43 O ATOM 176 H ASP A 303 -14.913 7.096 6.116 1.00 0.00 H ATOM 177 N ARG A 304 -12.441 8.745 7.460 1.00 12.94 N ATOM 178 CA ARG A 304 -11.076 9.294 7.618 1.00 11.88 C ATOM 179 C ARG A 304 -10.116 8.348 8.363 1.00 15.21 C ATOM 180 O ARG A 304 -9.210 8.791 9.083 1.00 14.24 O ATOM 181 CB ARG A 304 -11.120 10.670 8.299 1.00 11.97 C ATOM 182 CG ARG A 304 -11.877 11.747 7.496 1.00 18.28 C ATOM 183 CD ARG A 304 -12.134 12.963 8.354 1.00 14.57 C ATOM 184 NE ARG A 304 -10.889 13.476 8.933 1.00 15.32 N ATOM 185 CZ ARG A 304 -10.818 14.535 9.729 1.00 29.09 C ATOM 186 NH1 ARG A 304 -11.917 15.201 10.057 1.00 11.96 N ATOM 187 NH2 ARG A 304 -9.644 14.939 10.204 1.00 19.38 N ATOM 188 HE ARG A 304 -10.005 12.978 8.705 1.00 0.00 H ATOM 189 HH12 ARG A 304 -11.856 16.030 10.681 1.00 0.00 H ATOM 190 HH11 ARG A 304 -12.840 14.894 9.690 1.00 0.00 H ATOM 191 HH22 ARG A 304 -9.593 15.770 10.828 1.00 0.00 H ATOM 192 HH21 ARG A 304 -8.776 14.424 9.952 1.00 0.00 H ATOM 193 H ARG A 304 -12.787 8.608 6.489 1.00 0.00 H ATOM 194 N LEU A 305 -10.316 7.035 8.179 1.00 11.98 N ATOM 195 CA LEU A 305 -9.493 5.992 8.805 1.00 10.65 C ATOM 196 C LEU A 305 -8.847 5.103 7.753 1.00 15.51 C ATOM 197 O LEU A 305 -7.946 4.325 8.078 1.00 17.16 O ATOM 198 CB LEU A 305 -10.344 5.151 9.772 1.00 9.55 C ATOM 199 CG LEU A 305 -10.793 5.832 11.067 1.00 13.54 C ATOM 200 CD1 LEU A 305 -11.694 4.884 11.884 1.00 14.00 C ATOM 201 CD2 LEU A 305 -9.589 6.299 11.915 1.00 13.25 C ATOM 202 H LEU A 305 -11.097 6.739 7.559 1.00 0.00 H ATOM 203 N THR A 306 -9.308 5.215 6.500 1.00 10.93 N ATOM 204 CA THR A 306 -8.798 4.438 5.375 1.00 11.28 C ATOM 205 C THR A 306 -8.238 5.342 4.272 1.00 14.80 C ATOM 206 O THR A 306 -8.797 6.389 3.970 1.00 12.88 O ATOM 207 CB THR A 306 -9.844 3.402 4.891 1.00 16.77 C ATOM 208 OG1 THR A 306 -10.157 2.511 5.957 1.00 11.50 O ATOM 209 CG2 THR A 306 -9.370 2.579 3.693 1.00 16.77 C ATOM 210 HG1 THR A 306 -9.335 2.041 6.245 1.00 0.00 H ATOM 211 H THR A 306 -10.074 5.895 6.319 1.00 0.00 H ATOM 212 N VAL A 307 -7.124 4.919 3.677 1.00 13.07 N ATOM 213 CA VAL A 307 -6.483 5.690 2.623 1.00 12.90 C ATOM 214 C VAL A 307 -5.950 4.822 1.478 1.00 16.24 C ATOM 215 O VAL A 307 -5.392 3.744 1.713 1.00 15.20 O ATOM 216 CB VAL A 307 -5.480 6.745 3.170 1.00 14.97 C ATOM 217 CG1 VAL A 307 -4.353 6.093 3.983 1.00 13.99 C ATOM 218 CG2 VAL A 307 -4.933 7.641 2.056 1.00 14.26 C ATOM 219 H VAL A 307 -6.702 4.016 3.973 1.00 0.00 H ATOM 220 N VAL A 308 -6.186 5.283 0.234 1.00 12.98 N ATOM 221 CA VAL A 308 -5.732 4.619 -1.000 1.00 11.13 C ATOM 222 C VAL A 308 -4.752 5.563 -1.691 1.00 13.52 C ATOM 223 O VAL A 308 -5.049 6.745 -1.823 1.00 12.82 O ATOM 224 CB VAL A 308 -6.891 4.189 -1.948 1.00 13.80 C ATOM 225 CG1 VAL A 308 -6.372 3.275 -3.069 1.00 13.07 C ATOM 226 CG2 VAL A 308 -8.021 3.509 -1.184 1.00 13.04 C ATOM 227 H VAL A 308 -6.725 6.167 0.139 1.00 0.00 H ATOM 228 N GLY A 309 -3.607 5.027 -2.117 1.00 10.46 N ATOM 229 CA GLY A 309 -2.556 5.782 -2.789 1.00 10.17 C ATOM 230 C GLY A 309 -2.811 6.026 -4.263 1.00 15.41 C ATOM 231 O GLY A 309 -3.711 5.432 -4.867 1.00 14.43 O ATOM 232 H GLY A 309 -3.455 4.010 -1.960 1.00 0.00 H ATOM 233 N GLU A 310 -2.019 6.913 -4.854 1.00 12.62 N ATOM 234 CA GLU A 310 -2.179 7.243 -6.261 1.00 12.86 C ATOM 235 C GLU A 310 -0.811 7.599 -6.848 1.00 14.69 C ATOM 236 O GLU A 310 -0.204 8.569 -6.412 1.00 13.21 O ATOM 237 CB GLU A 310 -3.205 8.408 -6.408 1.00 14.32 C ATOM 238 CG GLU A 310 -3.343 8.976 -7.818 1.00 26.93 C ATOM 239 CD GLU A 310 -4.211 8.191 -8.784 1.00 54.61 C ATOM 240 OE1 GLU A 310 -5.195 7.548 -8.345 1.00 41.79 O ATOM 241 OE2 GLU A 310 -3.926 8.261 -10.001 1.00 55.05 O ATOM 242 H GLU A 310 -1.272 7.379 -4.301 1.00 0.00 H ATOM 243 N LYS A 311 -0.331 6.792 -7.821 1.00 12.29 N ATOM 244 CA LYS A 311 0.945 6.983 -8.543 1.00 13.04 C ATOM 245 C LYS A 311 2.121 7.174 -7.566 1.00 15.67 C ATOM 246 O LYS A 311 2.193 6.420 -6.597 1.00 15.16 O ATOM 247 CB LYS A 311 0.840 8.117 -9.593 1.00 15.38 C ATOM 248 CG LYS A 311 -0.322 7.948 -10.560 1.00 24.19 C ATOM 249 CD LYS A 311 -0.278 9.007 -11.647 1.00 40.09 C ATOM 250 CE LYS A 311 -1.449 8.902 -12.603 1.00 54.87 C ATOM 251 NZ LYS A 311 -2.647 9.618 -12.092 1.00 67.59 N ATOM 252 HZ1 LYS A 311 -2.932 9.207 -11.180 1.00 0.00 H ATOM 253 HZ2 LYS A 311 -2.419 10.625 -11.964 1.00 0.00 H ATOM 254 HZ3 LYS A 311 -3.425 9.521 -12.776 1.00 0.00 H ATOM 255 H LYS A 311 -0.908 5.968 -8.084 1.00 0.00 H ATOM 256 N GLY A 312 2.984 8.176 -7.809 1.00 11.53 N ATOM 257 CA GLY A 312 4.156 8.492 -6.995 1.00 10.17 C ATOM 258 C GLY A 312 3.857 8.746 -5.526 1.00 12.94 C ATOM 259 O GLY A 312 2.738 9.130 -5.172 1.00 11.85 O ATOM 260 H GLY A 312 2.803 8.773 -8.641 1.00 0.00 H ATOM 261 N TYR A 313 4.857 8.541 -4.655 1.00 8.99 N ATOM 262 CA TYR A 313 4.654 8.703 -3.217 1.00 8.19 C ATOM 263 C TYR A 313 4.070 10.022 -2.806 1.00 12.94 C ATOM 264 O TYR A 313 4.490 11.065 -3.293 1.00 12.26 O ATOM 265 CB TYR A 313 5.934 8.482 -2.438 1.00 8.59 C ATOM 266 CG TYR A 313 6.133 7.062 -1.961 1.00 6.92 C ATOM 267 CD1 TYR A 313 5.398 6.555 -0.887 1.00 7.07 C ATOM 268 CD2 TYR A 313 7.164 6.278 -2.473 1.00 6.77 C ATOM 269 CE1 TYR A 313 5.616 5.258 -0.408 1.00 8.91 C ATOM 270 CE2 TYR A 313 7.397 4.989 -1.999 1.00 6.95 C ATOM 271 CZ TYR A 313 6.607 4.473 -0.982 1.00 13.12 C ATOM 272 OH TYR A 313 6.847 3.198 -0.530 1.00 10.72 O ATOM 273 HH TYR A 313 7.771 3.142 -0.179 1.00 0.00 H ATOM 274 H TYR A 313 5.794 8.262 -5.010 1.00 0.00 H ATOM 275 N SER A 314 3.095 9.963 -1.896 1.00 9.86 N ATOM 276 CA SER A 314 2.445 11.140 -1.335 1.00 8.94 C ATOM 277 C SER A 314 1.935 10.786 0.070 1.00 11.45 C ATOM 278 O SER A 314 1.739 9.615 0.368 1.00 9.67 O ATOM 279 CB SER A 314 1.362 11.668 -2.262 1.00 9.31 C ATOM 280 OG SER A 314 0.228 10.829 -2.240 1.00 14.20 O ATOM 281 HG SER A 314 0.486 9.920 -2.536 1.00 0.00 H ATOM 282 H SER A 314 2.783 9.026 -1.570 1.00 0.00 H ATOM 283 N MET A 315 1.764 11.788 0.928 1.00 10.36 N ATOM 284 CA MET A 315 1.499 11.598 2.347 1.00 11.47 C ATOM 285 C MET A 315 0.292 12.321 2.929 1.00 16.06 C ATOM 286 O MET A 315 -0.133 13.369 2.430 1.00 15.48 O ATOM 287 CB MET A 315 2.781 12.029 3.110 1.00 14.41 C ATOM 288 CG MET A 315 2.783 11.715 4.615 1.00 19.29 C ATOM 289 SD MET A 315 3.703 12.927 5.589 1.00 25.21 S ATOM 290 CE MET A 315 5.321 12.799 4.798 1.00 21.42 C ATOM 291 H MET A 315 1.823 12.761 0.565 1.00 0.00 H ATOM 292 N VAL A 316 -0.240 11.719 4.013 1.00 11.93 N ATOM 293 CA VAL A 316 -1.302 12.198 4.890 1.00 10.62 C ATOM 294 C VAL A 316 -0.796 12.054 6.352 1.00 13.18 C ATOM 295 O VAL A 316 -0.184 11.035 6.691 1.00 12.03 O ATOM 296 CB VAL A 316 -2.680 11.487 4.648 1.00 13.12 C ATOM 297 CG1 VAL A 316 -2.602 9.964 4.814 1.00 12.08 C ATOM 298 CG2 VAL A 316 -3.776 12.071 5.536 1.00 12.76 C ATOM 299 H VAL A 316 0.160 10.790 4.255 1.00 0.00 H ATOM 300 N ARG A 317 -1.028 13.071 7.196 1.00 11.30 N ATOM 301 CA ARG A 317 -0.693 12.990 8.626 1.00 11.73 C ATOM 302 C ARG A 317 -2.028 12.853 9.378 1.00 14.42 C ATOM 303 O ARG A 317 -3.086 13.157 8.820 1.00 13.75 O ATOM 304 CB ARG A 317 0.088 14.253 9.124 1.00 12.10 C ATOM 305 CG ARG A 317 1.598 14.223 8.905 1.00 16.16 C ATOM 306 CD ARG A 317 2.339 15.468 9.438 1.00 14.15 C ATOM 307 NE ARG A 317 2.069 16.641 8.596 1.00 8.32 N ATOM 308 CZ ARG A 317 2.801 17.009 7.552 1.00 15.66 C ATOM 309 NH1 ARG A 317 3.920 16.357 7.252 1.00 10.23 N ATOM 310 NH2 ARG A 317 2.433 18.045 6.811 1.00 10.42 N ATOM 311 HE ARG A 317 1.243 17.226 8.836 1.00 0.00 H ATOM 312 HH12 ARG A 317 4.489 16.650 6.432 1.00 0.00 H ATOM 313 HH11 ARG A 317 4.226 15.553 7.837 1.00 0.00 H ATOM 314 HH22 ARG A 317 3.009 18.330 5.994 1.00 0.00 H ATOM 315 HH21 ARG A 317 1.568 18.572 7.047 1.00 0.00 H ATOM 316 H ARG A 317 -1.458 13.943 6.828 1.00 0.00 H ATOM 317 N ALA A 318 -1.989 12.402 10.650 1.00 12.03 N ATOM 318 CA ALA A 318 -3.179 12.349 11.511 1.00 10.70 C ATOM 319 C ALA A 318 -3.564 13.788 11.918 1.00 13.51 C ATOM 320 O ALA A 318 -2.820 14.722 11.655 1.00 11.81 O ATOM 321 CB ALA A 318 -2.894 11.534 12.752 1.00 11.37 C ATOM 322 H ALA A 318 -1.079 12.079 11.037 1.00 0.00 H ATOM 323 N SER A 319 -4.697 13.947 12.601 1.00 10.97 N ATOM 324 CA SER A 319 -5.220 15.231 13.077 1.00 10.45 C ATOM 325 C SER A 319 -4.538 15.688 14.371 1.00 14.20 C ATOM 326 O SER A 319 -4.587 16.869 14.698 1.00 15.24 O ATOM 327 CB SER A 319 -6.716 15.102 13.343 1.00 11.99 C ATOM 328 OG SER A 319 -6.970 13.984 14.180 1.00 14.48 O ATOM 329 HG SER A 319 -6.496 14.103 15.041 1.00 0.00 H ATOM 330 H SER A 319 -5.253 13.094 12.813 1.00 0.00 H ATOM 331 N HIS A 320 -3.967 14.762 15.128 1.00 9.26 N ATOM 332 CA HIS A 320 -3.333 15.072 16.416 1.00 9.79 C ATOM 333 C HIS A 320 -1.902 14.591 16.430 1.00 13.52 C ATOM 334 O HIS A 320 -1.616 13.511 15.910 1.00 13.34 O ATOM 335 CB HIS A 320 -4.084 14.381 17.590 1.00 10.31 C ATOM 336 CG HIS A 320 -5.524 14.780 17.769 1.00 13.14 C ATOM 337 ND1 HIS A 320 -6.430 14.702 16.737 1.00 14.77 N ATOM 338 CD2 HIS A 320 -6.172 15.191 18.882 1.00 14.94 C ATOM 339 CE1 HIS A 320 -7.595 15.097 17.234 1.00 14.17 C ATOM 340 NE2 HIS A 320 -7.491 15.394 18.524 1.00 14.64 N ATOM 341 H HIS A 320 -3.968 13.776 14.797 1.00 0.00 H ATOM 342 N GLY A 321 -1.038 15.366 17.071 1.00 9.77 N ATOM 343 CA GLY A 321 0.368 15.031 17.235 1.00 9.69 C ATOM 344 C GLY A 321 0.768 14.919 18.691 1.00 14.34 C ATOM 345 O GLY A 321 -0.011 15.260 19.583 1.00 14.13 O ATOM 346 H GLY A 321 -1.383 16.259 17.477 1.00 0.00 H ATOM 347 N VAL A 322 1.986 14.410 18.943 1.00 11.87 N ATOM 348 CA VAL A 322 2.520 14.203 20.291 1.00 11.24 C ATOM 349 C VAL A 322 3.858 14.903 20.474 1.00 14.30 C ATOM 350 O VAL A 322 4.665 14.950 19.542 1.00 12.98 O ATOM 351 CB VAL A 322 2.573 12.691 20.691 1.00 14.92 C ATOM 352 CG1 VAL A 322 1.163 12.120 20.821 1.00 14.51 C ATOM 353 CG2 VAL A 322 3.422 11.862 19.714 1.00 13.49 C ATOM 354 H VAL A 322 2.584 14.148 18.134 1.00 0.00 H ATOM 355 N ARG A 323 4.110 15.395 21.694 1.00 11.77 N ATOM 356 CA ARG A 323 5.330 16.120 22.050 1.00 11.79 C ATOM 357 C ARG A 323 6.143 15.424 23.186 1.00 15.10 C ATOM 358 O ARG A 323 7.364 15.515 23.204 1.00 13.89 O ATOM 359 CB ARG A 323 4.942 17.543 22.457 1.00 13.70 C ATOM 360 CG ARG A 323 6.075 18.553 22.394 1.00 18.25 C ATOM 361 CD ARG A 323 5.535 19.957 22.624 1.00 20.86 C ATOM 362 NE ARG A 323 5.026 20.156 23.987 1.00 22.52 N ATOM 363 CZ ARG A 323 5.767 20.587 25.002 1.00 31.25 C ATOM 364 NH1 ARG A 323 7.056 20.854 24.826 1.00 16.31 N ATOM 365 NH2 ARG A 323 5.231 20.735 26.205 1.00 15.59 N ATOM 366 HE ARG A 323 4.024 19.947 24.169 1.00 0.00 H ATOM 367 HH12 ARG A 323 7.631 21.191 25.624 1.00 0.00 H ATOM 368 HH11 ARG A 323 7.490 20.726 23.890 1.00 0.00 H ATOM 369 HH22 ARG A 323 5.815 21.073 26.997 1.00 0.00 H ATOM 370 HH21 ARG A 323 4.226 20.513 26.358 1.00 0.00 H ATOM 371 H ARG A 323 3.394 15.253 22.435 1.00 0.00 H ATOM 372 N LYS A 324 5.458 14.775 24.132 1.00 12.73 N ATOM 373 CA LYS A 324 6.086 14.077 25.259 1.00 13.21 C ATOM 374 C LYS A 324 5.371 12.744 25.541 1.00 16.51 C ATOM 375 O LYS A 324 4.177 12.601 25.225 1.00 16.39 O ATOM 376 CB LYS A 324 6.057 14.956 26.530 1.00 15.80 C ATOM 377 H LYS A 324 4.420 14.764 24.065 1.00 0.00 H ATOM 378 N GLY A 325 6.085 11.826 26.202 1.00 11.22 N ATOM 379 CA GLY A 325 5.537 10.536 26.611 1.00 10.45 C ATOM 380 C GLY A 325 5.674 9.463 25.550 1.00 14.73 C ATOM 381 O GLY A 325 6.320 9.669 24.513 1.00 14.03 O ATOM 382 H GLY A 325 7.075 12.041 26.435 1.00 0.00 H ATOM 383 N ALA A 326 5.107 8.293 25.835 1.00 12.98 N ATOM 384 CA ALA A 326 5.149 7.115 24.949 1.00 12.72 C ATOM 385 C ALA A 326 3.770 6.942 24.312 1.00 15.22 C ATOM 386 O ALA A 326 2.755 6.984 25.013 1.00 14.84 O ATOM 387 CB ALA A 326 5.562 5.875 25.739 1.00 12.75 C ATOM 388 H ALA A 326 4.602 8.204 26.740 1.00 0.00 H ATOM 389 N TRP A 327 3.727 6.851 22.982 1.00 11.71 N ATOM 390 CA TRP A 327 2.465 6.791 22.216 1.00 11.76 C ATOM 391 C TRP A 327 2.424 5.647 21.209 1.00 14.65 C ATOM 392 O TRP A 327 3.469 5.227 20.720 1.00 14.39 O ATOM 393 CB TRP A 327 2.188 8.159 21.542 1.00 11.08 C ATOM 394 CG TRP A 327 2.031 9.242 22.568 1.00 12.63 C ATOM 395 CD1 TRP A 327 3.024 9.975 23.152 1.00 15.51 C ATOM 396 CD2 TRP A 327 0.817 9.594 23.246 1.00 12.91 C ATOM 397 NE1 TRP A 327 2.499 10.785 24.135 1.00 15.38 N ATOM 398 CE2 TRP A 327 1.143 10.577 24.208 1.00 16.86 C ATOM 399 CE3 TRP A 327 -0.526 9.213 23.092 1.00 14.19 C ATOM 400 CZ2 TRP A 327 0.184 11.153 25.040 1.00 15.80 C ATOM 401 CZ3 TRP A 327 -1.483 9.806 23.900 1.00 15.61 C ATOM 402 CH2 TRP A 327 -1.128 10.771 24.851 1.00 16.33 C ATOM 403 HE1 TRP A 327 3.041 11.447 24.726 1.00 0.00 H ATOM 404 H TRP A 327 4.625 6.821 22.459 1.00 0.00 H ATOM 405 N TYR A 328 1.219 5.151 20.897 1.00 10.93 N ATOM 406 CA TYR A 328 1.049 4.020 19.983 1.00 10.09 C ATOM 407 C TYR A 328 -0.162 4.109 19.053 1.00 13.17 C ATOM 408 O TYR A 328 -1.194 4.658 19.422 1.00 12.43 O ATOM 409 CB TYR A 328 0.954 2.733 20.820 1.00 10.85 C ATOM 410 CG TYR A 328 1.243 1.458 20.061 1.00 12.32 C ATOM 411 CD1 TYR A 328 2.548 1.021 19.869 1.00 14.05 C ATOM 412 CD2 TYR A 328 0.213 0.644 19.613 1.00 13.03 C ATOM 413 CE1 TYR A 328 2.821 -0.149 19.174 1.00 13.82 C ATOM 414 CE2 TYR A 328 0.474 -0.536 18.924 1.00 13.92 C ATOM 415 CZ TYR A 328 1.779 -0.937 18.725 1.00 18.97 C ATOM 416 OH TYR A 328 2.043 -2.126 18.105 1.00 19.90 O ATOM 417 HH TYR A 328 1.654 -2.116 17.195 1.00 0.00 H ATOM 418 H TYR A 328 0.374 5.585 21.319 1.00 0.00 H ATOM 419 N PHE A 329 -0.040 3.512 17.848 1.00 10.69 N ATOM 420 CA PHE A 329 -1.139 3.367 16.884 1.00 9.21 C ATOM 421 C PHE A 329 -0.839 2.181 15.986 1.00 11.18 C ATOM 422 O PHE A 329 0.319 1.777 15.878 1.00 8.84 O ATOM 423 CB PHE A 329 -1.403 4.655 16.052 1.00 9.87 C ATOM 424 CG PHE A 329 -0.317 5.032 15.064 1.00 9.46 C ATOM 425 CD1 PHE A 329 -0.377 4.603 13.740 1.00 11.04 C ATOM 426 CD2 PHE A 329 0.769 5.810 15.458 1.00 9.40 C ATOM 427 CE1 PHE A 329 0.617 4.977 12.823 1.00 12.15 C ATOM 428 CE2 PHE A 329 1.754 6.190 14.539 1.00 10.80 C ATOM 429 CZ PHE A 329 1.680 5.761 13.229 1.00 9.36 C ATOM 430 H PHE A 329 0.891 3.131 17.586 1.00 0.00 H ATOM 431 N GLU A 330 -1.879 1.624 15.351 1.00 8.33 N ATOM 432 CA GLU A 330 -1.739 0.506 14.420 1.00 8.65 C ATOM 433 C GLU A 330 -2.164 0.895 13.017 1.00 14.83 C ATOM 434 O GLU A 330 -3.038 1.753 12.845 1.00 15.69 O ATOM 435 CB GLU A 330 -2.601 -0.689 14.859 1.00 9.56 C ATOM 436 CG GLU A 330 -1.963 -1.559 15.925 1.00 15.74 C ATOM 437 CD GLU A 330 -2.794 -2.738 16.376 1.00 16.64 C ATOM 438 OE1 GLU A 330 -4.034 -2.694 16.208 1.00 12.01 O ATOM 439 OE2 GLU A 330 -2.222 -3.652 17.009 1.00 18.66 O ATOM 440 H GLU A 330 -2.830 2.005 15.529 1.00 0.00 H ATOM 441 N ILE A 331 -1.583 0.223 12.015 1.00 11.91 N ATOM 442 CA ILE A 331 -1.980 0.355 10.614 1.00 11.32 C ATOM 443 C ILE A 331 -2.209 -1.054 10.038 1.00 16.08 C ATOM 444 O ILE A 331 -1.364 -1.928 10.183 1.00 14.04 O ATOM 445 CB ILE A 331 -1.020 1.242 9.739 1.00 13.98 C ATOM 446 CG1 ILE A 331 -1.126 2.757 10.110 1.00 12.36 C ATOM 447 CG2 ILE A 331 -1.283 1.043 8.220 1.00 14.73 C ATOM 448 CD1 ILE A 331 0.126 3.594 9.702 1.00 16.26 C ATOM 449 H ILE A 331 -0.806 -0.429 12.246 1.00 0.00 H ATOM 450 N THR A 332 -3.356 -1.264 9.385 1.00 14.43 N ATOM 451 CA THR A 332 -3.648 -2.526 8.733 1.00 13.89 C ATOM 452 C THR A 332 -3.513 -2.350 7.225 1.00 16.90 C ATOM 453 O THR A 332 -4.135 -1.451 6.678 1.00 15.70 O ATOM 454 CB THR A 332 -5.007 -3.068 9.217 1.00 20.75 C ATOM 455 OG1 THR A 332 -4.905 -3.319 10.623 1.00 17.03 O ATOM 456 CG2 THR A 332 -5.440 -4.341 8.484 1.00 18.37 C ATOM 457 HG1 THR A 332 -4.685 -2.476 11.092 1.00 0.00 H ATOM 458 H THR A 332 -4.060 -0.500 9.343 1.00 0.00 H ATOM 459 N VAL A 333 -2.711 -3.215 6.553 1.00 14.68 N ATOM 460 CA VAL A 333 -2.556 -3.193 5.087 1.00 13.72 C ATOM 461 C VAL A 333 -3.736 -4.019 4.543 1.00 16.77 C ATOM 462 O VAL A 333 -3.704 -5.256 4.578 1.00 16.68 O ATOM 463 CB VAL A 333 -1.170 -3.720 4.594 1.00 16.09 C ATOM 464 CG1 VAL A 333 -1.088 -3.717 3.069 1.00 14.82 C ATOM 465 CG2 VAL A 333 -0.030 -2.903 5.183 1.00 15.87 C ATOM 466 H VAL A 333 -2.182 -3.926 7.097 1.00 0.00 H ATOM 467 N ASP A 334 -4.800 -3.333 4.104 1.00 13.43 N ATOM 468 CA ASP A 334 -6.017 -4.005 3.614 1.00 13.33 C ATOM 469 C ASP A 334 -5.798 -4.640 2.241 1.00 18.12 C ATOM 470 O ASP A 334 -6.274 -5.751 1.981 1.00 18.10 O ATOM 471 CB ASP A 334 -7.200 -3.028 3.585 1.00 14.19 C ATOM 472 CG ASP A 334 -7.404 -2.267 4.886 1.00 20.57 C ATOM 473 OD1 ASP A 334 -7.343 -2.904 5.969 1.00 20.99 O ATOM 474 OD2 ASP A 334 -7.619 -1.041 4.822 1.00 20.09 O ATOM 475 H ASP A 334 -4.766 -2.294 4.109 1.00 0.00 H ATOM 476 N GLU A 335 -5.060 -3.934 1.372 1.00 14.61 N ATOM 477 CA GLU A 335 -4.749 -4.410 0.036 1.00 14.41 C ATOM 478 C GLU A 335 -3.434 -3.813 -0.441 1.00 18.25 C ATOM 479 O GLU A 335 -3.216 -2.608 -0.343 1.00 18.02 O ATOM 480 CB GLU A 335 -5.883 -4.084 -0.941 1.00 15.55 C ATOM 481 CG GLU A 335 -5.898 -4.978 -2.169 1.00 26.92 C ATOM 482 CD GLU A 335 -7.102 -4.714 -3.050 1.00 50.08 C ATOM 483 OE1 GLU A 335 -7.092 -3.692 -3.773 1.00 32.38 O ATOM 484 OE2 GLU A 335 -8.081 -5.491 -2.973 1.00 52.21 O ATOM 485 H GLU A 335 -4.695 -3.006 1.668 1.00 0.00 H ATOM 486 N MET A 336 -2.571 -4.670 -0.977 1.00 13.47 N ATOM 487 CA MET A 336 -1.300 -4.259 -1.501 1.00 13.21 C ATOM 488 C MET A 336 -1.099 -5.003 -2.809 1.00 19.73 C ATOM 489 O MET A 336 -0.426 -6.031 -2.833 1.00 18.78 O ATOM 490 CB MET A 336 -0.160 -4.468 -0.482 1.00 14.74 C ATOM 491 CG MET A 336 1.111 -3.758 -0.876 1.00 17.15 C ATOM 492 SD MET A 336 2.205 -3.434 0.515 1.00 19.90 S ATOM 493 CE MET A 336 1.573 -1.896 1.059 1.00 16.07 C ATOM 494 H MET A 336 -2.827 -5.677 -1.018 1.00 0.00 H ATOM 495 N PRO A 337 -1.707 -4.488 -3.913 1.00 18.84 N ATOM 496 CA PRO A 337 -1.566 -5.146 -5.225 1.00 19.30 C ATOM 497 C PRO A 337 -0.116 -5.107 -5.730 1.00 26.05 C ATOM 498 O PRO A 337 0.692 -4.396 -5.122 1.00 25.72 O ATOM 499 CB PRO A 337 -2.486 -4.309 -6.129 1.00 20.96 C ATOM 500 CG PRO A 337 -3.450 -3.624 -5.181 1.00 25.12 C ATOM 501 CD PRO A 337 -2.559 -3.287 -4.023 1.00 20.26 C ATOM 502 N PRO A 338 0.268 -5.866 -6.797 1.00 23.93 N ATOM 503 CA PRO A 338 1.678 -5.833 -7.244 1.00 23.70 C ATOM 504 C PRO A 338 2.134 -4.430 -7.641 1.00 24.59 C ATOM 505 O PRO A 338 1.327 -3.631 -8.139 1.00 23.78 O ATOM 506 CB PRO A 338 1.708 -6.800 -8.439 1.00 25.70 C ATOM 507 CG PRO A 338 0.497 -7.690 -8.241 1.00 30.59 C ATOM 508 CD PRO A 338 -0.537 -6.789 -7.634 1.00 26.06 C ATOM 509 N ASP A 339 3.415 -4.123 -7.347 1.00 19.00 N ATOM 510 CA ASP A 339 4.101 -2.849 -7.623 1.00 18.73 C ATOM 511 C ASP A 339 3.780 -1.724 -6.634 1.00 21.23 C ATOM 512 O ASP A 339 4.490 -0.721 -6.633 1.00 23.74 O ATOM 513 CB ASP A 339 3.946 -2.368 -9.090 1.00 21.14 C ATOM 514 CG ASP A 339 4.377 -3.351 -10.165 1.00 36.23 C ATOM 515 OD1 ASP A 339 5.326 -4.132 -9.918 1.00 37.27 O ATOM 516 OD2 ASP A 339 3.805 -3.299 -11.277 1.00 46.17 O ATOM 517 H ASP A 339 3.976 -4.862 -6.877 1.00 0.00 H ATOM 518 N THR A 340 2.756 -1.890 -5.785 1.00 13.54 N ATOM 519 CA THR A 340 2.403 -0.897 -4.772 1.00 13.29 C ATOM 520 C THR A 340 3.277 -1.064 -3.523 1.00 15.91 C ATOM 521 O THR A 340 3.843 -2.132 -3.294 1.00 15.72 O ATOM 522 CB THR A 340 0.883 -0.871 -4.455 1.00 18.76 C ATOM 523 OG1 THR A 340 0.540 -1.964 -3.614 1.00 14.62 O ATOM 524 CG2 THR A 340 -0.019 -0.813 -5.717 1.00 16.45 C ATOM 525 HG1 THR A 340 0.762 -2.813 -4.071 1.00 0.00 H ATOM 526 H THR A 340 2.190 -2.760 -5.850 1.00 0.00 H ATOM 527 N ALA A 341 3.369 -0.009 -2.716 1.00 11.45 N ATOM 528 CA ALA A 341 4.176 0.023 -1.507 1.00 11.10 C ATOM 529 C ALA A 341 3.739 1.136 -0.563 1.00 13.03 C ATOM 530 O ALA A 341 3.132 2.131 -0.984 1.00 10.94 O ATOM 531 CB ALA A 341 5.661 0.204 -1.865 1.00 11.63 C ATOM 532 H ALA A 341 2.830 0.845 -2.966 1.00 0.00 H ATOM 533 N ALA A 342 4.126 0.987 0.707 1.00 8.37 N ATOM 534 CA ALA A 342 3.838 1.954 1.757 1.00 8.18 C ATOM 535 C ALA A 342 5.107 2.277 2.553 1.00 11.35 C ATOM 536 O ALA A 342 5.990 1.440 2.666 1.00 10.34 O ATOM 537 CB ALA A 342 2.783 1.377 2.696 1.00 8.71 C ATOM 538 H ALA A 342 4.663 0.133 0.960 1.00 0.00 H ATOM 539 N ARG A 343 5.196 3.503 3.086 1.00 9.24 N ATOM 540 CA ARG A 343 6.255 3.928 4.009 1.00 8.69 C ATOM 541 C ARG A 343 5.469 4.600 5.099 1.00 11.40 C ATOM 542 O ARG A 343 4.839 5.628 4.882 1.00 11.77 O ATOM 543 CB ARG A 343 7.345 4.818 3.370 1.00 8.15 C ATOM 544 CG ARG A 343 8.142 4.088 2.293 1.00 15.83 C ATOM 545 CD ARG A 343 9.314 4.878 1.745 1.00 16.04 C ATOM 546 NE ARG A 343 9.878 4.242 0.552 1.00 9.06 N ATOM 547 CZ ARG A 343 10.956 4.676 -0.089 1.00 20.03 C ATOM 548 NH1 ARG A 343 11.637 5.715 0.371 1.00 8.53 N ATOM 549 NH2 ARG A 343 11.383 4.050 -1.175 1.00 9.96 N ATOM 550 HE ARG A 343 9.402 3.394 0.183 1.00 0.00 H ATOM 551 HH12 ARG A 343 12.481 6.050 -0.137 1.00 0.00 H ATOM 552 HH11 ARG A 343 11.328 6.196 1.240 1.00 0.00 H ATOM 553 HH22 ARG A 343 12.228 4.393 -1.675 1.00 0.00 H ATOM 554 HH21 ARG A 343 10.873 3.215 -1.528 1.00 0.00 H ATOM 555 H ARG A 343 4.467 4.199 2.829 1.00 0.00 H ATOM 556 N LEU A 344 5.426 3.938 6.246 1.00 8.29 N ATOM 557 CA LEU A 344 4.604 4.271 7.400 1.00 7.82 C ATOM 558 C LEU A 344 5.415 4.695 8.616 1.00 11.86 C ATOM 559 O LEU A 344 6.539 4.231 8.811 1.00 11.92 O ATOM 560 CB LEU A 344 3.752 3.012 7.714 1.00 7.18 C ATOM 561 CG LEU A 344 2.943 2.424 6.520 1.00 11.45 C ATOM 562 CD1 LEU A 344 2.272 1.101 6.905 1.00 10.81 C ATOM 563 CD2 LEU A 344 1.877 3.438 5.995 1.00 12.86 C ATOM 564 H LEU A 344 6.038 3.101 6.330 1.00 0.00 H ATOM 565 N GLY A 345 4.848 5.573 9.435 1.00 7.25 N ATOM 566 CA GLY A 345 5.579 6.024 10.608 1.00 6.70 C ATOM 567 C GLY A 345 5.112 7.310 11.241 1.00 11.08 C ATOM 568 O GLY A 345 3.935 7.461 11.550 1.00 11.13 O ATOM 569 H GLY A 345 3.892 5.934 9.240 1.00 0.00 H ATOM 570 N TRP A 346 6.062 8.215 11.482 1.00 10.69 N ATOM 571 CA TRP A 346 5.849 9.469 12.192 1.00 11.33 C ATOM 572 C TRP A 346 6.480 10.635 11.446 1.00 15.97 C ATOM 573 O TRP A 346 7.602 10.527 10.939 1.00 13.24 O ATOM 574 CB TRP A 346 6.462 9.405 13.605 1.00 9.54 C ATOM 575 CG TRP A 346 5.964 8.295 14.487 1.00 10.03 C ATOM 576 CD1 TRP A 346 6.535 7.067 14.651 1.00 12.84 C ATOM 577 CD2 TRP A 346 4.871 8.359 15.424 1.00 9.21 C ATOM 578 NE1 TRP A 346 5.826 6.333 15.576 1.00 12.12 N ATOM 579 CE2 TRP A 346 4.809 7.107 16.080 1.00 12.96 C ATOM 580 CE3 TRP A 346 3.961 9.368 15.797 1.00 10.25 C ATOM 581 CZ2 TRP A 346 3.886 6.839 17.103 1.00 12.24 C ATOM 582 CZ3 TRP A 346 3.002 9.085 16.768 1.00 12.21 C ATOM 583 CH2 TRP A 346 2.972 7.835 17.414 1.00 12.99 C ATOM 584 HE1 TRP A 346 6.028 5.350 15.849 1.00 0.00 H ATOM 585 H TRP A 346 7.022 8.011 11.139 1.00 0.00 H ATOM 586 N SER A 347 5.761 11.764 11.421 1.00 13.22 N ATOM 587 CA SER A 347 6.238 12.975 10.775 1.00 12.92 C ATOM 588 C SER A 347 5.975 14.216 11.595 1.00 17.04 C ATOM 589 O SER A 347 4.876 14.386 12.148 1.00 15.19 O ATOM 590 CB SER A 347 5.569 13.160 9.414 1.00 13.59 C ATOM 591 OG SER A 347 6.014 14.370 8.823 1.00 14.14 O ATOM 592 HG SER A 347 5.777 15.130 9.412 1.00 0.00 H ATOM 593 H SER A 347 4.828 11.775 11.880 1.00 0.00 H ATOM 594 N GLN A 348 6.954 15.145 11.564 1.00 13.25 N ATOM 595 CA GLN A 348 6.793 16.469 12.155 1.00 13.37 C ATOM 596 C GLN A 348 5.892 17.310 11.215 1.00 16.62 C ATOM 597 O GLN A 348 5.759 16.940 10.045 1.00 14.38 O ATOM 598 CB GLN A 348 8.136 17.165 12.311 1.00 14.44 C ATOM 599 CG GLN A 348 9.020 16.551 13.373 1.00 21.56 C ATOM 600 CD GLN A 348 10.012 17.532 13.922 1.00 28.55 C ATOM 601 OE1 GLN A 348 10.104 18.677 13.480 1.00 22.31 O ATOM 602 NE2 GLN A 348 10.661 17.149 14.997 1.00 27.45 N ATOM 603 HE22 GLN A 348 10.562 16.174 15.345 1.00 0.00 H ATOM 604 HE21 GLN A 348 11.275 17.821 15.501 1.00 0.00 H ATOM 605 H GLN A 348 7.855 14.908 11.102 1.00 0.00 H ATOM 606 N PRO A 349 5.291 18.443 11.667 1.00 14.81 N ATOM 607 CA PRO A 349 4.439 19.243 10.754 1.00 15.14 C ATOM 608 C PRO A 349 5.089 19.692 9.424 1.00 19.16 C ATOM 609 O PRO A 349 4.383 19.890 8.436 1.00 17.07 O ATOM 610 CB PRO A 349 4.043 20.450 11.618 1.00 16.67 C ATOM 611 CG PRO A 349 4.125 19.952 13.013 1.00 20.93 C ATOM 612 CD PRO A 349 5.298 19.025 13.031 1.00 16.67 C ATOM 613 N LEU A 350 6.425 19.821 9.379 1.00 17.47 N ATOM 614 CA LEU A 350 7.102 20.272 8.153 1.00 17.57 C ATOM 615 C LEU A 350 7.406 19.195 7.122 1.00 18.31 C ATOM 616 O LEU A 350 7.973 19.510 6.076 1.00 16.19 O ATOM 617 CB LEU A 350 8.358 21.123 8.466 1.00 17.88 C ATOM 618 CG LEU A 350 8.100 22.516 9.032 1.00 22.83 C ATOM 619 CD1 LEU A 350 9.361 23.073 9.689 1.00 22.44 C ATOM 620 CD2 LEU A 350 7.584 23.468 7.951 1.00 27.16 C ATOM 621 H LEU A 350 6.990 19.599 10.224 1.00 0.00 H ATOM 622 N GLY A 351 7.080 17.937 7.440 1.00 14.57 N ATOM 623 CA GLY A 351 7.286 16.818 6.529 1.00 13.59 C ATOM 624 C GLY A 351 6.567 17.036 5.211 1.00 16.09 C ATOM 625 O GLY A 351 5.377 17.370 5.202 1.00 13.45 O ATOM 626 H GLY A 351 6.663 17.750 8.374 1.00 0.00 H ATOM 627 N ASN A 352 7.317 16.934 4.095 1.00 13.28 N ATOM 628 CA ASN A 352 6.824 17.143 2.724 1.00 12.23 C ATOM 629 C ASN A 352 5.692 16.142 2.390 1.00 15.45 C ATOM 630 O ASN A 352 5.895 14.914 2.439 1.00 14.24 O ATOM 631 CB ASN A 352 8.002 17.007 1.719 1.00 10.24 C ATOM 632 CG ASN A 352 7.729 17.457 0.300 1.00 23.88 C ATOM 633 OD1 ASN A 352 6.597 17.515 -0.169 1.00 13.08 O ATOM 634 ND2 ASN A 352 8.776 17.756 -0.440 1.00 21.85 N ATOM 635 HD22 ASN A 352 9.732 17.704 -0.034 1.00 0.00 H ATOM 636 HD21 ASN A 352 8.647 18.044 -1.431 1.00 0.00 H ATOM 637 H ASN A 352 8.321 16.689 4.212 1.00 0.00 H ATOM 638 N LEU A 353 4.501 16.674 2.063 1.00 12.63 N ATOM 639 CA LEU A 353 3.332 15.855 1.719 1.00 11.80 C ATOM 640 C LEU A 353 3.428 15.247 0.324 1.00 15.44 C ATOM 641 O LEU A 353 2.757 14.253 0.054 1.00 16.10 O ATOM 642 CB LEU A 353 2.016 16.630 1.906 1.00 11.28 C ATOM 643 CG LEU A 353 1.642 17.028 3.355 1.00 13.02 C ATOM 644 CD1 LEU A 353 0.532 18.037 3.353 1.00 9.59 C ATOM 645 CD2 LEU A 353 1.270 15.807 4.224 1.00 13.57 C ATOM 646 H LEU A 353 4.404 17.709 2.053 1.00 0.00 H ATOM 647 N GLN A 354 4.294 15.817 -0.543 1.00 11.92 N ATOM 648 CA GLN A 354 4.549 15.391 -1.918 1.00 10.95 C ATOM 649 C GLN A 354 5.881 14.640 -2.038 1.00 15.48 C ATOM 650 O GLN A 354 6.693 14.901 -2.932 1.00 15.40 O ATOM 651 CB GLN A 354 4.485 16.607 -2.881 1.00 12.04 C ATOM 652 CG GLN A 354 3.093 17.277 -2.936 1.00 11.86 C ATOM 653 CD GLN A 354 2.030 16.423 -3.596 1.00 19.80 C ATOM 654 OE1 GLN A 354 2.311 15.400 -4.231 1.00 15.21 O ATOM 655 NE2 GLN A 354 0.776 16.859 -3.520 1.00 14.70 N ATOM 656 HE22 GLN A 354 0.557 17.721 -2.982 1.00 0.00 H ATOM 657 HE21 GLN A 354 0.014 16.338 -3.999 1.00 0.00 H ATOM 658 H GLN A 354 4.831 16.638 -0.199 1.00 0.00 H ATOM 659 N ALA A 355 6.103 13.698 -1.122 1.00 11.04 N ATOM 660 CA ALA A 355 7.316 12.901 -1.061 1.00 10.46 C ATOM 661 C ALA A 355 7.030 11.701 -0.172 1.00 14.52 C ATOM 662 O ALA A 355 6.060 11.758 0.598 1.00 14.42 O ATOM 663 CB ALA A 355 8.450 13.736 -0.466 1.00 11.23 C ATOM 664 H ALA A 355 5.365 13.523 -0.410 1.00 0.00 H ATOM 665 N PRO A 356 7.803 10.588 -0.256 1.00 11.00 N ATOM 666 CA PRO A 356 7.538 9.465 0.666 1.00 11.12 C ATOM 667 C PRO A 356 7.848 9.864 2.099 1.00 14.46 C ATOM 668 O PRO A 356 8.523 10.873 2.327 1.00 14.96 O ATOM 669 CB PRO A 356 8.505 8.373 0.192 1.00 12.78 C ATOM 670 CG PRO A 356 9.593 9.088 -0.528 1.00 16.25 C ATOM 671 CD PRO A 356 8.983 10.324 -1.106 1.00 11.49 C ATOM 672 N LEU A 357 7.366 9.086 3.064 1.00 11.38 N ATOM 673 CA LEU A 357 7.690 9.347 4.464 1.00 10.07 C ATOM 674 C LEU A 357 9.145 8.938 4.625 1.00 9.41 C ATOM 675 O LEU A 357 9.575 7.985 3.983 1.00 8.49 O ATOM 676 CB LEU A 357 6.753 8.572 5.409 1.00 10.00 C ATOM 677 CG LEU A 357 6.826 8.988 6.902 1.00 14.69 C ATOM 678 CD1 LEU A 357 6.102 10.303 7.132 1.00 15.41 C ATOM 679 CD2 LEU A 357 6.144 7.976 7.774 1.00 11.31 C ATOM 680 H LEU A 357 6.752 8.283 2.819 1.00 0.00 H ATOM 681 N GLY A 358 9.904 9.702 5.392 1.00 7.21 N ATOM 682 CA GLY A 358 11.341 9.469 5.573 1.00 8.48 C ATOM 683 C GLY A 358 12.203 10.239 4.583 1.00 11.58 C ATOM 684 O GLY A 358 13.431 10.155 4.624 1.00 10.97 O ATOM 685 H GLY A 358 9.463 10.503 5.888 1.00 0.00 H ATOM 686 N TYR A 359 11.569 11.011 3.694 1.00 10.13 N ATOM 687 CA TYR A 359 12.247 11.808 2.656 1.00 10.96 C ATOM 688 C TYR A 359 13.249 12.861 3.179 1.00 14.22 C ATOM 689 O TYR A 359 14.318 13.049 2.588 1.00 13.06 O ATOM 690 CB TYR A 359 11.177 12.492 1.769 1.00 12.31 C ATOM 691 CG TYR A 359 11.669 13.669 0.951 1.00 12.52 C ATOM 692 CD1 TYR A 359 12.404 13.474 -0.216 1.00 13.59 C ATOM 693 CD2 TYR A 359 11.340 14.980 1.305 1.00 12.46 C ATOM 694 CE1 TYR A 359 12.840 14.553 -0.986 1.00 13.34 C ATOM 695 CE2 TYR A 359 11.809 16.069 0.564 1.00 12.63 C ATOM 696 CZ TYR A 359 12.562 15.848 -0.578 1.00 18.25 C ATOM 697 OH TYR A 359 12.990 16.902 -1.346 1.00 18.93 O ATOM 698 HH TYR A 359 13.562 17.497 -0.799 1.00 0.00 H ATOM 699 H TYR A 359 10.531 11.052 3.738 1.00 0.00 H ATOM 700 N ASP A 360 12.848 13.598 4.221 1.00 10.83 N ATOM 701 CA ASP A 360 13.608 14.711 4.788 1.00 11.17 C ATOM 702 C ASP A 360 13.902 14.502 6.290 1.00 14.63 C ATOM 703 O ASP A 360 13.694 13.407 6.801 1.00 13.98 O ATOM 704 CB ASP A 360 12.820 16.023 4.512 1.00 12.71 C ATOM 705 CG ASP A 360 11.363 15.983 4.988 1.00 16.58 C ATOM 706 OD1 ASP A 360 11.075 15.267 5.969 1.00 18.29 O ATOM 707 OD2 ASP A 360 10.520 16.678 4.384 1.00 16.90 O ATOM 708 H ASP A 360 11.934 13.363 4.657 1.00 0.00 H ATOM 709 N LYS A 361 14.420 15.526 6.983 1.00 12.52 N ATOM 710 CA LYS A 361 14.747 15.436 8.416 1.00 12.63 C ATOM 711 C LYS A 361 13.493 15.337 9.312 1.00 14.30 C ATOM 712 O LYS A 361 13.596 14.966 10.479 1.00 13.67 O ATOM 713 CB LYS A 361 15.591 16.650 8.847 1.00 14.03 C ATOM 714 H LYS A 361 14.599 16.423 6.487 1.00 0.00 H ATOM 715 N PHE A 362 12.325 15.677 8.765 1.00 10.89 N ATOM 716 CA PHE A 362 11.076 15.730 9.527 1.00 10.78 C ATOM 717 C PHE A 362 10.375 14.421 9.792 1.00 14.32 C ATOM 718 O PHE A 362 9.486 14.391 10.635 1.00 14.50 O ATOM 719 CB PHE A 362 10.118 16.790 8.951 1.00 12.07 C ATOM 720 CG PHE A 362 10.759 18.149 8.781 1.00 14.40 C ATOM 721 CD1 PHE A 362 11.082 18.632 7.512 1.00 17.60 C ATOM 722 CD2 PHE A 362 11.117 18.913 9.891 1.00 16.82 C ATOM 723 CE1 PHE A 362 11.698 19.876 7.356 1.00 18.25 C ATOM 724 CE2 PHE A 362 11.736 20.160 9.734 1.00 19.25 C ATOM 725 CZ PHE A 362 12.010 20.639 8.466 1.00 17.71 C ATOM 726 H PHE A 362 12.300 15.915 7.753 1.00 0.00 H ATOM 727 N SER A 363 10.760 13.341 9.096 1.00 9.87 N ATOM 728 CA SER A 363 10.054 12.080 9.253 1.00 9.67 C ATOM 729 C SER A 363 10.908 10.856 9.224 1.00 14.23 C ATOM 730 O SER A 363 12.005 10.862 8.661 1.00 15.20 O ATOM 731 CB SER A 363 8.926 11.962 8.226 1.00 10.70 C ATOM 732 OG SER A 363 9.452 11.874 6.914 1.00 12.82 O ATOM 733 HG SER A 363 9.982 12.687 6.717 1.00 0.00 H ATOM 734 H SER A 363 11.566 13.406 8.442 1.00 0.00 H ATOM 735 N TYR A 364 10.355 9.781 9.805 1.00 10.62 N ATOM 736 CA TYR A 364 10.968 8.465 9.952 1.00 10.79 C ATOM 737 C TYR A 364 9.968 7.418 9.499 1.00 13.83 C ATOM 738 O TYR A 364 8.853 7.359 10.029 1.00 13.44 O ATOM 739 CB TYR A 364 11.350 8.227 11.426 1.00 11.64 C ATOM 740 CG TYR A 364 12.313 9.255 11.982 1.00 13.06 C ATOM 741 CD1 TYR A 364 11.850 10.437 12.567 1.00 14.45 C ATOM 742 CD2 TYR A 364 13.683 9.041 11.948 1.00 13.52 C ATOM 743 CE1 TYR A 364 12.733 11.385 13.079 1.00 12.76 C ATOM 744 CE2 TYR A 364 14.571 9.952 12.517 1.00 14.11 C ATOM 745 CZ TYR A 364 14.094 11.127 13.072 1.00 19.99 C ATOM 746 OH TYR A 364 14.992 12.054 13.548 1.00 22.44 O ATOM 747 HH TYR A 364 15.538 11.645 14.265 1.00 0.00 H ATOM 748 H TYR A 364 9.395 9.897 10.188 1.00 0.00 H ATOM 749 N SER A 365 10.352 6.617 8.493 1.00 8.99 N ATOM 750 CA SER A 365 9.464 5.605 7.938 1.00 7.95 C ATOM 751 C SER A 365 9.996 4.174 7.899 1.00 11.09 C ATOM 752 O SER A 365 11.192 3.926 8.044 1.00 10.19 O ATOM 753 CB SER A 365 8.997 6.010 6.548 1.00 8.51 C ATOM 754 OG SER A 365 10.055 5.908 5.616 1.00 9.95 O ATOM 755 HG SER A 365 9.731 6.175 4.720 1.00 0.00 H ATOM 756 H SER A 365 11.309 6.722 8.099 1.00 0.00 H ATOM 757 N TRP A 366 9.059 3.250 7.684 1.00 8.54 N ATOM 758 CA TRP A 366 9.235 1.803 7.573 1.00 8.47 C ATOM 759 C TRP A 366 8.586 1.379 6.268 1.00 10.56 C ATOM 760 O TRP A 366 7.381 1.479 6.144 1.00 10.46 O ATOM 761 CB TRP A 366 8.508 1.110 8.750 1.00 6.34 C ATOM 762 CG TRP A 366 8.796 -0.356 8.889 1.00 6.97 C ATOM 763 CD1 TRP A 366 9.861 -1.050 8.378 1.00 9.46 C ATOM 764 CD2 TRP A 366 8.003 -1.308 9.616 1.00 6.59 C ATOM 765 NE1 TRP A 366 9.771 -2.377 8.729 1.00 9.25 N ATOM 766 CE2 TRP A 366 8.638 -2.563 9.494 1.00 10.92 C ATOM 767 CE3 TRP A 366 6.806 -1.221 10.348 1.00 7.84 C ATOM 768 CZ2 TRP A 366 8.136 -3.717 10.111 1.00 10.37 C ATOM 769 CZ3 TRP A 366 6.342 -2.354 10.995 1.00 9.87 C ATOM 770 CH2 TRP A 366 6.995 -3.587 10.863 1.00 10.42 C ATOM 771 HE1 TRP A 366 10.448 -3.120 8.461 1.00 0.00 H ATOM 772 H TRP A 366 8.085 3.601 7.583 1.00 0.00 H ATOM 773 N ARG A 367 9.371 0.920 5.304 1.00 8.77 N ATOM 774 CA ARG A 367 8.863 0.510 3.992 1.00 8.71 C ATOM 775 C ARG A 367 8.353 -0.942 3.952 1.00 13.71 C ATOM 776 O ARG A 367 9.032 -1.843 4.425 1.00 12.87 O ATOM 777 CB ARG A 367 9.949 0.746 2.909 1.00 6.83 C ATOM 778 CG ARG A 367 9.518 0.362 1.479 1.00 3.78 C ATOM 779 CD ARG A 367 10.568 0.688 0.438 1.00 5.05 C ATOM 780 NE ARG A 367 11.818 -0.058 0.618 1.00 9.57 N ATOM 781 CZ ARG A 367 12.861 0.029 -0.199 1.00 20.60 C ATOM 782 NH1 ARG A 367 12.806 0.803 -1.274 1.00 8.05 N ATOM 783 NH2 ARG A 367 13.961 -0.675 0.042 1.00 9.89 N ATOM 784 HE ARG A 367 11.892 -0.695 1.437 1.00 0.00 H ATOM 785 HH12 ARG A 367 13.626 0.868 -1.911 1.00 0.00 H ATOM 786 HH11 ARG A 367 11.943 1.346 -1.481 1.00 0.00 H ATOM 787 HH22 ARG A 367 14.775 -0.604 -0.601 1.00 0.00 H ATOM 788 HH21 ARG A 367 14.008 -1.298 0.874 1.00 0.00 H ATOM 789 H ARG A 367 10.392 0.848 5.487 1.00 0.00 H ATOM 790 N SER A 368 7.189 -1.160 3.307 1.00 11.95 N ATOM 791 CA SER A 368 6.576 -2.459 3.059 1.00 11.64 C ATOM 792 C SER A 368 7.564 -3.392 2.340 1.00 14.71 C ATOM 793 O SER A 368 7.831 -4.482 2.822 1.00 12.67 O ATOM 794 CB SER A 368 5.321 -2.275 2.213 1.00 15.27 C ATOM 795 OG SER A 368 5.663 -1.593 1.018 1.00 18.64 O ATOM 796 HG SER A 368 6.329 -2.125 0.515 1.00 0.00 H ATOM 797 H SER A 368 6.682 -0.324 2.954 1.00 0.00 H ATOM 798 N LYS A 369 8.116 -2.936 1.209 1.00 14.03 N ATOM 799 CA LYS A 369 9.132 -3.615 0.401 1.00 13.74 C ATOM 800 C LYS A 369 10.432 -3.698 1.227 1.00 17.63 C ATOM 801 O LYS A 369 10.986 -2.660 1.580 1.00 17.47 O ATOM 802 CB LYS A 369 9.367 -2.795 -0.901 1.00 16.40 C ATOM 803 CG LYS A 369 10.319 -3.424 -1.926 1.00 27.91 C ATOM 804 CD LYS A 369 11.171 -2.354 -2.618 1.00 38.33 C ATOM 805 CE LYS A 369 10.900 -2.171 -4.099 1.00 46.71 C ATOM 806 NZ LYS A 369 11.423 -0.858 -4.598 1.00 48.44 N ATOM 807 HZ1 LYS A 369 10.961 -0.083 -4.081 1.00 0.00 H ATOM 808 HZ2 LYS A 369 12.451 -0.814 -4.444 1.00 0.00 H ATOM 809 HZ3 LYS A 369 11.219 -0.769 -5.614 1.00 0.00 H ATOM 810 H LYS A 369 7.791 -2.008 0.870 1.00 0.00 H ATOM 811 N LYS A 370 10.886 -4.934 1.564 1.00 14.30 N ATOM 812 CA LYS A 370 12.137 -5.241 2.296 1.00 13.70 C ATOM 813 C LYS A 370 12.274 -4.816 3.785 1.00 15.74 C ATOM 814 O LYS A 370 13.314 -5.085 4.386 1.00 16.32 O ATOM 815 CB LYS A 370 13.397 -4.856 1.467 1.00 16.02 C ATOM 816 CG LYS A 370 13.506 -5.556 0.094 1.00 17.84 C ATOM 817 CD LYS A 370 14.839 -5.246 -0.623 1.00 25.68 C ATOM 818 CE LYS A 370 14.896 -3.879 -1.254 1.00 38.13 C ATOM 819 NZ LYS A 370 16.262 -3.563 -1.751 1.00 49.33 N ATOM 820 HZ1 LYS A 370 16.933 -3.587 -0.957 1.00 0.00 H ATOM 821 HZ2 LYS A 370 16.542 -4.267 -2.464 1.00 0.00 H ATOM 822 HZ3 LYS A 370 16.263 -2.615 -2.179 1.00 0.00 H ATOM 823 H LYS A 370 10.298 -5.743 1.280 1.00 0.00 H ATOM 824 N GLY A 371 11.245 -4.190 4.363 1.00 12.69 N ATOM 825 CA GLY A 371 11.225 -3.740 5.759 1.00 11.51 C ATOM 826 C GLY A 371 12.258 -2.672 6.076 1.00 14.93 C ATOM 827 O GLY A 371 12.657 -2.500 7.235 1.00 13.06 O ATOM 828 H GLY A 371 10.400 -4.009 3.784 1.00 0.00 H ATOM 829 N THR A 372 12.683 -1.932 5.040 1.00 12.45 N ATOM 830 CA THR A 372 13.711 -0.889 5.125 1.00 13.09 C ATOM 831 C THR A 372 13.254 0.306 5.979 1.00 16.04 C ATOM 832 O THR A 372 12.081 0.693 5.921 1.00 14.98 O ATOM 833 CB THR A 372 14.081 -0.426 3.696 1.00 18.64 C ATOM 834 OG1 THR A 372 14.265 -1.570 2.863 1.00 16.06 O ATOM 835 CG2 THR A 372 15.334 0.443 3.656 1.00 16.68 C ATOM 836 HG1 THR A 372 14.994 -2.130 3.230 1.00 0.00 H ATOM 837 H THR A 372 12.253 -2.111 4.110 1.00 0.00 H ATOM 838 N LYS A 373 14.180 0.875 6.771 1.00 10.47 N ATOM 839 CA LYS A 373 13.868 2.084 7.531 1.00 10.84 C ATOM 840 C LYS A 373 14.402 3.292 6.728 1.00 14.38 C ATOM 841 O LYS A 373 15.495 3.194 6.154 1.00 13.56 O ATOM 842 CB LYS A 373 14.393 2.046 8.988 1.00 11.72 C ATOM 843 CG LYS A 373 15.908 1.913 9.163 1.00 11.97 C ATOM 844 CD LYS A 373 16.279 1.800 10.636 1.00 9.01 C ATOM 845 CE LYS A 373 17.761 1.916 10.805 1.00 11.39 C ATOM 846 NZ LYS A 373 18.165 1.742 12.229 1.00 8.25 N ATOM 847 HZ1 LYS A 373 17.709 2.475 12.809 1.00 0.00 H ATOM 848 HZ2 LYS A 373 17.868 0.802 12.560 1.00 0.00 H ATOM 849 HZ3 LYS A 373 19.198 1.829 12.308 1.00 0.00 H ATOM 850 H LYS A 373 15.127 0.451 6.843 1.00 0.00 H ATOM 851 N PHE A 374 13.613 4.392 6.636 1.00 9.78 N ATOM 852 CA PHE A 374 14.019 5.608 5.894 1.00 8.54 C ATOM 853 C PHE A 374 13.957 6.899 6.718 1.00 12.12 C ATOM 854 O PHE A 374 12.987 7.157 7.448 1.00 9.05 O ATOM 855 CB PHE A 374 13.185 5.800 4.617 1.00 9.47 C ATOM 856 CG PHE A 374 13.530 4.882 3.470 1.00 9.58 C ATOM 857 CD1 PHE A 374 12.899 3.649 3.331 1.00 9.35 C ATOM 858 CD2 PHE A 374 14.442 5.275 2.491 1.00 9.43 C ATOM 859 CE1 PHE A 374 13.198 2.814 2.256 1.00 8.88 C ATOM 860 CE2 PHE A 374 14.754 4.424 1.424 1.00 10.64 C ATOM 861 CZ PHE A 374 14.154 3.192 1.329 1.00 7.54 C ATOM 862 H PHE A 374 12.685 4.381 7.106 1.00 0.00 H ATOM 863 N HIS A 375 15.013 7.711 6.576 1.00 9.82 N ATOM 864 CA HIS A 375 15.161 9.036 7.186 1.00 8.92 C ATOM 865 C HIS A 375 16.103 9.830 6.311 1.00 12.76 C ATOM 866 O HIS A 375 17.174 9.328 5.965 1.00 12.56 O ATOM 867 CB HIS A 375 15.685 8.973 8.632 1.00 8.87 C ATOM 868 CG HIS A 375 15.735 10.317 9.291 1.00 10.81 C ATOM 869 ND1 HIS A 375 14.605 11.111 9.389 1.00 11.69 N ATOM 870 CD2 HIS A 375 16.772 10.957 9.876 1.00 11.23 C ATOM 871 CE1 HIS A 375 14.991 12.198 10.035 1.00 10.53 C ATOM 872 NE2 HIS A 375 16.285 12.158 10.334 1.00 10.70 N ATOM 873 H HIS A 375 15.796 7.372 5.981 1.00 0.00 H ATOM 874 N GLN A 376 15.695 11.055 5.922 1.00 9.42 N ATOM 875 CA GLN A 376 16.472 11.931 5.032 1.00 9.65 C ATOM 876 C GLN A 376 16.823 11.267 3.685 1.00 14.43 C ATOM 877 O GLN A 376 17.875 11.551 3.098 1.00 16.29 O ATOM 878 CB GLN A 376 17.725 12.490 5.748 1.00 10.98 C ATOM 879 CG GLN A 376 17.392 13.680 6.627 1.00 13.60 C ATOM 880 CD GLN A 376 18.608 14.279 7.299 1.00 28.79 C ATOM 881 OE1 GLN A 376 18.886 15.477 7.179 1.00 27.89 O ATOM 882 NE2 GLN A 376 19.336 13.476 8.047 1.00 12.29 N ATOM 883 HE22 GLN A 376 19.081 12.471 8.132 1.00 0.00 H ATOM 884 HE21 GLN A 376 20.166 13.847 8.553 1.00 0.00 H ATOM 885 H GLN A 376 14.778 11.400 6.271 1.00 0.00 H ATOM 886 N SER A 377 15.924 10.373 3.212 1.00 10.37 N ATOM 887 CA SER A 377 15.982 9.627 1.950 1.00 8.64 C ATOM 888 C SER A 377 17.030 8.518 1.934 1.00 14.23 C ATOM 889 O SER A 377 17.374 8.009 0.868 1.00 13.93 O ATOM 890 CB SER A 377 16.141 10.575 0.764 1.00 9.79 C ATOM 891 OG SER A 377 14.992 11.389 0.595 1.00 12.36 O ATOM 892 HG SER A 377 14.848 11.929 1.412 1.00 0.00 H ATOM 893 H SER A 377 15.095 10.194 3.814 1.00 0.00 H ATOM 894 N ILE A 378 17.500 8.124 3.137 1.00 12.63 N ATOM 895 CA ILE A 378 18.489 7.076 3.369 1.00 11.81 C ATOM 896 C ILE A 378 17.785 5.832 3.898 1.00 13.33 C ATOM 897 O ILE A 378 17.250 5.832 5.012 1.00 10.20 O ATOM 898 CB ILE A 378 19.619 7.541 4.344 1.00 14.59 C ATOM 899 CG1 ILE A 378 20.342 8.805 3.817 1.00 15.28 C ATOM 900 CG2 ILE A 378 20.610 6.377 4.656 1.00 13.63 C ATOM 901 CD1 ILE A 378 21.312 8.600 2.525 1.00 16.66 C ATOM 902 H ILE A 378 17.123 8.612 3.975 1.00 0.00 H ATOM 903 N GLY A 379 17.849 4.773 3.109 1.00 10.32 N ATOM 904 CA GLY A 379 17.287 3.488 3.480 1.00 9.66 C ATOM 905 C GLY A 379 18.315 2.639 4.189 1.00 15.03 C ATOM 906 O GLY A 379 19.429 2.484 3.695 1.00 13.39 O ATOM 907 H GLY A 379 18.321 4.865 2.187 1.00 0.00 H ATOM 908 N LYS A 380 17.963 2.097 5.365 1.00 12.75 N ATOM 909 CA LYS A 380 18.894 1.226 6.084 1.00 13.20 C ATOM 910 C LYS A 380 18.193 -0.080 6.413 1.00 16.97 C ATOM 911 O LYS A 380 16.977 -0.065 6.602 1.00 16.45 O ATOM 912 CB LYS A 380 19.402 1.906 7.365 1.00 14.56 C ATOM 913 CG LYS A 380 20.462 2.958 7.109 1.00 21.16 C ATOM 914 CD LYS A 380 20.856 3.722 8.359 1.00 27.02 C ATOM 915 CE LYS A 380 22.111 4.547 8.119 1.00 30.19 C ATOM 916 NZ LYS A 380 22.308 5.579 9.172 1.00 29.05 N ATOM 917 HZ1 LYS A 380 21.492 6.223 9.181 1.00 0.00 H ATOM 918 HZ2 LYS A 380 22.396 5.115 10.099 1.00 0.00 H ATOM 919 HZ3 LYS A 380 23.174 6.118 8.970 1.00 0.00 H ATOM 920 H LYS A 380 17.025 2.297 5.767 1.00 0.00 H ATOM 921 N HIS A 381 18.940 -1.196 6.507 1.00 13.03 N ATOM 922 CA HIS A 381 18.341 -2.475 6.888 1.00 14.31 C ATOM 923 C HIS A 381 17.681 -2.334 8.275 1.00 16.30 C ATOM 924 O HIS A 381 18.217 -1.667 9.168 1.00 16.43 O ATOM 925 CB HIS A 381 19.347 -3.646 6.891 1.00 16.16 C ATOM 926 CG HIS A 381 18.716 -4.941 7.353 1.00 20.87 C ATOM 927 ND1 HIS A 381 18.001 -5.759 6.475 1.00 22.64 N ATOM 928 CD2 HIS A 381 18.616 -5.459 8.606 1.00 22.76 C ATOM 929 CE1 HIS A 381 17.524 -6.747 7.213 1.00 21.97 C ATOM 930 NE2 HIS A 381 17.862 -6.611 8.499 1.00 22.32 N ATOM 931 H HIS A 381 19.959 -1.148 6.306 1.00 0.00 H ATOM 932 N TYR A 382 16.509 -2.935 8.428 1.00 11.99 N ATOM 933 CA TYR A 382 15.781 -2.892 9.685 1.00 11.29 C ATOM 934 C TYR A 382 15.059 -4.220 9.966 1.00 13.94 C ATOM 935 O TYR A 382 15.366 -4.903 10.928 1.00 11.74 O ATOM 936 CB TYR A 382 14.837 -1.669 9.726 1.00 11.28 C ATOM 937 CG TYR A 382 13.950 -1.640 10.947 1.00 12.01 C ATOM 938 CD1 TYR A 382 14.486 -1.449 12.219 1.00 13.70 C ATOM 939 CD2 TYR A 382 12.573 -1.818 10.837 1.00 13.00 C ATOM 940 CE1 TYR A 382 13.682 -1.480 13.355 1.00 12.90 C ATOM 941 CE2 TYR A 382 11.751 -1.817 11.969 1.00 13.73 C ATOM 942 CZ TYR A 382 12.310 -1.627 13.224 1.00 16.25 C ATOM 943 OH TYR A 382 11.521 -1.602 14.350 1.00 14.89 O ATOM 944 HH TYR A 382 12.090 -1.457 15.147 1.00 0.00 H ATOM 945 H TYR A 382 16.099 -3.452 7.625 1.00 0.00 H ATOM 946 N SER A 383 14.104 -4.586 9.136 1.00 12.19 N ATOM 947 CA SER A 383 13.375 -5.822 9.388 1.00 11.66 C ATOM 948 C SER A 383 13.167 -6.527 8.062 1.00 17.72 C ATOM 949 O SER A 383 13.735 -6.105 7.052 1.00 18.18 O ATOM 950 CB SER A 383 12.049 -5.510 10.094 1.00 10.42 C ATOM 951 OG SER A 383 11.089 -4.922 9.231 1.00 14.41 O ATOM 952 HG SER A 383 10.895 -5.542 8.484 1.00 0.00 H ATOM 953 H SER A 383 13.873 -3.999 8.309 1.00 0.00 H ATOM 954 N SER A 384 12.380 -7.596 8.053 1.00 15.86 N ATOM 955 CA SER A 384 12.012 -8.240 6.800 1.00 17.44 C ATOM 956 C SER A 384 10.747 -7.462 6.368 1.00 21.82 C ATOM 957 O SER A 384 10.207 -6.685 7.177 1.00 23.41 O ATOM 958 CB SER A 384 11.743 -9.731 7.003 1.00 21.47 C ATOM 959 OG SER A 384 10.699 -9.936 7.938 1.00 29.00 O ATOM 960 HG SER A 384 10.545 -10.907 8.051 1.00 0.00 H ATOM 961 H SER A 384 12.022 -7.978 8.952 1.00 0.00 H ATOM 962 N GLY A 385 10.321 -7.617 5.115 1.00 15.11 N ATOM 963 CA GLY A 385 9.168 -6.879 4.603 1.00 13.76 C ATOM 964 C GLY A 385 7.822 -7.127 5.254 1.00 16.47 C ATOM 965 O GLY A 385 7.660 -8.018 6.093 1.00 17.21 O ATOM 966 H GLY A 385 10.821 -8.278 4.487 1.00 0.00 H ATOM 967 N TYR A 386 6.842 -6.310 4.881 1.00 12.09 N ATOM 968 CA TYR A 386 5.452 -6.454 5.324 1.00 10.56 C ATOM 969 C TYR A 386 4.549 -6.193 4.120 1.00 12.95 C ATOM 970 O TYR A 386 4.980 -5.542 3.170 1.00 10.64 O ATOM 971 CB TYR A 386 5.088 -5.553 6.549 1.00 10.47 C ATOM 972 CG TYR A 386 5.121 -4.057 6.310 1.00 10.32 C ATOM 973 CD1 TYR A 386 4.047 -3.401 5.700 1.00 11.48 C ATOM 974 CD2 TYR A 386 6.168 -3.277 6.801 1.00 9.88 C ATOM 975 CE1 TYR A 386 4.050 -2.017 5.527 1.00 11.32 C ATOM 976 CE2 TYR A 386 6.183 -1.897 6.631 1.00 9.57 C ATOM 977 CZ TYR A 386 5.127 -1.272 5.986 1.00 16.41 C ATOM 978 OH TYR A 386 5.175 0.079 5.774 1.00 13.57 O ATOM 979 HH TYR A 386 5.965 0.297 5.219 1.00 0.00 H ATOM 980 H TYR A 386 7.074 -5.525 4.239 1.00 0.00 H ATOM 981 N GLY A 387 3.316 -6.673 4.174 1.00 11.17 N ATOM 982 CA GLY A 387 2.401 -6.513 3.059 1.00 11.16 C ATOM 983 C GLY A 387 0.963 -6.739 3.439 1.00 16.40 C ATOM 984 O GLY A 387 0.588 -6.534 4.596 1.00 16.12 O ATOM 985 H GLY A 387 2.998 -7.173 5.029 1.00 0.00 H ATOM 986 N GLN A 388 0.150 -7.161 2.449 1.00 12.55 N ATOM 987 CA GLN A 388 -1.275 -7.390 2.593 1.00 12.96 C ATOM 988 C GLN A 388 -1.612 -8.281 3.797 1.00 17.61 C ATOM 989 O GLN A 388 -1.010 -9.341 3.976 1.00 18.01 O ATOM 990 CB GLN A 388 -1.864 -7.958 1.285 1.00 13.88 C ATOM 991 CG GLN A 388 -3.384 -8.083 1.321 1.00 15.87 C ATOM 992 CD GLN A 388 -3.983 -8.219 -0.054 1.00 30.74 C ATOM 993 OE1 GLN A 388 -3.600 -7.531 -1.014 1.00 29.06 O ATOM 994 NE2 GLN A 388 -4.964 -9.095 -0.167 1.00 18.25 N ATOM 995 HE22 GLN A 388 -5.259 -9.655 0.658 1.00 0.00 H ATOM 996 HE21 GLN A 388 -5.442 -9.226 -1.081 1.00 0.00 H ATOM 997 H GLN A 388 0.575 -7.335 1.516 1.00 0.00 H ATOM 998 N GLY A 389 -2.559 -7.821 4.601 1.00 13.26 N ATOM 999 CA GLY A 389 -3.026 -8.552 5.769 1.00 12.70 C ATOM 1000 C GLY A 389 -2.241 -8.297 7.038 1.00 15.89 C ATOM 1001 O GLY A 389 -2.718 -8.647 8.116 1.00 15.16 O ATOM 1002 H GLY A 389 -2.987 -6.897 4.388 1.00 0.00 H ATOM 1003 N ASP A 390 -1.009 -7.732 6.928 1.00 13.12 N ATOM 1004 CA ASP A 390 -0.159 -7.447 8.101 1.00 12.06 C ATOM 1005 C ASP A 390 -0.669 -6.266 8.918 1.00 15.62 C ATOM 1006 O ASP A 390 -1.181 -5.284 8.353 1.00 14.77 O ATOM 1007 CB ASP A 390 1.299 -7.218 7.682 1.00 13.34 C ATOM 1008 CG ASP A 390 2.011 -8.470 7.203 1.00 15.26 C ATOM 1009 OD1 ASP A 390 1.671 -9.580 7.692 1.00 14.15 O ATOM 1010 OD2 ASP A 390 2.947 -8.343 6.394 1.00 18.65 O ATOM 1011 H ASP A 390 -0.652 -7.491 5.981 1.00 0.00 H ATOM 1012 N VAL A 391 -0.551 -6.374 10.255 1.00 13.05 N ATOM 1013 CA VAL A 391 -0.962 -5.301 11.174 1.00 11.96 C ATOM 1014 C VAL A 391 0.307 -4.711 11.742 1.00 14.64 C ATOM 1015 O VAL A 391 1.002 -5.358 12.540 1.00 13.78 O ATOM 1016 CB VAL A 391 -1.969 -5.716 12.287 1.00 13.90 C ATOM 1017 CG1 VAL A 391 -2.288 -4.532 13.201 1.00 12.97 C ATOM 1018 CG2 VAL A 391 -3.261 -6.289 11.690 1.00 13.03 C ATOM 1019 H VAL A 391 -0.154 -7.249 10.653 1.00 0.00 H ATOM 1020 N LEU A 392 0.611 -3.477 11.338 1.00 10.79 N ATOM 1021 CA LEU A 392 1.839 -2.825 11.800 1.00 10.01 C ATOM 1022 C LEU A 392 1.584 -1.929 12.995 1.00 13.78 C ATOM 1023 O LEU A 392 0.544 -1.281 13.073 1.00 14.85 O ATOM 1024 CB LEU A 392 2.607 -2.093 10.646 1.00 9.57 C ATOM 1025 CG LEU A 392 3.009 -2.898 9.385 1.00 11.95 C ATOM 1026 CD1 LEU A 392 3.482 -4.299 9.721 1.00 8.44 C ATOM 1027 CD2 LEU A 392 1.846 -2.952 8.368 1.00 12.98 C ATOM 1028 H LEU A 392 -0.028 -2.974 10.690 1.00 0.00 H ATOM 1029 N GLY A 393 2.520 -1.955 13.928 1.00 9.48 N ATOM 1030 CA GLY A 393 2.483 -1.216 15.182 1.00 8.95 C ATOM 1031 C GLY A 393 3.495 -0.102 15.204 1.00 12.63 C ATOM 1032 O GLY A 393 4.609 -0.265 14.699 1.00 11.43 O ATOM 1033 H GLY A 393 3.352 -2.553 13.752 1.00 0.00 H ATOM 1034 N PHE A 394 3.086 1.065 15.716 1.00 11.20 N ATOM 1035 CA PHE A 394 3.958 2.249 15.704 1.00 11.47 C ATOM 1036 C PHE A 394 4.100 2.843 17.068 1.00 13.83 C ATOM 1037 O PHE A 394 3.127 3.358 17.613 1.00 13.27 O ATOM 1038 CB PHE A 394 3.443 3.286 14.693 1.00 12.77 C ATOM 1039 CG PHE A 394 3.412 2.714 13.298 1.00 13.47 C ATOM 1040 CD1 PHE A 394 2.326 1.955 12.862 1.00 14.35 C ATOM 1041 CD2 PHE A 394 4.522 2.827 12.459 1.00 13.28 C ATOM 1042 CE1 PHE A 394 2.347 1.333 11.610 1.00 14.93 C ATOM 1043 CE2 PHE A 394 4.537 2.206 11.205 1.00 14.73 C ATOM 1044 CZ PHE A 394 3.460 1.450 10.799 1.00 13.00 C ATOM 1045 H PHE A 394 2.134 1.136 16.130 1.00 0.00 H ATOM 1046 N TYR A 395 5.315 2.752 17.619 1.00 9.43 N ATOM 1047 CA TYR A 395 5.641 3.275 18.950 1.00 9.55 C ATOM 1048 C TYR A 395 6.605 4.462 18.844 1.00 12.43 C ATOM 1049 O TYR A 395 7.534 4.445 18.046 1.00 12.32 O ATOM 1050 CB TYR A 395 6.251 2.146 19.804 1.00 9.31 C ATOM 1051 CG TYR A 395 6.813 2.562 21.148 1.00 11.06 C ATOM 1052 CD1 TYR A 395 6.061 2.425 22.315 1.00 12.18 C ATOM 1053 CD2 TYR A 395 8.124 3.029 21.265 1.00 11.72 C ATOM 1054 CE1 TYR A 395 6.588 2.779 23.560 1.00 11.78 C ATOM 1055 CE2 TYR A 395 8.658 3.388 22.501 1.00 12.27 C ATOM 1056 CZ TYR A 395 7.891 3.249 23.645 1.00 15.86 C ATOM 1057 OH TYR A 395 8.435 3.595 24.852 1.00 16.06 O ATOM 1058 HH TYR A 395 7.770 3.441 25.569 1.00 0.00 H ATOM 1059 H TYR A 395 6.069 2.286 17.075 1.00 0.00 H ATOM 1060 N ILE A 396 6.378 5.474 19.653 1.00 9.65 N ATOM 1061 CA ILE A 396 7.273 6.620 19.796 1.00 9.28 C ATOM 1062 C ILE A 396 7.411 6.922 21.295 1.00 13.84 C ATOM 1063 O ILE A 396 6.444 6.785 22.040 1.00 13.67 O ATOM 1064 CB ILE A 396 6.880 7.876 18.951 1.00 12.18 C ATOM 1065 CG1 ILE A 396 8.105 8.785 18.703 1.00 11.71 C ATOM 1066 CG2 ILE A 396 5.704 8.665 19.563 1.00 13.86 C ATOM 1067 CD1 ILE A 396 7.988 9.727 17.486 1.00 10.85 C ATOM 1068 H ILE A 396 5.510 5.457 20.225 1.00 0.00 H ATOM 1069 N ASN A 397 8.615 7.277 21.728 1.00 10.94 N ATOM 1070 CA ASN A 397 8.864 7.701 23.092 1.00 10.38 C ATOM 1071 C ASN A 397 9.584 9.020 23.041 1.00 13.59 C ATOM 1072 O ASN A 397 10.700 9.086 22.509 1.00 12.95 O ATOM 1073 CB ASN A 397 9.701 6.701 23.894 1.00 8.41 C ATOM 1074 CG ASN A 397 9.744 7.065 25.365 1.00 19.87 C ATOM 1075 OD1 ASN A 397 8.771 7.541 25.934 1.00 17.87 O ATOM 1076 ND2 ASN A 397 10.884 6.929 25.997 1.00 16.82 N ATOM 1077 HD22 ASN A 397 11.706 6.523 25.505 1.00 0.00 H ATOM 1078 HD21 ASN A 397 10.967 7.227 26.990 1.00 0.00 H ATOM 1079 H ASN A 397 9.413 7.250 21.061 1.00 0.00 H ATOM 1080 N LEU A 398 8.967 10.059 23.608 1.00 11.57 N ATOM 1081 CA LEU A 398 9.575 11.394 23.668 1.00 13.07 C ATOM 1082 C LEU A 398 9.762 11.756 25.171 1.00 20.17 C ATOM 1083 O LEU A 398 8.853 12.317 25.784 1.00 19.87 O ATOM 1084 CB LEU A 398 8.718 12.429 22.874 1.00 12.82 C ATOM 1085 CG LEU A 398 8.425 12.057 21.372 1.00 17.05 C ATOM 1086 CD1 LEU A 398 7.293 12.907 20.782 1.00 16.98 C ATOM 1087 CD2 LEU A 398 9.658 12.208 20.504 1.00 16.93 C ATOM 1088 H LEU A 398 8.023 9.918 24.021 1.00 0.00 H ATOM 1089 N PRO A 399 10.887 11.336 25.811 1.00 19.24 N ATOM 1090 CA PRO A 399 11.061 11.598 27.258 1.00 25.40 C ATOM 1091 C PRO A 399 11.114 13.073 27.628 1.00 57.04 C ATOM 1092 O PRO A 399 11.557 13.870 26.814 1.00 31.39 O ATOM 1093 CB PRO A 399 12.387 10.898 27.598 1.00 26.03 C ATOM 1094 CG PRO A 399 12.625 9.936 26.481 1.00 28.41 C ATOM 1095 CD PRO A 399 12.054 10.616 25.266 1.00 22.41 C TER 1096 PRO A 399 ATOM 1097 N GLY A 444 16.506 9.723 26.415 1.00 23.70 N ATOM 1098 CA GLY A 444 16.685 9.408 25.011 1.00 23.04 C ATOM 1099 C GLY A 444 15.394 8.934 24.316 1.00 23.90 C ATOM 1100 O GLY A 444 14.766 7.954 24.714 1.00 24.13 O ATOM 1101 HN3 GLY A 444 16.174 8.876 26.919 1.00 0.00 H ATOM 1102 HN2 GLY A 444 15.803 10.484 26.512 1.00 0.00 H ATOM 1103 HN1 GLY A 444 17.413 10.034 26.818 1.00 0.00 H ATOM 1104 N SER A 445 15.016 9.654 23.263 1.00 18.01 N ATOM 1105 CA SER A 445 13.834 9.391 22.446 1.00 16.07 C ATOM 1106 C SER A 445 14.013 8.115 21.591 1.00 18.66 C ATOM 1107 O SER A 445 15.155 7.749 21.292 1.00 17.69 O ATOM 1108 CB SER A 445 13.566 10.594 21.557 1.00 16.40 C ATOM 1109 OG SER A 445 14.761 10.896 20.865 1.00 18.47 O ATOM 1110 HG SER A 445 15.030 10.117 20.317 1.00 0.00 H ATOM 1111 H SER A 445 15.608 10.468 23.001 1.00 0.00 H ATOM 1112 N GLU A 446 12.897 7.435 21.231 1.00 14.59 N ATOM 1113 CA GLU A 446 12.917 6.196 20.427 1.00 14.84 C ATOM 1114 C GLU A 446 11.742 6.069 19.474 1.00 15.31 C ATOM 1115 O GLU A 446 10.607 6.362 19.854 1.00 13.20 O ATOM 1116 CB GLU A 446 12.823 4.942 21.328 1.00 16.32 C ATOM 1117 CG GLU A 446 13.972 4.683 22.276 1.00 28.99 C ATOM 1118 CD GLU A 446 13.656 3.485 23.143 1.00 40.63 C ATOM 1119 OE1 GLU A 446 13.027 3.664 24.211 1.00 39.63 O ATOM 1120 OE2 GLU A 446 13.939 2.354 22.695 1.00 32.92 O ATOM 1121 H GLU A 446 11.975 7.806 21.538 1.00 0.00 H ATOM 1122 N ILE A 447 12.007 5.486 18.295 1.00 11.27 N ATOM 1123 CA ILE A 447 10.994 5.075 17.324 1.00 10.73 C ATOM 1124 C ILE A 447 11.116 3.558 17.186 1.00 13.60 C ATOM 1125 O ILE A 447 12.207 3.050 16.933 1.00 12.73 O ATOM 1126 CB ILE A 447 10.988 5.823 15.961 1.00 13.17 C ATOM 1127 CG1 ILE A 447 10.552 7.282 16.154 1.00 13.35 C ATOM 1128 CG2 ILE A 447 10.036 5.108 14.949 1.00 13.01 C ATOM 1129 CD1 ILE A 447 10.707 8.130 14.973 1.00 13.82 C ATOM 1130 H ILE A 447 13.004 5.314 18.055 1.00 0.00 H ATOM 1131 N ILE A 448 9.995 2.837 17.405 1.00 10.06 N ATOM 1132 CA ILE A 448 9.963 1.372 17.362 1.00 9.04 C ATOM 1133 C ILE A 448 8.794 0.905 16.512 1.00 12.09 C ATOM 1134 O ILE A 448 7.681 1.397 16.673 1.00 12.52 O ATOM 1135 CB ILE A 448 9.948 0.750 18.807 1.00 10.76 C ATOM 1136 CG1 ILE A 448 11.162 1.231 19.664 1.00 10.68 C ATOM 1137 CG2 ILE A 448 9.847 -0.797 18.784 1.00 8.43 C ATOM 1138 CD1 ILE A 448 11.080 0.890 21.114 1.00 10.58 C ATOM 1139 H ILE A 448 9.112 3.346 17.614 1.00 0.00 H ATOM 1140 N PHE A 449 9.048 -0.060 15.631 1.00 8.97 N ATOM 1141 CA PHE A 449 8.025 -0.635 14.761 1.00 8.71 C ATOM 1142 C PHE A 449 7.710 -2.078 15.169 1.00 12.79 C ATOM 1143 O PHE A 449 8.567 -2.792 15.682 1.00 12.56 O ATOM 1144 CB PHE A 449 8.446 -0.543 13.281 1.00 10.02 C ATOM 1145 CG PHE A 449 8.730 0.858 12.770 1.00 11.81 C ATOM 1146 CD1 PHE A 449 9.995 1.204 12.303 1.00 13.11 C ATOM 1147 CD2 PHE A 449 7.728 1.821 12.729 1.00 13.11 C ATOM 1148 CE1 PHE A 449 10.251 2.490 11.817 1.00 14.01 C ATOM 1149 CE2 PHE A 449 7.991 3.114 12.249 1.00 15.34 C ATOM 1150 CZ PHE A 449 9.251 3.442 11.801 1.00 13.14 C ATOM 1151 H PHE A 449 10.020 -0.422 15.559 1.00 0.00 H ATOM 1152 N TYR A 450 6.465 -2.475 14.995 1.00 10.48 N ATOM 1153 CA TYR A 450 5.997 -3.812 15.335 1.00 9.88 C ATOM 1154 C TYR A 450 5.322 -4.413 14.110 1.00 11.84 C ATOM 1155 O TYR A 450 4.668 -3.695 13.365 1.00 9.10 O ATOM 1156 CB TYR A 450 4.966 -3.734 16.473 1.00 11.43 C ATOM 1157 CG TYR A 450 5.506 -3.382 17.840 1.00 13.56 C ATOM 1158 CD1 TYR A 450 5.888 -2.074 18.147 1.00 15.11 C ATOM 1159 CD2 TYR A 450 5.519 -4.325 18.869 1.00 13.83 C ATOM 1160 CE1 TYR A 450 6.330 -1.732 19.422 1.00 14.62 C ATOM 1161 CE2 TYR A 450 5.933 -3.987 20.155 1.00 14.67 C ATOM 1162 CZ TYR A 450 6.336 -2.689 20.425 1.00 19.25 C ATOM 1163 OH TYR A 450 6.744 -2.348 21.683 1.00 16.89 O ATOM 1164 HH TYR A 450 6.006 -2.508 22.323 1.00 0.00 H ATOM 1165 H TYR A 450 5.783 -1.800 14.595 1.00 0.00 H ATOM 1166 N LYS A 451 5.454 -5.727 13.925 1.00 9.93 N ATOM 1167 CA LYS A 451 4.790 -6.454 12.852 1.00 10.71 C ATOM 1168 C LYS A 451 4.032 -7.604 13.473 1.00 15.74 C ATOM 1169 O LYS A 451 4.649 -8.501 14.062 1.00 16.90 O ATOM 1170 CB LYS A 451 5.766 -6.958 11.777 1.00 12.88 C ATOM 1171 CG LYS A 451 5.034 -7.668 10.636 1.00 14.86 C ATOM 1172 CD LYS A 451 5.933 -7.946 9.470 1.00 22.61 C ATOM 1173 CE LYS A 451 6.176 -9.420 9.279 1.00 22.77 C ATOM 1174 NZ LYS A 451 6.541 -9.733 7.872 1.00 18.81 N ATOM 1175 HZ1 LYS A 451 5.767 -9.441 7.241 1.00 0.00 H ATOM 1176 HZ2 LYS A 451 7.409 -9.220 7.618 1.00 0.00 H ATOM 1177 HZ3 LYS A 451 6.701 -10.756 7.776 1.00 0.00 H ATOM 1178 H LYS A 451 6.062 -6.259 14.580 1.00 0.00 H ATOM 1179 N ASN A 452 2.694 -7.562 13.372 1.00 11.57 N ATOM 1180 CA ASN A 452 1.805 -8.593 13.933 1.00 11.78 C ATOM 1181 C ASN A 452 2.161 -8.893 15.422 1.00 14.85 C ATOM 1182 O ASN A 452 2.343 -10.043 15.835 1.00 13.47 O ATOM 1183 CB ASN A 452 1.762 -9.851 13.010 1.00 8.02 C ATOM 1184 CG ASN A 452 1.306 -9.538 11.597 1.00 13.69 C ATOM 1185 OD1 ASN A 452 0.383 -8.759 11.374 1.00 9.17 O ATOM 1186 ND2 ASN A 452 1.910 -10.168 10.603 1.00 12.40 N ATOM 1187 HD22 ASN A 452 2.691 -10.826 10.802 1.00 0.00 H ATOM 1188 HD21 ASN A 452 1.604 -10.006 9.622 1.00 0.00 H ATOM 1189 H ASN A 452 2.263 -6.759 12.871 1.00 0.00 H ATOM 1190 N GLY A 453 2.294 -7.805 16.181 1.00 13.14 N ATOM 1191 CA GLY A 453 2.634 -7.783 17.600 1.00 12.87 C ATOM 1192 C GLY A 453 4.058 -8.150 17.954 1.00 16.43 C ATOM 1193 O GLY A 453 4.339 -8.378 19.125 1.00 16.93 O ATOM 1194 H GLY A 453 2.141 -6.886 15.719 1.00 0.00 H ATOM 1195 N VAL A 454 4.975 -8.209 16.969 1.00 12.20 N ATOM 1196 CA VAL A 454 6.370 -8.563 17.237 1.00 10.82 C ATOM 1197 C VAL A 454 7.224 -7.305 17.124 1.00 15.39 C ATOM 1198 O VAL A 454 7.314 -6.717 16.035 1.00 13.90 O ATOM 1199 CB VAL A 454 6.898 -9.697 16.297 1.00 12.57 C ATOM 1200 CG1 VAL A 454 8.335 -10.114 16.659 1.00 11.42 C ATOM 1201 CG2 VAL A 454 5.960 -10.902 16.288 1.00 11.64 C ATOM 1202 H VAL A 454 4.684 -7.998 15.993 1.00 0.00 H ATOM 1203 N ASN A 455 7.907 -6.941 18.228 1.00 12.42 N ATOM 1204 CA ASN A 455 8.803 -5.783 18.269 1.00 12.67 C ATOM 1205 C ASN A 455 9.938 -5.991 17.256 1.00 16.21 C ATOM 1206 O ASN A 455 10.667 -6.985 17.346 1.00 13.63 O ATOM 1207 CB ASN A 455 9.346 -5.584 19.692 1.00 10.95 C ATOM 1208 CG ASN A 455 10.057 -4.285 19.933 1.00 19.11 C ATOM 1209 OD1 ASN A 455 10.983 -3.895 19.207 1.00 12.80 O ATOM 1210 ND2 ASN A 455 9.745 -3.663 21.061 1.00 11.10 N ATOM 1211 HD22 ASN A 455 8.962 -4.014 21.649 1.00 0.00 H ATOM 1212 HD21 ASN A 455 10.283 -2.824 21.358 1.00 0.00 H ATOM 1213 H ASN A 455 7.792 -7.509 19.091 1.00 0.00 H ATOM 1214 N GLN A 456 10.070 -5.059 16.274 1.00 13.17 N ATOM 1215 CA GLN A 456 11.098 -5.192 15.233 1.00 12.06 C ATOM 1216 C GLN A 456 12.435 -4.564 15.560 1.00 16.26 C ATOM 1217 O GLN A 456 13.346 -4.598 14.726 1.00 15.77 O ATOM 1218 CB GLN A 456 10.576 -4.772 13.842 1.00 13.22 C ATOM 1219 CG GLN A 456 9.316 -5.519 13.376 1.00 16.99 C ATOM 1220 CD GLN A 456 9.533 -6.991 13.155 1.00 28.62 C ATOM 1221 OE1 GLN A 456 10.359 -7.413 12.346 1.00 29.67 O ATOM 1222 NE2 GLN A 456 8.783 -7.801 13.855 1.00 17.48 N ATOM 1223 HE22 GLN A 456 8.093 -7.417 14.532 1.00 0.00 H ATOM 1224 HE21 GLN A 456 8.876 -8.830 13.735 1.00 0.00 H ATOM 1225 H GLN A 456 9.432 -4.238 16.260 1.00 0.00 H ATOM 1226 N GLY A 457 12.565 -4.057 16.789 1.00 13.20 N ATOM 1227 CA GLY A 457 13.775 -3.396 17.278 1.00 12.29 C ATOM 1228 C GLY A 457 13.665 -1.883 17.196 1.00 16.06 C ATOM 1229 O GLY A 457 12.683 -1.344 16.652 1.00 14.21 O ATOM 1230 H GLY A 457 11.756 -4.137 17.438 1.00 0.00 H ATOM 1231 N VAL A 458 14.655 -1.188 17.763 1.00 13.70 N ATOM 1232 CA VAL A 458 14.758 0.282 17.739 1.00 13.51 C ATOM 1233 C VAL A 458 15.153 0.717 16.310 1.00 16.90 C ATOM 1234 O VAL A 458 16.276 0.416 15.868 1.00 16.37 O ATOM 1235 CB VAL A 458 15.761 0.819 18.811 1.00 16.81 C ATOM 1236 CG1 VAL A 458 15.955 2.337 18.680 1.00 16.92 C ATOM 1237 CG2 VAL A 458 15.295 0.471 20.223 1.00 16.13 C ATOM 1238 H VAL A 458 15.402 -1.719 18.254 1.00 0.00 H ATOM 1239 N ALA A 459 14.229 1.394 15.576 1.00 12.15 N ATOM 1240 CA ALA A 459 14.560 1.870 14.224 1.00 11.33 C ATOM 1241 C ALA A 459 15.425 3.140 14.348 1.00 15.34 C ATOM 1242 O ALA A 459 16.458 3.248 13.688 1.00 13.68 O ATOM 1243 CB ALA A 459 13.294 2.163 13.423 1.00 11.68 C ATOM 1244 H ALA A 459 13.285 1.576 15.972 1.00 0.00 H ATOM 1245 N TYR A 460 15.005 4.085 15.211 1.00 12.54 N ATOM 1246 CA TYR A 460 15.754 5.333 15.444 1.00 12.47 C ATOM 1247 C TYR A 460 15.729 5.748 16.882 1.00 15.74 C ATOM 1248 O TYR A 460 14.706 5.613 17.549 1.00 15.38 O ATOM 1249 CB TYR A 460 15.225 6.502 14.577 1.00 12.10 C ATOM 1250 CG TYR A 460 15.239 6.213 13.094 1.00 11.24 C ATOM 1251 CD1 TYR A 460 14.095 5.742 12.441 1.00 12.32 C ATOM 1252 CD2 TYR A 460 16.401 6.375 12.345 1.00 10.55 C ATOM 1253 CE1 TYR A 460 14.105 5.477 11.072 1.00 12.20 C ATOM 1254 CE2 TYR A 460 16.436 6.059 10.989 1.00 10.45 C ATOM 1255 CZ TYR A 460 15.285 5.620 10.356 1.00 14.05 C ATOM 1256 OH TYR A 460 15.314 5.372 9.010 1.00 12.21 O ATOM 1257 HH TYR A 460 15.984 4.668 8.820 1.00 0.00 H ATOM 1258 H TYR A 460 14.119 3.928 15.733 1.00 0.00 H ATOM 1259 N LYS A 461 16.850 6.299 17.337 1.00 13.70 N ATOM 1260 CA LYS A 461 17.030 6.855 18.678 1.00 14.69 C ATOM 1261 C LYS A 461 17.538 8.306 18.589 1.00 20.21 C ATOM 1262 O LYS A 461 18.081 8.714 17.543 1.00 18.71 O ATOM 1263 CB LYS A 461 17.942 5.973 19.564 1.00 17.63 C ATOM 1264 CG LYS A 461 19.294 5.576 18.948 1.00 31.20 C ATOM 1265 CD LYS A 461 20.402 5.267 19.973 1.00 33.74 C ATOM 1266 CE LYS A 461 20.129 4.092 20.888 1.00 41.00 C ATOM 1267 NZ LYS A 461 19.859 4.534 22.285 1.00 45.30 N ATOM 1268 HZ1 LYS A 461 20.685 5.049 22.650 1.00 0.00 H ATOM 1269 HZ2 LYS A 461 19.027 5.158 22.295 1.00 0.00 H ATOM 1270 HZ3 LYS A 461 19.677 3.702 22.881 1.00 0.00 H ATOM 1271 H LYS A 461 17.662 6.338 16.689 1.00 0.00 H ATOM 1272 N ASP A 462 17.330 9.096 19.676 1.00 17.33 N ATOM 1273 CA ASP A 462 17.771 10.504 19.754 1.00 17.28 C ATOM 1274 C ASP A 462 17.310 11.297 18.510 1.00 19.74 C ATOM 1275 O ASP A 462 18.106 11.919 17.808 1.00 18.96 O ATOM 1276 CB ASP A 462 19.295 10.584 19.999 1.00 18.66 C ATOM 1277 CG ASP A 462 19.758 9.803 21.219 1.00 30.29 C ATOM 1278 OD1 ASP A 462 19.282 10.104 22.333 1.00 31.37 O ATOM 1279 OD2 ASP A 462 20.596 8.889 21.056 1.00 40.65 O ATOM 1280 H ASP A 462 16.835 8.688 20.495 1.00 0.00 H ATOM 1281 N ILE A 463 16.010 11.208 18.220 1.00 15.71 N ATOM 1282 CA ILE A 463 15.404 11.828 17.038 1.00 15.87 C ATOM 1283 C ILE A 463 15.316 13.366 17.123 1.00 22.45 C ATOM 1284 O ILE A 463 15.413 13.938 18.220 1.00 21.47 O ATOM 1285 CB ILE A 463 14.034 11.160 16.693 1.00 17.94 C ATOM 1286 CG1 ILE A 463 12.954 11.469 17.771 1.00 17.32 C ATOM 1287 CG2 ILE A 463 14.205 9.642 16.434 1.00 17.43 C ATOM 1288 CD1 ILE A 463 11.538 10.949 17.450 1.00 15.65 C ATOM 1289 H ILE A 463 15.396 10.672 18.866 1.00 0.00 H ATOM 1290 N PHE A 464 15.122 14.018 15.952 1.00 21.93 N ATOM 1291 CA PHE A 464 14.970 15.464 15.819 1.00 23.09 C ATOM 1292 C PHE A 464 13.805 15.888 16.696 1.00 26.62 C ATOM 1293 O PHE A 464 12.714 15.337 16.558 1.00 26.94 O ATOM 1294 CB PHE A 464 14.751 15.858 14.339 1.00 25.81 C ATOM 1295 CG PHE A 464 14.773 17.350 14.035 1.00 28.65 C ATOM 1296 CD1 PHE A 464 15.854 18.144 14.422 1.00 32.09 C ATOM 1297 CD2 PHE A 464 13.752 17.943 13.297 1.00 31.15 C ATOM 1298 CE1 PHE A 464 15.877 19.515 14.129 1.00 32.75 C ATOM 1299 CE2 PHE A 464 13.773 19.312 13.013 1.00 34.17 C ATOM 1300 CZ PHE A 464 14.834 20.089 13.433 1.00 32.08 C ATOM 1301 H PHE A 464 15.078 13.447 15.084 1.00 0.00 H ATOM 1302 N GLU A 465 14.061 16.778 17.666 1.00 22.18 N ATOM 1303 CA GLU A 465 13.038 17.226 18.620 1.00 22.43 C ATOM 1304 C GLU A 465 11.908 17.997 17.941 1.00 24.31 C ATOM 1305 O GLU A 465 12.143 18.716 16.973 1.00 23.15 O ATOM 1306 CB GLU A 465 13.660 18.084 19.751 1.00 24.04 C ATOM 1307 H GLU A 465 15.022 17.167 17.746 1.00 0.00 H ATOM 1308 N GLY A 466 10.703 17.839 18.480 1.00 20.58 N ATOM 1309 CA GLY A 466 9.494 18.495 18.014 1.00 19.48 C ATOM 1310 C GLY A 466 8.252 17.647 18.211 1.00 21.78 C ATOM 1311 O GLY A 466 8.276 16.641 18.928 1.00 21.56 O ATOM 1312 H GLY A 466 10.620 17.199 19.295 1.00 0.00 H ATOM 1313 N VAL A 467 7.157 18.062 17.566 1.00 15.76 N ATOM 1314 CA VAL A 467 5.883 17.371 17.617 1.00 14.33 C ATOM 1315 C VAL A 467 5.853 16.312 16.518 1.00 17.78 C ATOM 1316 O VAL A 467 6.241 16.604 15.390 1.00 15.80 O ATOM 1317 CB VAL A 467 4.712 18.374 17.523 1.00 16.22 C ATOM 1318 CG1 VAL A 467 3.375 17.658 17.329 1.00 14.96 C ATOM 1319 CG2 VAL A 467 4.675 19.252 18.771 1.00 15.92 C ATOM 1320 H VAL A 467 7.222 18.929 16.996 1.00 0.00 H ATOM 1321 N TYR A 468 5.412 15.077 16.867 1.00 14.31 N ATOM 1322 CA TYR A 468 5.301 13.964 15.924 1.00 13.53 C ATOM 1323 C TYR A 468 3.879 13.504 15.732 1.00 16.14 C ATOM 1324 O TYR A 468 3.132 13.350 16.697 1.00 15.54 O ATOM 1325 CB TYR A 468 6.218 12.798 16.305 1.00 13.71 C ATOM 1326 CG TYR A 468 7.650 13.068 15.926 1.00 13.96 C ATOM 1327 CD1 TYR A 468 8.541 13.616 16.845 1.00 16.01 C ATOM 1328 CD2 TYR A 468 8.108 12.827 14.631 1.00 13.59 C ATOM 1329 CE1 TYR A 468 9.853 13.906 16.490 1.00 15.50 C ATOM 1330 CE2 TYR A 468 9.417 13.112 14.266 1.00 13.32 C ATOM 1331 CZ TYR A 468 10.290 13.639 15.204 1.00 20.77 C ATOM 1332 OH TYR A 468 11.589 13.914 14.861 1.00 20.55 O ATOM 1333 HH TYR A 468 12.066 14.282 15.647 1.00 0.00 H ATOM 1334 H TYR A 468 5.139 14.913 17.857 1.00 0.00 H ATOM 1335 N PHE A 469 3.507 13.316 14.463 1.00 11.14 N ATOM 1336 CA PHE A 469 2.185 12.904 14.051 1.00 10.65 C ATOM 1337 C PHE A 469 2.188 11.517 13.413 1.00 14.80 C ATOM 1338 O PHE A 469 3.033 11.272 12.544 1.00 13.53 O ATOM 1339 CB PHE A 469 1.654 13.896 12.984 1.00 12.45 C ATOM 1340 CG PHE A 469 1.215 15.257 13.471 1.00 13.14 C ATOM 1341 CD1 PHE A 469 2.149 16.253 13.738 1.00 15.38 C ATOM 1342 CD2 PHE A 469 -0.133 15.558 13.612 1.00 14.96 C ATOM 1343 CE1 PHE A 469 1.745 17.512 14.185 1.00 16.77 C ATOM 1344 CE2 PHE A 469 -0.542 16.819 14.066 1.00 18.06 C ATOM 1345 CZ PHE A 469 0.401 17.789 14.351 1.00 16.14 C ATOM 1346 H PHE A 469 4.218 13.477 13.721 1.00 0.00 H ATOM 1347 N PRO A 470 1.179 10.646 13.707 1.00 11.91 N ATOM 1348 CA PRO A 470 1.034 9.409 12.923 1.00 11.82 C ATOM 1349 C PRO A 470 0.957 9.795 11.428 1.00 15.36 C ATOM 1350 O PRO A 470 0.337 10.818 11.092 1.00 12.67 O ATOM 1351 CB PRO A 470 -0.299 8.852 13.420 1.00 13.24 C ATOM 1352 CG PRO A 470 -0.439 9.401 14.803 1.00 16.21 C ATOM 1353 CD PRO A 470 0.073 10.785 14.681 1.00 12.04 C ATOM 1354 N ALA A 471 1.701 9.080 10.557 1.00 12.60 N ATOM 1355 CA ALA A 471 1.756 9.463 9.141 1.00 12.62 C ATOM 1356 C ALA A 471 1.777 8.278 8.181 1.00 15.74 C ATOM 1357 O ALA A 471 2.413 7.261 8.455 1.00 14.62 O ATOM 1358 CB ALA A 471 2.968 10.371 8.896 1.00 12.93 C ATOM 1359 H ALA A 471 2.238 8.254 10.891 1.00 0.00 H ATOM 1360 N ILE A 472 1.100 8.430 7.033 1.00 11.67 N ATOM 1361 CA ILE A 472 1.004 7.377 6.012 1.00 9.27 C ATOM 1362 C ILE A 472 1.499 7.910 4.678 1.00 12.36 C ATOM 1363 O ILE A 472 1.010 8.930 4.223 1.00 12.40 O ATOM 1364 CB ILE A 472 -0.480 6.852 5.896 1.00 11.83 C ATOM 1365 CG1 ILE A 472 -0.928 6.088 7.168 1.00 13.14 C ATOM 1366 CG2 ILE A 472 -0.686 5.973 4.647 1.00 10.02 C ATOM 1367 CD1 ILE A 472 -2.449 6.025 7.427 1.00 8.62 C ATOM 1368 H ILE A 472 0.620 9.336 6.857 1.00 0.00 H ATOM 1369 N SER A 473 2.409 7.190 4.016 1.00 10.27 N ATOM 1370 CA SER A 473 2.806 7.537 2.652 1.00 10.38 C ATOM 1371 C SER A 473 2.652 6.318 1.789 1.00 14.06 C ATOM 1372 O SER A 473 3.032 5.220 2.199 1.00 13.69 O ATOM 1373 CB SER A 473 4.186 8.184 2.563 1.00 10.60 C ATOM 1374 OG SER A 473 5.215 7.224 2.657 1.00 16.36 O ATOM 1375 HG SER A 473 5.146 6.751 3.524 1.00 0.00 H ATOM 1376 H SER A 473 2.844 6.367 4.480 1.00 0.00 H ATOM 1377 N LEU A 474 1.980 6.493 0.645 1.00 10.98 N ATOM 1378 CA LEU A 474 1.643 5.391 -0.241 1.00 10.37 C ATOM 1379 C LEU A 474 2.090 5.605 -1.667 1.00 12.69 C ATOM 1380 O LEU A 474 2.017 6.714 -2.202 1.00 10.85 O ATOM 1381 CB LEU A 474 0.133 5.096 -0.211 1.00 10.64 C ATOM 1382 CG LEU A 474 -0.545 4.888 1.145 1.00 13.98 C ATOM 1383 CD1 LEU A 474 -2.036 4.844 0.985 1.00 14.18 C ATOM 1384 CD2 LEU A 474 -0.064 3.599 1.825 1.00 12.46 C ATOM 1385 H LEU A 474 1.687 7.455 0.379 1.00 0.00 H ATOM 1386 N TYR A 475 2.552 4.506 -2.273 1.00 10.13 N ATOM 1387 CA TYR A 475 3.011 4.407 -3.651 1.00 9.08 C ATOM 1388 C TYR A 475 2.005 3.567 -4.394 1.00 12.39 C ATOM 1389 O TYR A 475 1.823 2.386 -4.081 1.00 11.25 O ATOM 1390 CB TYR A 475 4.400 3.739 -3.736 1.00 10.05 C ATOM 1391 CG TYR A 475 4.891 3.596 -5.168 1.00 11.49 C ATOM 1392 CD1 TYR A 475 5.276 4.711 -5.908 1.00 13.13 C ATOM 1393 CD2 TYR A 475 4.902 2.357 -5.803 1.00 11.84 C ATOM 1394 CE1 TYR A 475 5.687 4.593 -7.235 1.00 15.74 C ATOM 1395 CE2 TYR A 475 5.338 2.223 -7.123 1.00 12.56 C ATOM 1396 CZ TYR A 475 5.724 3.347 -7.838 1.00 18.91 C ATOM 1397 OH TYR A 475 6.169 3.232 -9.133 1.00 16.01 O ATOM 1398 HH TYR A 475 6.399 4.129 -9.483 1.00 0.00 H ATOM 1399 H TYR A 475 2.587 3.636 -1.704 1.00 0.00 H ATOM 1400 N LYS A 476 1.356 4.177 -5.399 1.00 9.98 N ATOM 1401 CA LYS A 476 0.359 3.529 -6.225 1.00 8.76 C ATOM 1402 C LYS A 476 -0.878 3.102 -5.415 1.00 15.65 C ATOM 1403 O LYS A 476 -0.975 3.437 -4.228 1.00 15.95 O ATOM 1404 CB LYS A 476 1.000 2.435 -7.103 1.00 10.45 C ATOM 1405 CG LYS A 476 1.927 3.011 -8.168 1.00 11.81 C ATOM 1406 CD LYS A 476 2.379 1.970 -9.184 1.00 20.39 C ATOM 1407 CE LYS A 476 2.879 2.630 -10.445 1.00 21.52 C ATOM 1408 NZ LYS A 476 3.624 1.677 -11.306 1.00 24.48 N ATOM 1409 HZ1 LYS A 476 4.443 1.307 -10.783 1.00 0.00 H ATOM 1410 HZ2 LYS A 476 2.998 0.891 -11.574 1.00 0.00 H ATOM 1411 HZ3 LYS A 476 3.951 2.168 -12.162 1.00 0.00 H ATOM 1412 H LYS A 476 1.583 5.173 -5.595 1.00 0.00 H ATOM 1413 N SER A 477 -1.810 2.378 -6.043 1.00 13.81 N ATOM 1414 CA SER A 477 -3.105 1.986 -5.492 1.00 15.17 C ATOM 1415 C SER A 477 -3.207 0.948 -4.361 1.00 19.13 C ATOM 1416 O SER A 477 -4.087 0.083 -4.419 1.00 19.08 O ATOM 1417 CB SER A 477 -4.104 1.699 -6.616 1.00 19.83 C ATOM 1418 OG SER A 477 -4.343 2.877 -7.369 1.00 34.18 O ATOM 1419 HG SER A 477 -3.492 3.194 -7.763 1.00 0.00 H ATOM 1420 H SER A 477 -1.594 2.066 -7.011 1.00 0.00 H ATOM 1421 N CYS A 478 -2.396 1.076 -3.306 1.00 14.78 N ATOM 1422 CA CYS A 478 -2.550 0.194 -2.148 1.00 14.32 C ATOM 1423 C CYS A 478 -3.476 0.877 -1.139 1.00 16.21 C ATOM 1424 O CYS A 478 -3.582 2.107 -1.133 1.00 15.18 O ATOM 1425 CB CYS A 478 -1.212 -0.193 -1.524 1.00 14.83 C ATOM 1426 SG CYS A 478 -0.172 1.212 -1.083 1.00 19.10 S ATOM 1427 H CYS A 478 -1.654 1.804 -3.308 1.00 0.00 H ATOM 1428 N THR A 479 -4.147 0.072 -0.303 1.00 11.26 N ATOM 1429 CA THR A 479 -5.125 0.519 0.694 1.00 11.75 C ATOM 1430 C THR A 479 -4.675 0.151 2.100 1.00 16.06 C ATOM 1431 O THR A 479 -4.301 -0.997 2.343 1.00 15.63 O ATOM 1432 CB THR A 479 -6.509 -0.075 0.358 1.00 12.69 C ATOM 1433 OG1 THR A 479 -6.789 0.250 -0.988 1.00 11.76 O ATOM 1434 CG2 THR A 479 -7.629 0.460 1.243 1.00 11.15 C ATOM 1435 HG1 THR A 479 -7.674 -0.117 -1.238 1.00 0.00 H ATOM 1436 H THR A 479 -3.959 -0.949 -0.366 1.00 0.00 H ATOM 1437 N VAL A 480 -4.673 1.142 3.011 1.00 12.48 N ATOM 1438 CA VAL A 480 -4.294 0.922 4.409 1.00 12.17 C ATOM 1439 C VAL A 480 -5.340 1.584 5.327 1.00 14.83 C ATOM 1440 O VAL A 480 -5.962 2.590 4.954 1.00 12.42 O ATOM 1441 CB VAL A 480 -2.813 1.300 4.789 1.00 15.69 C ATOM 1442 CG1 VAL A 480 -1.779 0.689 3.824 1.00 15.22 C ATOM 1443 CG2 VAL A 480 -2.611 2.815 4.919 1.00 14.97 C ATOM 1444 H VAL A 480 -4.951 2.099 2.712 1.00 0.00 H ATOM 1445 N SER A 481 -5.523 0.999 6.520 1.00 11.58 N ATOM 1446 CA SER A 481 -6.435 1.464 7.548 1.00 11.03 C ATOM 1447 C SER A 481 -5.664 1.753 8.828 1.00 14.29 C ATOM 1448 O SER A 481 -4.851 0.953 9.256 1.00 13.69 O ATOM 1449 CB SER A 481 -7.546 0.448 7.790 1.00 12.69 C ATOM 1450 OG SER A 481 -8.492 0.537 6.739 1.00 18.03 O ATOM 1451 HG SER A 481 -8.045 0.344 5.877 1.00 0.00 H ATOM 1452 H SER A 481 -4.967 0.144 6.724 1.00 0.00 H ATOM 1453 N ILE A 482 -5.900 2.916 9.411 1.00 12.38 N ATOM 1454 CA ILE A 482 -5.232 3.356 10.638 1.00 10.50 C ATOM 1455 C ILE A 482 -6.173 3.175 11.843 1.00 11.67 C ATOM 1456 O ILE A 482 -7.360 3.453 11.746 1.00 8.59 O ATOM 1457 CB ILE A 482 -4.666 4.813 10.492 1.00 12.42 C ATOM 1458 CG1 ILE A 482 -3.750 5.216 11.696 1.00 12.58 C ATOM 1459 CG2 ILE A 482 -5.770 5.855 10.232 1.00 9.67 C ATOM 1460 CD1 ILE A 482 -2.562 6.129 11.309 1.00 15.28 C ATOM 1461 H ILE A 482 -6.597 3.553 8.975 1.00 0.00 H ATOM 1462 N ASN A 483 -5.627 2.690 12.956 1.00 9.42 N ATOM 1463 CA ASN A 483 -6.352 2.506 14.210 1.00 9.77 C ATOM 1464 C ASN A 483 -5.563 3.271 15.279 1.00 12.32 C ATOM 1465 O ASN A 483 -4.438 2.901 15.583 1.00 11.19 O ATOM 1466 CB ASN A 483 -6.467 0.993 14.557 1.00 8.91 C ATOM 1467 CG ASN A 483 -7.133 0.698 15.880 1.00 21.06 C ATOM 1468 OD1 ASN A 483 -7.786 1.554 16.479 1.00 14.53 O ATOM 1469 ND2 ASN A 483 -6.989 -0.529 16.371 1.00 11.55 N ATOM 1470 HD22 ASN A 483 -6.433 -1.236 15.849 1.00 0.00 H ATOM 1471 HD21 ASN A 483 -7.432 -0.782 17.277 1.00 0.00 H ATOM 1472 H ASN A 483 -4.621 2.426 12.931 1.00 0.00 H ATOM 1473 N PHE A 484 -6.119 4.370 15.793 1.00 9.94 N ATOM 1474 CA PHE A 484 -5.430 5.166 16.814 1.00 8.98 C ATOM 1475 C PHE A 484 -5.663 4.637 18.234 1.00 12.41 C ATOM 1476 O PHE A 484 -5.032 5.103 19.175 1.00 12.14 O ATOM 1477 CB PHE A 484 -5.803 6.644 16.700 1.00 10.06 C ATOM 1478 CG PHE A 484 -5.515 7.259 15.351 1.00 10.99 C ATOM 1479 CD1 PHE A 484 -6.535 7.429 14.412 1.00 10.86 C ATOM 1480 CD2 PHE A 484 -4.221 7.650 15.007 1.00 10.08 C ATOM 1481 CE1 PHE A 484 -6.276 8.051 13.191 1.00 10.92 C ATOM 1482 CE2 PHE A 484 -3.959 8.242 13.774 1.00 11.61 C ATOM 1483 CZ PHE A 484 -4.981 8.440 12.871 1.00 9.51 C ATOM 1484 H PHE A 484 -7.059 4.668 15.463 1.00 0.00 H ATOM 1485 N GLY A 485 -6.531 3.644 18.365 1.00 9.41 N ATOM 1486 CA GLY A 485 -6.870 3.056 19.652 1.00 9.38 C ATOM 1487 C GLY A 485 -8.268 3.452 20.104 1.00 14.11 C ATOM 1488 O GLY A 485 -9.012 4.054 19.325 1.00 12.07 O ATOM 1489 H GLY A 485 -6.990 3.269 17.510 1.00 0.00 H ATOM 1490 N PRO A 486 -8.673 3.154 21.358 1.00 14.00 N ATOM 1491 CA PRO A 486 -7.901 2.511 22.442 1.00 13.96 C ATOM 1492 C PRO A 486 -7.675 1.010 22.289 1.00 19.87 C ATOM 1493 O PRO A 486 -6.721 0.468 22.856 1.00 21.00 O ATOM 1494 CB PRO A 486 -8.712 2.871 23.698 1.00 15.57 C ATOM 1495 CG PRO A 486 -10.134 2.949 23.207 1.00 19.81 C ATOM 1496 CD PRO A 486 -10.033 3.535 21.814 1.00 15.93 C ATOM 1497 N CYS A 487 -8.500 0.361 21.474 1.00 18.40 N ATOM 1498 CA CYS A 487 -8.480 -1.084 21.234 1.00 19.93 C ATOM 1499 C CYS A 487 -7.596 -1.491 20.046 1.00 19.89 C ATOM 1500 O CYS A 487 -7.978 -1.316 18.887 1.00 19.05 O ATOM 1501 CB CYS A 487 -9.909 -1.614 21.095 1.00 22.29 C ATOM 1502 SG CYS A 487 -10.993 -1.181 22.491 1.00 27.80 S ATOM 1503 H CYS A 487 -9.215 0.922 20.968 1.00 0.00 H ATOM 1504 N PHE A 488 -6.410 -2.048 20.343 1.00 13.23 N ATOM 1505 CA PHE A 488 -5.493 -2.541 19.321 1.00 10.51 C ATOM 1506 C PHE A 488 -5.672 -4.055 19.096 1.00 12.89 C ATOM 1507 O PHE A 488 -6.073 -4.765 20.007 1.00 11.48 O ATOM 1508 CB PHE A 488 -4.038 -2.185 19.688 1.00 10.85 C ATOM 1509 CG PHE A 488 -3.790 -0.694 19.784 1.00 11.36 C ATOM 1510 CD1 PHE A 488 -3.371 -0.119 20.979 1.00 12.91 C ATOM 1511 CD2 PHE A 488 -4.013 0.140 18.685 1.00 11.45 C ATOM 1512 CE1 PHE A 488 -3.177 1.265 21.078 1.00 13.65 C ATOM 1513 CE2 PHE A 488 -3.808 1.520 18.781 1.00 14.14 C ATOM 1514 CZ PHE A 488 -3.384 2.074 19.976 1.00 12.45 C ATOM 1515 H PHE A 488 -6.134 -2.131 21.342 1.00 0.00 H ATOM 1516 N LYS A 489 -5.395 -4.537 17.877 1.00 10.04 N ATOM 1517 CA LYS A 489 -5.462 -5.966 17.551 1.00 9.18 C ATOM 1518 C LYS A 489 -4.332 -6.730 18.277 1.00 14.78 C ATOM 1519 O LYS A 489 -4.561 -7.826 18.798 1.00 15.07 O ATOM 1520 CB LYS A 489 -5.378 -6.196 16.033 1.00 10.71 C ATOM 1521 CG LYS A 489 -6.679 -5.908 15.292 1.00 15.79 C ATOM 1522 CD LYS A 489 -6.499 -6.076 13.799 1.00 20.44 C ATOM 1523 CE LYS A 489 -7.653 -5.501 13.012 1.00 29.50 C ATOM 1524 NZ LYS A 489 -7.564 -4.018 12.868 1.00 27.83 N ATOM 1525 HZ1 LYS A 489 -7.568 -3.579 13.811 1.00 0.00 H ATOM 1526 HZ2 LYS A 489 -6.683 -3.771 12.373 1.00 0.00 H ATOM 1527 HZ3 LYS A 489 -8.379 -3.675 12.321 1.00 0.00 H ATOM 1528 H LYS A 489 -5.120 -3.869 17.129 1.00 0.00 H ATOM 1529 N TYR A 490 -3.123 -6.128 18.320 1.00 11.25 N ATOM 1530 CA TYR A 490 -1.933 -6.699 18.945 1.00 11.06 C ATOM 1531 C TYR A 490 -1.377 -5.682 19.948 1.00 14.84 C ATOM 1532 O TYR A 490 -0.348 -5.086 19.655 1.00 14.88 O ATOM 1533 CB TYR A 490 -0.857 -7.004 17.877 1.00 11.89 C ATOM 1534 CG TYR A 490 -1.217 -8.010 16.795 1.00 12.58 C ATOM 1535 CD1 TYR A 490 -1.801 -7.601 15.600 1.00 13.49 C ATOM 1536 CD2 TYR A 490 -0.878 -9.359 16.929 1.00 12.91 C ATOM 1537 CE1 TYR A 490 -2.086 -8.517 14.582 1.00 13.51 C ATOM 1538 CE2 TYR A 490 -1.114 -10.273 15.899 1.00 12.62 C ATOM 1539 CZ TYR A 490 -1.734 -9.851 14.735 1.00 16.98 C ATOM 1540 OH TYR A 490 -1.952 -10.748 13.722 1.00 17.54 O ATOM 1541 HH TYR A 490 -1.085 -11.117 13.417 1.00 0.00 H ATOM 1542 H TYR A 490 -3.034 -5.192 17.877 1.00 0.00 H ATOM 1543 N PRO A 491 -1.998 -5.433 21.128 1.00 12.71 N ATOM 1544 CA PRO A 491 -1.408 -4.442 22.041 1.00 13.21 C ATOM 1545 C PRO A 491 -0.064 -4.908 22.638 1.00 16.62 C ATOM 1546 O PRO A 491 0.013 -5.997 23.196 1.00 14.65 O ATOM 1547 CB PRO A 491 -2.507 -4.199 23.083 1.00 14.75 C ATOM 1548 CG PRO A 491 -3.338 -5.398 23.046 1.00 18.55 C ATOM 1549 CD PRO A 491 -3.206 -6.051 21.712 1.00 13.72 C ATOM 1550 N PRO A 492 1.021 -4.114 22.476 1.00 14.22 N ATOM 1551 CA PRO A 492 2.327 -4.518 23.046 1.00 14.49 C ATOM 1552 C PRO A 492 2.341 -4.674 24.564 1.00 17.80 C ATOM 1553 O PRO A 492 1.781 -3.858 25.302 1.00 16.58 O ATOM 1554 CB PRO A 492 3.284 -3.414 22.596 1.00 16.86 C ATOM 1555 CG PRO A 492 2.571 -2.694 21.508 1.00 20.80 C ATOM 1556 CD PRO A 492 1.111 -2.808 21.799 1.00 15.84 C ATOM 1557 N LYS A 493 2.983 -5.752 25.024 1.00 14.48 N ATOM 1558 CA LYS A 493 3.109 -6.062 26.446 1.00 12.80 C ATOM 1559 C LYS A 493 4.505 -5.755 26.940 1.00 14.75 C ATOM 1560 O LYS A 493 4.738 -5.788 28.147 1.00 14.81 O ATOM 1561 CB LYS A 493 2.756 -7.546 26.708 1.00 14.60 C ATOM 1562 CG LYS A 493 1.323 -7.939 26.298 1.00 17.57 C ATOM 1563 CD LYS A 493 0.254 -7.130 27.034 1.00 23.66 C ATOM 1564 CE LYS A 493 -1.156 -7.393 26.542 1.00 30.86 C ATOM 1565 NZ LYS A 493 -1.689 -8.688 27.042 1.00 27.39 N ATOM 1566 HZ1 LYS A 493 -1.080 -9.463 26.711 1.00 0.00 H ATOM 1567 HZ2 LYS A 493 -1.704 -8.677 28.082 1.00 0.00 H ATOM 1568 HZ3 LYS A 493 -2.655 -8.827 26.681 1.00 0.00 H ATOM 1569 H LYS A 493 3.414 -6.402 24.336 1.00 0.00 H ATOM 1570 N ASP A 494 5.427 -5.423 26.014 1.00 10.99 N ATOM 1571 CA ASP A 494 6.841 -5.166 26.295 1.00 10.64 C ATOM 1572 C ASP A 494 7.218 -3.763 26.776 1.00 16.88 C ATOM 1573 O ASP A 494 8.297 -3.579 27.352 1.00 18.01 O ATOM 1574 CB ASP A 494 7.702 -5.559 25.081 1.00 11.71 C ATOM 1575 CG ASP A 494 7.337 -4.937 23.746 1.00 15.15 C ATOM 1576 OD1 ASP A 494 7.990 -5.276 22.739 1.00 19.04 O ATOM 1577 OD2 ASP A 494 6.424 -4.109 23.711 1.00 15.90 O ATOM 1578 H ASP A 494 5.110 -5.344 25.027 1.00 0.00 H ATOM 1579 N LEU A 495 6.374 -2.777 26.487 1.00 13.61 N ATOM 1580 CA LEU A 495 6.617 -1.373 26.793 1.00 14.26 C ATOM 1581 C LEU A 495 5.331 -0.700 27.177 1.00 18.15 C ATOM 1582 O LEU A 495 4.264 -1.055 26.669 1.00 17.38 O ATOM 1583 CB LEU A 495 7.191 -0.632 25.543 1.00 14.67 C ATOM 1584 CG LEU A 495 8.518 -1.132 24.932 1.00 19.87 C ATOM 1585 CD1 LEU A 495 8.757 -0.516 23.581 1.00 19.84 C ATOM 1586 CD2 LEU A 495 9.708 -0.866 25.857 1.00 21.85 C ATOM 1587 H LEU A 495 5.482 -3.024 26.012 1.00 0.00 H ATOM 1588 N THR A 496 5.445 0.327 28.015 1.00 15.90 N ATOM 1589 CA THR A 496 4.318 1.155 28.451 1.00 15.87 C ATOM 1590 C THR A 496 4.093 2.247 27.384 1.00 18.16 C ATOM 1591 O THR A 496 5.063 2.753 26.821 1.00 16.76 O ATOM 1592 CB THR A 496 4.597 1.761 29.835 1.00 20.26 C ATOM 1593 OG1 THR A 496 5.590 2.772 29.697 1.00 23.54 O ATOM 1594 CG2 THR A 496 5.068 0.723 30.853 1.00 16.02 C ATOM 1595 HG1 THR A 496 5.261 3.474 29.081 1.00 0.00 H ATOM 1596 H THR A 496 6.391 0.556 28.382 1.00 0.00 H ATOM 1597 N TYR A 497 2.815 2.589 27.107 1.00 14.34 N ATOM 1598 CA TYR A 497 2.424 3.613 26.123 1.00 13.70 C ATOM 1599 C TYR A 497 0.985 4.048 26.404 1.00 17.22 C ATOM 1600 O TYR A 497 0.234 3.339 27.068 1.00 16.13 O ATOM 1601 CB TYR A 497 2.486 3.030 24.664 1.00 13.18 C ATOM 1602 CG TYR A 497 1.562 1.840 24.477 1.00 15.23 C ATOM 1603 CD1 TYR A 497 0.207 2.019 24.196 1.00 17.90 C ATOM 1604 CD2 TYR A 497 2.014 0.543 24.695 1.00 15.80 C ATOM 1605 CE1 TYR A 497 -0.666 0.937 24.113 1.00 19.71 C ATOM 1606 CE2 TYR A 497 1.149 -0.548 24.625 1.00 17.27 C ATOM 1607 CZ TYR A 497 -0.188 -0.348 24.327 1.00 26.72 C ATOM 1608 OH TYR A 497 -1.039 -1.421 24.247 1.00 29.88 O ATOM 1609 HH TYR A 497 -1.950 -1.102 24.027 1.00 0.00 H ATOM 1610 H TYR A 497 2.058 2.097 27.623 1.00 0.00 H ATOM 1611 N ARG A 498 0.581 5.157 25.808 1.00 14.37 N ATOM 1612 CA ARG A 498 -0.812 5.565 25.803 1.00 13.70 C ATOM 1613 C ARG A 498 -1.292 5.358 24.331 1.00 16.24 C ATOM 1614 O ARG A 498 -0.475 5.547 23.410 1.00 16.28 O ATOM 1615 CB ARG A 498 -0.951 7.046 26.189 1.00 14.15 C ATOM 1616 CG ARG A 498 -0.711 7.352 27.665 1.00 21.90 C ATOM 1617 CD ARG A 498 -1.749 8.320 28.180 1.00 23.94 C ATOM 1618 NE ARG A 498 -1.289 9.703 28.141 1.00 31.64 N ATOM 1619 CZ ARG A 498 -2.083 10.769 28.187 1.00 42.59 C ATOM 1620 NH1 ARG A 498 -3.404 10.624 28.220 1.00 23.99 N ATOM 1621 NH2 ARG A 498 -1.565 11.989 28.161 1.00 35.62 N ATOM 1622 HE ARG A 498 -0.265 9.868 28.072 1.00 0.00 H ATOM 1623 HH12 ARG A 498 -4.018 11.462 28.256 1.00 0.00 H ATOM 1624 HH11 ARG A 498 -3.823 9.672 28.210 1.00 0.00 H ATOM 1625 HH22 ARG A 498 -2.189 12.820 28.197 1.00 0.00 H ATOM 1626 HH21 ARG A 498 -0.534 12.115 28.104 1.00 0.00 H ATOM 1627 H ARG A 498 1.283 5.756 25.328 1.00 0.00 H ATOM 1628 N PRO A 499 -2.572 4.992 24.052 1.00 9.94 N ATOM 1629 CA PRO A 499 -3.006 4.950 22.634 1.00 9.55 C ATOM 1630 C PRO A 499 -3.092 6.382 22.073 1.00 14.27 C ATOM 1631 O PRO A 499 -3.394 7.300 22.847 1.00 14.06 O ATOM 1632 CB PRO A 499 -4.407 4.326 22.705 1.00 10.36 C ATOM 1633 CG PRO A 499 -4.932 4.705 24.087 1.00 13.97 C ATOM 1634 CD PRO A 499 -3.703 4.757 24.986 1.00 10.13 C ATOM 1635 N MET A 500 -2.851 6.591 20.754 1.00 10.92 N ATOM 1636 CA MET A 500 -2.983 7.945 20.149 1.00 10.94 C ATOM 1637 C MET A 500 -4.356 8.558 20.412 1.00 16.01 C ATOM 1638 O MET A 500 -4.469 9.778 20.494 1.00 16.49 O ATOM 1639 CB MET A 500 -2.750 7.940 18.617 1.00 12.33 C ATOM 1640 CG MET A 500 -1.293 7.991 18.208 1.00 14.67 C ATOM 1641 SD MET A 500 -0.341 9.428 18.787 1.00 16.07 S ATOM 1642 CE MET A 500 -1.442 10.814 18.287 1.00 11.84 C ATOM 1643 H MET A 500 -2.569 5.790 20.154 1.00 0.00 H ATOM 1644 N SER A 501 -5.398 7.711 20.512 1.00 12.70 N ATOM 1645 CA SER A 501 -6.781 8.095 20.793 1.00 13.25 C ATOM 1646 C SER A 501 -6.905 8.905 22.111 1.00 18.43 C ATOM 1647 O SER A 501 -7.843 9.698 22.252 1.00 18.18 O ATOM 1648 CB SER A 501 -7.670 6.854 20.853 1.00 16.12 C ATOM 1649 OG SER A 501 -7.250 5.964 21.878 1.00 21.42 O ATOM 1650 HG SER A 501 -7.294 6.425 22.753 1.00 0.00 H ATOM 1651 H SER A 501 -5.203 6.698 20.378 1.00 0.00 H ATOM 1652 N ASP A 502 -5.941 8.731 23.058 1.00 15.38 N ATOM 1653 CA ASP A 502 -5.919 9.511 24.305 1.00 15.59 C ATOM 1654 C ASP A 502 -5.755 11.012 24.022 1.00 18.72 C ATOM 1655 O ASP A 502 -6.103 11.811 24.874 1.00 17.24 O ATOM 1656 CB ASP A 502 -4.821 9.021 25.267 1.00 16.44 C ATOM 1657 CG ASP A 502 -5.255 7.901 26.191 1.00 15.98 C ATOM 1658 OD1 ASP A 502 -6.416 7.449 26.083 1.00 17.16 O ATOM 1659 OD2 ASP A 502 -4.431 7.450 26.987 1.00 19.25 O ATOM 1660 H ASP A 502 -5.196 8.024 22.894 1.00 0.00 H ATOM 1661 N MET A 503 -5.296 11.385 22.800 1.00 16.69 N ATOM 1662 CA MET A 503 -5.140 12.782 22.361 1.00 17.03 C ATOM 1663 C MET A 503 -6.489 13.430 22.033 1.00 20.42 C ATOM 1664 O MET A 503 -6.601 14.660 22.042 1.00 19.08 O ATOM 1665 CB MET A 503 -4.232 12.877 21.125 1.00 19.97 C ATOM 1666 CG MET A 503 -2.753 12.725 21.421 1.00 25.13 C ATOM 1667 SD MET A 503 -2.144 13.595 22.894 1.00 31.54 S ATOM 1668 CE MET A 503 -2.349 15.254 22.430 1.00 28.72 C ATOM 1669 H MET A 503 -5.037 10.634 22.129 1.00 0.00 H ATOM 1670 N GLY A 504 -7.471 12.595 21.690 1.00 17.05 N ATOM 1671 CA GLY A 504 -8.811 13.018 21.315 1.00 29.10 C ATOM 1672 C GLY A 504 -9.596 13.548 22.496 1.00 50.17 C ATOM 1673 O GLY A 504 -10.140 14.648 22.428 1.00 20.89 O ATOM 1674 H GLY A 504 -7.265 11.576 21.691 1.00 0.00 H TER 1675 GLY A 504 HETATM 1676 O HOH 1 -20.205 9.838 1.234 1.00 14.08 O HETATM 1677 O HOH 2 -0.681 -8.313 22.436 1.00 12.02 O HETATM 1678 O HOH 3 -3.232 18.951 15.280 1.00 12.27 O HETATM 1679 O HOH 4 -0.482 -12.830 13.560 1.00 20.14 O HETATM 1680 O HOH 5 -14.184 10.267 1.195 1.00 15.27 O HETATM 1681 O HOH 6 3.694 -7.720 23.394 1.00 15.95 O HETATM 1682 O HOH 7 1.958 -11.441 18.088 1.00 13.49 O HETATM 1683 O HOH 8 -7.065 11.041 -6.680 1.00 26.41 O HETATM 1684 O HOH 9 5.991 -10.556 12.905 1.00 20.82 O HETATM 1685 O HOH 10 -6.282 13.486 -0.191 1.00 16.80 O HETATM 1686 O HOH 11 8.142 17.044 -3.763 1.00 12.47 O HETATM 1687 O HOH 12 -9.126 16.475 20.460 1.00 23.30 O HETATM 1688 O HOH 13 9.000 -7.861 22.817 1.00 27.98 O HETATM 1689 O HOH 14 16.858 -2.617 18.690 1.00 18.29 O HETATM 1690 O HOH 15 12.972 -2.619 20.690 1.00 16.44 O HETATM 1691 O HOH 16 10.775 18.711 2.475 1.00 23.06 O HETATM 1692 O HOH 17 3.061 -12.000 7.330 1.00 30.21 O HETATM 1693 O HOH 18 15.415 15.358 1.400 1.00 12.34 O HETATM 1694 O HOH 19 2.275 19.799 24.489 1.00 24.49 O HETATM 1695 O HOH 20 -15.515 11.659 9.156 1.00 29.54 O HETATM 1696 O HOH 21 15.002 17.811 0.421 1.00 12.06 O HETATM 1697 O HOH 22 6.139 -4.646 30.339 1.00 31.62 O HETATM 1698 O HOH 23 -6.990 -5.620 22.571 1.00 22.30 O HETATM 1699 O HOH 24 -7.168 -8.850 19.355 1.00 17.72 O HETATM 1700 O HOH 25 2.851 -12.852 15.561 1.00 30.56 O HETATM 1701 O HOH 26 -10.201 16.912 12.354 1.00 32.01 O HETATM 1702 O HOH 27 -13.159 12.141 4.297 1.00 13.03 O HETATM 1703 O HOH 28 3.885 -12.399 10.675 1.00 20.85 O HETATM 1704 O HOH 29 -8.447 18.036 9.214 1.00 22.50 O HETATM 1705 O HOH 30 7.932 -8.684 20.665 1.00 23.13 O HETATM 1706 O HOH 31 18.146 -1.253 12.358 1.00 27.42 O HETATM 1707 O HOH 32 15.578 17.875 5.519 1.00 17.63 O HETATM 1708 O HOH 33 6.567 21.657 28.811 1.00 22.78 O HETATM 1709 O HOH 34 3.901 20.073 5.022 1.00 24.94 O HETATM 1710 O HOH 35 -13.981 13.890 15.488 1.00 29.42 O HETATM 1711 O HOH 36 8.720 -10.873 13.305 1.00 20.95 O HETATM 1712 O HOH 37 1.991 15.183 24.004 1.00 12.06 O HETATM 1713 O HOH 38 11.149 -9.432 19.379 1.00 28.30 O HETATM 1714 O HOH 39 -12.459 7.289 -0.840 1.00 19.26 O HETATM 1715 O HOH 40 -12.207 9.882 -1.932 1.00 24.57 O HETATM 1716 O HOH 41 -14.678 17.318 16.766 1.00 28.83 O HETATM 1717 O HOH 42 7.243 -12.793 9.791 1.00 33.92 O HETATM 1718 O HOH 43 6.483 20.918 1.787 1.00 19.47 O HETATM 1719 O HOH 44 -4.521 19.129 10.332 1.00 22.28 O HETATM 1720 O HOH 45 14.085 19.502 4.476 1.00 24.94 O HETATM 1721 O HOH 46 -1.917 4.409 -8.923 1.00 3.10 O HETATM 1722 O HOH 47 8.744 14.059 5.568 1.00 14.25 O HETATM 1723 O HOH 48 16.646 -3.220 3.501 1.00 12.46 O HETATM 1724 O HOH 49 8.103 13.501 3.093 1.00 7.88 O HETATM 1725 O HOH 50 15.278 -4.092 6.051 1.00 13.44 O HETATM 1726 O HOH 51 5.331 -3.228 -1.046 1.00 10.55 O HETATM 1727 O HOH 52 11.613 7.804 2.336 1.00 11.05 O HETATM 1728 O HOH 53 1.713 -5.186 15.202 1.00 10.45 O HETATM 1729 O HOH 54 0.281 8.445 -3.614 1.00 8.87 O HETATM 1730 O HOH 55 17.609 5.388 7.747 1.00 16.85 O HETATM 1731 O HOH 56 -15.979 5.346 5.416 1.00 20.72 O HETATM 1732 O HOH 57 -10.010 8.617 18.516 1.00 17.44 O HETATM 1733 O HOH 58 19.258 6.087 15.414 1.00 18.21 O HETATM 1734 O HOH 59 0.814 0.467 28.394 1.00 26.38 O HETATM 1735 O HOH 60 -0.725 11.767 -8.742 1.00 15.46 O HETATM 1736 O HOH 61 -8.246 6.555 24.267 1.00 15.87 O HETATM 1737 O HOH 62 19.341 7.549 8.564 1.00 22.34 O HETATM 1738 O HOH 63 -15.656 5.911 2.073 1.00 18.25 O HETATM 1739 O HOH 64 20.839 -0.970 9.761 1.00 20.74 O HETATM 1740 O HOH 65 17.619 11.510 13.678 1.00 23.84 O HETATM 1741 O HOH 66 -1.529 0.709 -8.658 1.00 24.68 O HETATM 1742 O HOH 67 2.540 8.364 27.502 1.00 15.76 O HETATM 1743 O HOH 68 -12.975 6.947 15.171 1.00 17.20 O HETATM 1744 O HOH 69 -18.318 8.300 8.007 1.00 27.44 O HETATM 1745 O HOH 70 3.989 19.694 2.295 1.00 16.12 O HETATM 1746 O HOH 71 -10.164 1.127 18.100 1.00 27.74 O HETATM 1747 O HOH 72 -8.869 4.866 16.025 1.00 19.58 O HETATM 1748 O HOH 73 3.049 -4.999 -3.659 1.00 34.05 O HETATM 1749 O HOH 74 0.464 19.167 -1.981 1.00 27.33 O HETATM 1750 O HOH 75 19.551 0.851 0.479 1.00 46.62 O HETATM 1751 O HOH 76 14.842 -7.314 3.952 1.00 22.17 O HETATM 1752 O HOH 77 -5.245 -0.882 11.952 1.00 18.45 O HETATM 1753 O HOH 78 9.539 -7.631 1.156 1.00 21.93 O HETATM 1754 O HOH 79 16.868 17.770 18.098 1.00 24.30 O HETATM 1755 O HOH 80 -9.312 -0.031 -1.659 1.00 21.71 O HETATM 1756 O HOH 81 -7.711 -0.657 11.277 1.00 32.29 O HETATM 1757 O HOH 82 17.756 9.273 14.849 1.00 21.96 O HETATM 1758 O HOH 83 -10.179 7.429 15.851 1.00 17.26 O HETATM 1759 O HOH 84 1.752 10.930 28.299 1.00 31.92 O HETATM 1760 O HOH 85 21.950 -0.830 5.829 1.00 21.33 O HETATM 1761 O HOH 86 7.401 -1.034 -7.386 1.00 29.13 O HETATM 1762 O HOH 87 2.300 -2.610 27.635 1.00 25.94 O HETATM 1763 O HOH 88 -12.475 2.716 7.196 1.00 30.31 O HETATM 1764 O HOH 89 3.496 -6.901 -1.484 1.00 24.21 O HETATM 1765 O HOH 90 -5.702 -2.545 23.169 1.00 24.95 O HETATM 1766 O HOH 91 -9.239 1.611 11.234 1.00 20.45 O HETATM 1767 O HOH 92 -0.736 19.107 0.257 1.00 23.59 O HETATM 1768 O HOH 93 19.060 -0.886 2.778 1.00 39.66 O HETATM 1769 O HOH 94 21.119 7.949 16.576 1.00 32.48 O HETATM 1770 O HOH 95 -11.297 3.660 1.043 1.00 26.90 O HETATM 1771 O HOH 96 -11.356 1.434 9.707 1.00 36.01 O HETATM 1772 O HOH 97 -5.062 1.399 -10.059 1.00 34.93 O HETATM 1773 O HOH 98 -5.613 -1.174 -2.891 1.00 12.01 O HETATM 1774 O HOH 99 0.312 -3.797 17.177 1.00 13.26 O HETATM 1775 O HOH 100 9.225 16.563 21.583 1.00 23.84 O HETATM 1776 O HOH 101 0.831 15.680 -8.373 1.00 40.57 O HETATM 1777 O HOH 102 -5.374 -1.847 -7.974 1.00 47.83 O HETATM 1778 O HOH 103 -5.712 -2.339 14.287 1.00 15.47 O HETATM 1779 O HOH 104 -10.448 5.943 0.047 1.00 25.70 O HETATM 1780 O HOH 105 -10.711 6.788 -7.275 1.00 30.24 O HETATM 1781 O HOH 106 14.722 10.702 -8.988 1.00 17.76 O HETATM 1782 O HOH 107 10.202 16.920 -5.450 1.00 14.22 O HETATM 1783 O HOH 108 23.143 6.364 -4.886 1.00 27.71 O HETATM 1784 O HOH 109 10.456 3.786 -14.849 1.00 12.09 O HETATM 1785 O HOH 110 10.154 15.682 -12.188 1.00 20.71 O HETATM 1786 O HOH 111 11.873 8.680 -20.576 1.00 32.14 O HETATM 1787 O HOH 112 13.269 8.992 0.119 1.00 16.38 O HETATM 1788 O HOH 113 8.537 2.150 -20.822 1.00 23.95 O HETATM 1789 O HOH 114 9.032 0.864 -8.771 1.00 14.09 O HETATM 1790 O HOH 115 12.092 0.955 -7.539 1.00 4.81 O HETATM 1791 O HOH 116 8.702 10.849 -12.596 1.00 10.33 O HETATM 1792 O HOH 117 7.349 7.743 -5.795 1.00 12.19 O HETATM 1793 O HOH 118 5.351 9.002 -13.895 1.00 19.07 O HETATM 1794 O HOH 119 11.207 6.990 -2.949 1.00 9.70 O HETATM 1795 O HOH 120 3.756 10.034 -9.951 1.00 20.36 O HETATM 1796 O HOH 121 4.487 5.913 -11.052 1.00 21.42 O HETATM 1797 O HOH 122 15.353 2.169 -2.243 1.00 19.94 O HETATM 1798 N GLU A 123 9.768 4.541 -21.975 1.00 0.24 N HETATM 1799 CA GLU A 123 9.489 5.852 -21.383 1.00 0.07 C HETATM 1800 C GLU A 123 9.536 5.804 -19.865 1.00 0.23 C HETATM 1801 O GLU A 123 9.019 4.864 -19.255 1.00 -0.39 O HETATM 1802 N GLU A 123 10.177 6.806 -19.254 1.00 -0.26 N HETATM 1803 CA GLU A 123 10.316 6.821 -17.806 1.00 0.14 C HETATM 1804 C GLU A 123 9.002 7.041 -17.076 1.00 0.21 C HETATM 1805 O GLU A 123 8.203 7.898 -17.466 1.00 -0.39 O HETATM 1806 N GLU A 123 8.795 6.253 -16.003 1.00 -0.26 N HETATM 1807 CA GLU A 123 7.642 6.352 -15.108 1.00 0.13 C HETATM 1808 C GLU A 123 8.167 6.374 -13.692 1.00 0.20 C HETATM 1809 O GLU A 123 9.130 5.652 -13.383 1.00 -0.39 O HETATM 1810 N GLU A 123 7.550 7.205 -12.834 1.00 -0.26 N HETATM 1811 CA GLU A 123 7.974 7.376 -11.448 1.00 0.13 C HETATM 1812 C GLU A 123 8.006 6.046 -10.682 1.00 0.20 C HETATM 1813 O GLU A 123 7.051 5.272 -10.747 1.00 -0.39 O HETATM 1814 N GLU A 123 9.154 5.759 -10.051 1.00 -0.26 N HETATM 1815 CA GLU A 123 9.420 4.513 -9.328 1.00 0.13 C HETATM 1816 C GLU A 123 9.195 4.667 -7.838 1.00 0.20 C HETATM 1817 O GLU A 123 9.199 5.774 -7.317 1.00 -0.39 O HETATM 1818 N GLU A 123 9.036 3.547 -7.143 1.00 -0.26 N HETATM 1819 CA GLU A 123 8.879 3.470 -5.681 1.00 0.13 C HETATM 1820 C GLU A 123 10.136 4.104 -4.976 1.00 0.20 C HETATM 1821 O GLU A 123 10.010 4.827 -3.972 1.00 -0.39 O HETATM 1822 N GLU A 123 11.329 3.851 -5.532 1.00 -0.26 N HETATM 1823 CA GLU A 123 12.597 4.362 -5.003 1.00 0.15 C HETATM 1824 C GLU A 123 13.020 5.714 -5.619 1.00 0.21 C HETATM 1825 O GLU A 123 14.195 6.062 -5.509 1.00 -0.39 O HETATM 1826 N GLU A 123 12.069 6.475 -6.246 1.00 -0.26 N HETATM 1827 CA GLU A 123 12.293 7.777 -6.909 1.00 0.13 C HETATM 1828 C GLU A 123 13.145 8.827 -6.135 1.00 0.20 C HETATM 1829 O GLU A 123 13.979 9.509 -6.734 1.00 -0.39 O HETATM 1830 N GLU A 123 12.885 8.980 -4.829 1.00 -0.26 N HETATM 1831 CA GLU A 123 13.513 9.999 -3.978 1.00 0.14 C HETATM 1832 C GLU A 123 14.725 9.476 -3.203 1.00 0.21 C HETATM 1833 O GLU A 123 15.414 10.261 -2.555 1.00 -0.39 O HETATM 1834 N GLU A 123 14.980 8.162 -3.254 1.00 -0.26 N HETATM 1835 CA GLU A 123 16.045 7.531 -2.471 1.00 0.14 C HETATM 1836 C GLU A 123 17.454 7.762 -2.943 1.00 0.21 C HETATM 1837 O GLU A 123 17.759 7.559 -4.111 1.00 -0.39 O HETATM 1838 N GLU A 123 18.320 8.125 -1.996 1.00 -0.26 N HETATM 1839 CA GLU A 123 19.755 8.323 -2.162 1.00 0.13 C HETATM 1840 C GLU A 123 20.461 6.950 -2.092 1.00 0.20 C HETATM 1841 O GLU A 123 21.364 6.666 -2.901 1.00 -0.39 O HETATM 1842 N GLU A 123 20.037 6.123 -1.099 1.00 -0.27 N HETATM 1843 CA GLU A 123 20.525 4.777 -0.790 1.00 0.09 C HETATM 1844 C GLU A 123 19.352 3.953 -0.277 1.00 0.06 C HETATM 1845 O GLU A 123 18.454 4.511 0.350 1.00 -0.57 O HETATM 1846 OXT GLU A 123 19.324 2.744 -0.499 1.00 -0.57 O HETATM 1847 CB GLU A 123 21.629 4.828 0.282 1.00 -0.03 C HETATM 1848 H86 GLU A 123 21.979 3.808 0.497 1.00 0.03 H HETATM 1849 H87 GLU A 123 21.227 5.279 1.201 1.00 0.03 H HETATM 1850 H88 GLU A 123 22.470 5.434 -0.086 1.00 0.03 H HETATM 1851 H85 GLU A 123 20.930 4.316 -1.703 1.00 0.07 H HETATM 1852 H84 GLU A 123 19.308 6.474 -0.512 1.00 0.19 H HETATM 1853 CB GLU A 123 20.275 9.281 -1.062 1.00 -0.00 C HETATM 1854 CG1 GLU A 123 19.537 10.643 -1.138 1.00 -0.05 C HETATM 1855 CD1 GLU A 123 19.668 11.538 0.132 1.00 -0.06 C HETATM 1856 H81 GLU A 123 19.113 12.475 -0.021 1.00 0.02 H HETATM 1857 H82 GLU A 123 20.729 11.765 0.312 1.00 0.02 H HETATM 1858 H83 GLU A 123 19.254 11.005 1.001 1.00 0.02 H HETATM 1859 H76 GLU A 123 18.468 10.443 -1.305 1.00 0.03 H HETATM 1860 H77 GLU A 123 19.943 11.203 -1.993 1.00 0.03 H HETATM 1861 CG2 GLU A 123 21.828 9.438 -1.131 1.00 -0.06 C HETATM 1862 H78 GLU A 123 22.300 8.446 -1.073 1.00 0.02 H HETATM 1863 H79 GLU A 123 22.172 10.057 -0.289 1.00 0.02 H HETATM 1864 H80 GLU A 123 22.106 9.921 -2.079 1.00 0.02 H HETATM 1865 H75 GLU A 123 20.036 8.831 -0.087 1.00 0.03 H HETATM 1866 H74 GLU A 123 19.949 8.774 -3.146 1.00 0.08 H HETATM 1867 H73 GLU A 123 17.948 8.277 -1.080 1.00 0.19 H HETATM 1868 CB GLU A 123 15.780 6.024 -2.241 1.00 0.04 C HETATM 1869 CG GLU A 123 14.359 5.683 -1.808 1.00 0.04 C HETATM 1870 OD1 GLU A 123 13.618 6.604 -1.402 1.00 -0.57 O HETATM 1871 OD2 GLU A 123 13.975 4.523 -1.938 1.00 -0.57 O HETATM 1872 H71 GLU A 123 16.470 5.671 -1.460 1.00 0.05 H HETATM 1873 H72 GLU A 123 15.988 5.493 -3.182 1.00 0.05 H HETATM 1874 H70 GLU A 123 15.990 8.006 -1.480 1.00 0.08 H HETATM 1875 H69 GLU A 123 14.420 7.588 -3.851 1.00 0.19 H HETATM 1876 CB GLU A 123 12.463 10.560 -2.987 1.00 0.02 C HETATM 1877 CG GLU A 123 11.202 11.142 -3.591 1.00 -0.04 C HETATM 1878 CD1 GLU A 123 10.227 10.315 -4.139 1.00 -0.06 C HETATM 1879 CE1 GLU A 123 9.056 10.847 -4.660 1.00 -0.07 C HETATM 1880 CZ GLU A 123 8.835 12.209 -4.611 1.00 -0.07 C HETATM 1881 CE2 GLU A 123 9.789 13.048 -4.080 1.00 -0.07 C HETATM 1882 CD2 GLU A 123 10.964 12.514 -3.559 1.00 -0.06 C HETATM 1883 H65 GLU A 123 11.704 13.175 -3.122 1.00 0.06 H HETATM 1884 H67 GLU A 123 9.626 14.120 -4.068 1.00 0.06 H HETATM 1885 H68 GLU A 123 7.907 12.619 -4.992 1.00 0.06 H HETATM 1886 H66 GLU A 123 8.315 10.193 -5.105 1.00 0.06 H HETATM 1887 H64 GLU A 123 10.384 9.243 -4.159 1.00 0.06 H HETATM 1888 H62 GLU A 123 12.949 11.354 -2.400 1.00 0.05 H HETATM 1889 H63 GLU A 123 12.164 9.740 -2.318 1.00 0.05 H HETATM 1890 H61 GLU A 123 13.856 10.818 -4.628 1.00 0.08 H HETATM 1891 H60 GLU A 123 12.222 8.361 -4.408 1.00 0.19 H HETATM 1892 CB GLU A 123 10.944 8.422 -7.267 1.00 -0.00 C HETATM 1893 CG GLU A 123 11.027 9.505 -8.339 1.00 0.00 C HETATM 1894 CD GLU A 123 11.431 9.019 -9.718 1.00 0.04 C HETATM 1895 OE1 GLU A 123 11.094 7.870 -10.080 1.00 -0.57 O HETATM 1896 OE2 GLU A 123 12.163 9.760 -10.404 1.00 -0.57 O HETATM 1897 H58 GLU A 123 11.765 10.252 -8.012 1.00 0.04 H HETATM 1898 H59 GLU A 123 10.038 9.979 -8.421 1.00 0.04 H HETATM 1899 H56 GLU A 123 10.525 8.872 -6.355 1.00 0.03 H HETATM 1900 H57 GLU A 123 10.270 7.631 -7.628 1.00 0.03 H HETATM 1901 H55 GLU A 123 12.829 7.561 -7.845 1.00 0.08 H HETATM 1902 H54 GLU A 123 11.136 6.116 -6.256 1.00 0.19 H HETATM 1903 CB GLU A 123 13.701 3.333 -5.217 1.00 0.08 C HETATM 1904 OG GLU A 123 13.875 3.052 -6.598 1.00 -0.39 O HETATM 1905 H53 GLU A 123 13.064 2.708 -6.955 1.00 0.21 H HETATM 1906 H51 GLU A 123 13.434 2.404 -4.692 1.00 0.06 H HETATM 1907 H52 GLU A 123 14.643 3.727 -4.809 1.00 0.06 H HETATM 1908 H50 GLU A 123 12.469 4.514 -3.921 1.00 0.08 H HETATM 1909 H49 GLU A 123 11.356 3.282 -6.354 1.00 0.19 H HETATM 1910 CB GLU A 123 8.683 1.982 -5.307 1.00 -0.00 C HETATM 1911 CG GLU A 123 8.236 1.720 -3.886 1.00 0.00 C HETATM 1912 CD GLU A 123 9.285 1.880 -2.799 1.00 0.04 C HETATM 1913 OE1 GLU A 123 10.494 1.664 -3.059 1.00 -0.57 O HETATM 1914 OE2 GLU A 123 8.879 2.214 -1.667 1.00 -0.57 O HETATM 1915 H47 GLU A 123 7.863 0.686 -3.839 1.00 0.04 H HETATM 1916 H48 GLU A 123 7.415 2.417 -3.661 1.00 0.04 H HETATM 1917 H45 GLU A 123 9.642 1.465 -5.461 1.00 0.03 H HETATM 1918 H46 GLU A 123 7.926 1.560 -5.984 1.00 0.03 H HETATM 1919 H44 GLU A 123 7.986 4.035 -5.378 1.00 0.08 H HETATM 1920 H43 GLU A 123 9.022 2.687 -7.653 1.00 0.19 H HETATM 1921 CB GLU A 123 10.877 4.058 -9.592 1.00 -0.01 C HETATM 1922 CG GLU A 123 11.128 3.579 -11.034 1.00 -0.02 C HETATM 1923 CD GLU A 123 12.536 3.053 -11.223 1.00 0.06 C HETATM 1924 NE GLU A 123 12.742 1.769 -10.550 1.00 -0.27 N HETATM 1925 CZ GLU A 123 12.544 0.574 -11.105 1.00 0.29 C HETATM 1926 NH1 GLU A 123 12.131 0.476 -12.360 1.00 -0.28 N HETATM 1927 H39 GLU A 123 11.980 -0.452 -12.782 1.00 0.26 H HETATM 1928 H40 GLU A 123 11.961 1.327 -12.914 1.00 0.26 H HETATM 1929 NH2 GLU A 123 12.755 -0.529 -10.406 1.00 -0.28 N HETATM 1930 H41 GLU A 123 13.076 -0.466 -9.429 1.00 0.26 H HETATM 1931 H42 GLU A 123 12.598 -1.451 -10.838 1.00 0.26 H HETATM 1932 H38 GLU A 123 13.065 1.791 -9.572 1.00 0.26 H HETATM 1933 H36 GLU A 123 13.246 3.786 -10.812 1.00 0.07 H HETATM 1934 H37 GLU A 123 12.724 2.923 -12.299 1.00 0.07 H HETATM 1935 H34 GLU A 123 10.970 4.423 -11.721 1.00 0.03 H HETATM 1936 H35 GLU A 123 10.415 2.776 -11.270 1.00 0.03 H HETATM 1937 H32 GLU A 123 11.111 3.231 -8.906 1.00 0.03 H HETATM 1938 H33 GLU A 123 11.547 4.906 -9.387 1.00 0.03 H HETATM 1939 H31 GLU A 123 8.733 3.740 -9.704 1.00 0.08 H HETATM 1940 H30 GLU A 123 9.881 6.445 -10.076 1.00 0.19 H HETATM 1941 CB GLU A 123 7.136 8.439 -10.736 1.00 -0.00 C HETATM 1942 CG GLU A 123 7.699 8.768 -9.359 1.00 0.00 C HETATM 1943 CD GLU A 123 6.996 9.860 -8.589 1.00 0.04 C HETATM 1944 OE1 GLU A 123 6.193 10.609 -9.190 1.00 -0.57 O HETATM 1945 OE2 GLU A 123 7.195 9.915 -7.358 1.00 -0.57 O HETATM 1946 H28 GLU A 123 8.748 9.073 -9.491 1.00 0.04 H HETATM 1947 H29 GLU A 123 7.657 7.851 -8.753 1.00 0.04 H HETATM 1948 H26 GLU A 123 6.108 8.065 -10.621 1.00 0.03 H HETATM 1949 H27 GLU A 123 7.127 9.354 -11.346 1.00 0.03 H HETATM 1950 H25 GLU A 123 9.008 7.750 -11.474 1.00 0.08 H HETATM 1951 H24 GLU A 123 6.764 7.730 -13.161 1.00 0.19 H HETATM 1952 CB GLU A 123 6.670 5.190 -15.300 1.00 -0.00 C HETATM 1953 CG GLU A 123 5.743 5.408 -16.485 1.00 0.00 C HETATM 1954 CD GLU A 123 4.722 4.313 -16.728 1.00 0.04 C HETATM 1955 OE1 GLU A 123 4.101 3.840 -15.748 1.00 -0.57 O HETATM 1956 OE2 GLU A 123 4.523 3.949 -17.909 1.00 -0.57 O HETATM 1957 H22 GLU A 123 6.364 5.498 -17.388 1.00 0.04 H HETATM 1958 H23 GLU A 123 5.197 6.349 -16.320 1.00 0.04 H HETATM 1959 H20 GLU A 123 6.062 5.082 -14.390 1.00 0.03 H HETATM 1960 H21 GLU A 123 7.247 4.269 -15.466 1.00 0.03 H HETATM 1961 H19 GLU A 123 7.107 7.291 -15.313 1.00 0.08 H HETATM 1962 H18 GLU A 123 9.478 5.550 -15.804 1.00 0.19 H HETATM 1963 CB GLU A 123 11.385 7.821 -17.332 1.00 0.02 C HETATM 1964 CG GLU A 123 11.737 7.609 -15.876 1.00 -0.05 C HETATM 1965 CD1 GLU A 123 12.574 6.563 -15.486 1.00 -0.07 C HETATM 1966 CE1 GLU A 123 12.850 6.320 -14.146 1.00 -0.04 C HETATM 1967 CZ GLU A 123 12.279 7.122 -13.171 1.00 0.08 C HETATM 1968 CE2 GLU A 123 11.429 8.158 -13.527 1.00 -0.04 C HETATM 1969 CD2 GLU A 123 11.156 8.391 -14.876 1.00 -0.07 C HETATM 1970 H14 GLU A 123 10.481 9.193 -15.152 1.00 0.05 H HETATM 1971 H16 GLU A 123 10.980 8.783 -12.763 1.00 0.05 H HETATM 1972 OH GLU A 123 12.552 6.865 -11.860 1.00 -0.34 O HETATM 1973 H17 GLU A 123 11.744 6.659 -11.404 1.00 0.25 H HETATM 1974 H15 GLU A 123 13.509 5.507 -13.865 1.00 0.05 H HETATM 1975 H13 GLU A 123 13.018 5.927 -16.244 1.00 0.05 H HETATM 1976 H11 GLU A 123 11.000 8.843 -17.461 1.00 0.05 H HETATM 1977 H12 GLU A 123 12.291 7.691 -17.941 1.00 0.05 H HETATM 1978 H10 GLU A 123 10.669 5.819 -17.520 1.00 0.08 H HETATM 1979 H9 GLU A 123 10.564 7.551 -19.797 1.00 0.19 H HETATM 1980 CB GLU A 123 8.153 6.427 -21.866 1.00 0.02 C HETATM 1981 CG GLU A 123 8.323 7.461 -22.969 1.00 0.01 C HETATM 1982 CD GLU A 123 7.106 8.317 -23.280 1.00 0.04 C HETATM 1983 OE1 GLU A 123 6.317 8.608 -22.350 1.00 -0.57 O HETATM 1984 OE2 GLU A 123 6.968 8.735 -24.453 1.00 -0.57 O HETATM 1985 H7 GLU A 123 8.602 6.927 -23.889 1.00 0.04 H HETATM 1986 H8 GLU A 123 9.141 8.135 -22.674 1.00 0.04 H HETATM 1987 H5 GLU A 123 7.646 6.902 -21.014 1.00 0.04 H HETATM 1988 H6 GLU A 123 7.533 5.603 -22.249 1.00 0.04 H HETATM 1989 H4 GLU A 123 10.283 6.537 -21.717 1.00 0.11 H HETATM 1990 H1 GLU A 123 9.728 4.611 -22.980 1.00 0.20 H HETATM 1991 H2 GLU A 123 9.081 3.876 -21.657 1.00 0.20 H HETATM 1992 H3 GLU A 123 10.687 4.235 -21.695 1.00 0.20 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1097 1098 1101 1102 1103 CONECT 1101 1097 CONECT 1102 1097 CONECT 1103 1097 CONECT 1798 1799 1990 1991 1992 CONECT 1799 1798 1800 1980 1989 CONECT 1800 1799 1801 1802 CONECT 1801 1800 CONECT 1802 1800 1803 1979 CONECT 1803 1802 1804 1963 1978 CONECT 1804 1803 1805 1806 CONECT 1805 1804 CONECT 1806 1804 1807 1962 CONECT 1807 1806 1808 1952 1961 CONECT 1808 1807 1809 1810 CONECT 1809 1808 CONECT 1810 1808 1811 1951 CONECT 1811 1810 1812 1941 1950 CONECT 1812 1811 1813 1814 CONECT 1813 1812 CONECT 1814 1812 1815 1940 CONECT 1815 1814 1816 1921 1939 CONECT 1816 1815 1817 1818 CONECT 1817 1816 CONECT 1818 1816 1819 1920 CONECT 1819 1818 1820 1910 1919 CONECT 1820 1819 1821 1822 CONECT 1821 1820 CONECT 1822 1820 1823 1909 CONECT 1823 1822 1824 1903 1908 CONECT 1824 1823 1825 1826 CONECT 1825 1824 CONECT 1826 1824 1827 1902 CONECT 1827 1826 1828 1892 1901 CONECT 1828 1827 1829 1830 CONECT 1829 1828 CONECT 1830 1828 1831 1891 CONECT 1831 1830 1832 1876 1890 CONECT 1832 1831 1833 1834 CONECT 1833 1832 CONECT 1834 1832 1835 1875 CONECT 1835 1834 1836 1868 1874 CONECT 1836 1835 1837 1838 CONECT 1837 1836 CONECT 1838 1836 1839 1867 CONECT 1839 1838 1840 1853 1866 CONECT 1840 1839 1841 1842 CONECT 1841 1840 CONECT 1842 1840 1843 1852 CONECT 1843 1842 1844 1847 1851 CONECT 1844 1843 1845 1846 CONECT 1845 1844 CONECT 1846 1844 CONECT 1847 1843 1848 1849 1850 CONECT 1848 1847 CONECT 1849 1847 CONECT 1850 1847 CONECT 1851 1843 CONECT 1852 1842 CONECT 1853 1839 1854 1861 1865 CONECT 1854 1853 1855 1859 1860 CONECT 1855 1854 1856 1857 1858 CONECT 1856 1855 CONECT 1857 1855 CONECT 1858 1855 CONECT 1859 1854 CONECT 1860 1854 CONECT 1861 1853 1862 1863 1864 CONECT 1862 1861 CONECT 1863 1861 CONECT 1864 1861 CONECT 1865 1853 CONECT 1866 1839 CONECT 1867 1838 CONECT 1868 1835 1869 1872 1873 CONECT 1869 1868 1870 1871 CONECT 1870 1869 CONECT 1871 1869 CONECT 1872 1868 CONECT 1873 1868 CONECT 1874 1835 CONECT 1875 1834 CONECT 1876 1831 1877 1888 1889 CONECT 1877 1876 1878 1882 CONECT 1878 1877 1879 1887 CONECT 1879 1878 1880 1886 CONECT 1880 1879 1881 1885 CONECT 1881 1880 1882 1884 CONECT 1882 1877 1881 1883 CONECT 1883 1882 CONECT 1884 1881 CONECT 1885 1880 CONECT 1886 1879 CONECT 1887 1878 CONECT 1888 1876 CONECT 1889 1876 CONECT 1890 1831 CONECT 1891 1830 CONECT 1892 1827 1893 1899 1900 CONECT 1893 1892 1894 1897 1898 CONECT 1894 1893 1895 1896 CONECT 1895 1894 CONECT 1896 1894 CONECT 1897 1893 CONECT 1898 1893 CONECT 1899 1892 CONECT 1900 1892 CONECT 1901 1827 CONECT 1902 1826 CONECT 1903 1823 1904 1906 1907 CONECT 1904 1903 1905 CONECT 1905 1904 CONECT 1906 1903 CONECT 1907 1903 CONECT 1908 1823 CONECT 1909 1822 CONECT 1910 1819 1911 1917 1918 CONECT 1911 1910 1912 1915 1916 CONECT 1912 1911 1913 1914 CONECT 1913 1912 CONECT 1914 1912 CONECT 1915 1911 CONECT 1916 1911 CONECT 1917 1910 CONECT 1918 1910 CONECT 1919 1819 CONECT 1920 1818 CONECT 1921 1815 1922 1937 1938 CONECT 1922 1921 1923 1935 1936 CONECT 1923 1922 1924 1933 1934 CONECT 1924 1923 1925 1932 CONECT 1925 1924 1926 1929 CONECT 1926 1925 1927 1928 CONECT 1927 1926 CONECT 1928 1926 CONECT 1929 1925 1930 1931 CONECT 1930 1929 CONECT 1931 1929 CONECT 1932 1924 CONECT 1933 1923 CONECT 1934 1923 CONECT 1935 1922 CONECT 1936 1922 CONECT 1937 1921 CONECT 1938 1921 CONECT 1939 1815 CONECT 1940 1814 CONECT 1941 1811 1942 1948 1949 CONECT 1942 1941 1943 1946 1947 CONECT 1943 1942 1944 1945 CONECT 1944 1943 CONECT 1945 1943 CONECT 1946 1942 CONECT 1947 1942 CONECT 1948 1941 CONECT 1949 1941 CONECT 1950 1811 CONECT 1951 1810 CONECT 1952 1807 1953 1959 1960 CONECT 1953 1952 1954 1957 1958 CONECT 1954 1953 1955 1956 CONECT 1955 1954 CONECT 1956 1954 CONECT 1957 1953 CONECT 1958 1953 CONECT 1959 1952 CONECT 1960 1952 CONECT 1961 1807 CONECT 1962 1806 CONECT 1963 1803 1964 1976 1977 CONECT 1964 1963 1965 1969 CONECT 1965 1964 1966 1975 CONECT 1966 1965 1967 1974 CONECT 1967 1966 1968 1972 CONECT 1968 1967 1969 1971 CONECT 1969 1964 1968 1970 CONECT 1970 1969 CONECT 1971 1968 CONECT 1972 1967 1973 CONECT 1973 1972 CONECT 1974 1966 CONECT 1975 1965 CONECT 1976 1963 CONECT 1977 1963 CONECT 1978 1803 CONECT 1979 1802 CONECT 1980 1799 1981 1987 1988 CONECT 1981 1980 1982 1985 1986 CONECT 1982 1981 1983 1984 CONECT 1983 1982 CONECT 1984 1982 CONECT 1985 1981 CONECT 1986 1981 CONECT 1987 1980 CONECT 1988 1980 CONECT 1989 1799 CONECT 1990 1798 CONECT 1991 1798 CONECT 1992 1798 MASTER 0 0 0 0 0 0 0 0 1990 2 203 14 END
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Related entries of code: 4x8p
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5f6k
RCSB PDB
PDBbind
27aa, >5F6K_3|Chains... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1abt
RCSB PDB
PDBbind
12-mer
1br8
RCSB PDB
PDBbind
12-mer
1dkd
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PDBbind
12-mer
1gwr
RCSB PDB
PDBbind
12-mer
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12-mer
1i8i
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PDBbind
12-mer
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PDBbind
12-mer
1jyi
RCSB PDB
PDBbind
12-mer
1ka7
RCSB PDB
PDBbind
12-mer
1lf8
RCSB PDB
PDBbind
12-mer
1mq1
RCSB PDB
PDBbind
12-mer
1mwn
RCSB PDB
PDBbind
12-mer
1osg
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
1qwf
RCSB PDB
PDBbind
12-mer
1shc
RCSB PDB
PDBbind
12-mer
1ujj
RCSB PDB
PDBbind
12-mer
1ujk
RCSB PDB
PDBbind
12-mer
1upk
RCSB PDB
PDBbind
12-mer
1w80
RCSB PDB
PDBbind
12-mer
1x8s
RCSB PDB
PDBbind
12-mer
1xb7
RCSB PDB
PDBbind
12-mer
1y98
RCSB PDB
PDBbind
12-mer
2a3i
RCSB PDB
PDBbind
12-mer
2byp
RCSB PDB
PDBbind
12-mer
2ci9
RCSB PDB
PDBbind
12-mer
2fx8
RCSB PDB
PDBbind
12-mer
2g6q
RCSB PDB
PDBbind
12-mer
2iv9
RCSB PDB
PDBbind
12-mer
2jbu
RCSB PDB
PDBbind
12-mer
2kff
RCSB PDB
PDBbind
12-mer
2kfg
RCSB PDB
PDBbind
12-mer
2kfh
RCSB PDB
PDBbind
12-mer
2ltv
RCSB PDB
PDBbind
12-mer
2mow
RCSB PDB
PDBbind
12-mer
2mwp
RCSB PDB
PDBbind
12-mer
2ncz
RCSB PDB
PDBbind
12-mer
2nwn
RCSB PDB
PDBbind
12-mer
2ovq
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
2pv2
RCSB PDB
PDBbind
12-mer
2pv3
RCSB PDB
PDBbind
12-mer
2qbx
RCSB PDB
PDBbind
12-mer
2qic
RCSB PDB
PDBbind
12-mer
2rol
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
2w10
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
2xzq
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
2y07
RCSB PDB
PDBbind
12-mer
2y1n
RCSB PDB
PDBbind
12-mer
2y36
RCSB PDB
PDBbind
12-mer
2ynr
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
3c6w
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
3d32
RCSB PDB
PDBbind
12-mer
3dow
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
3ds1
RCSB PDB
PDBbind
12-mer
3ds3
RCSB PDB
PDBbind
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3ds4
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
3eqy
RCSB PDB
PDBbind
12-mer
3ggw
RCSB PDB
PDBbind
12-mer
3hs8
RCSB PDB
PDBbind
12-mer
3hs9
RCSB PDB
PDBbind
12-mer
3i5r
RCSB PDB
PDBbind
12-mer
3iqq
RCSB PDB
PDBbind
12-mer
3ivq
RCSB PDB
PDBbind
12-mer
3iwy
RCSB PDB
PDBbind
12-mer
3jzo
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
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PDBbind
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RCSB PDB
PDBbind
12-mer
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PDBbind
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RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
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PDBbind
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RCSB PDB
PDBbind
12-mer
3lnz
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
3ob1
RCSB PDB
PDBbind
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3ob2
RCSB PDB
PDBbind
12-mer
3poa
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PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
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PDBbind
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PDBbind
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PDBbind
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3uef
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
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PDBbind
12-mer
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RCSB PDB
PDBbind
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4twt
RCSB PDB
PDBbind
12-mer
4u7t
RCSB PDB
PDBbind
12-mer
4ux9
RCSB PDB
PDBbind
12-mer
4w50
RCSB PDB
PDBbind
12-mer
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RCSB PDB
PDBbind
12-mer
4why
RCSB PDB
PDBbind
12-mer
4yhz
RCSB PDB
PDBbind
12-mer
4ym4
RCSB PDB
PDBbind
12-mer
4z2o
RCSB PDB
PDBbind
12-mer
4z2p
RCSB PDB
PDBbind
12-mer
4z68
RCSB PDB
PDBbind
12-mer
4znx
RCSB PDB
PDBbind
12-mer
5b56
RCSB PDB
PDBbind
12-mer
5d2a
RCSB PDB
PDBbind
12-mer
5eeq
RCSB PDB
PDBbind
12-mer
5esq
RCSB PDB
PDBbind
12-mer
5etu
RCSB PDB
PDBbind
12-mer
5euk
RCSB PDB
PDBbind
12-mer
5f88
RCSB PDB
PDBbind
12-mer
5ff6
RCSB PDB
PDBbind
12-mer
5ggp
RCSB PDB
PDBbind
12-mer
5gr9
RCSB PDB
PDBbind
12-mer
5huw
RCSB PDB
PDBbind
12-mer
5huy
RCSB PDB
PDBbind
12-mer
5hyq
RCSB PDB
PDBbind
12-mer
5i2i
RCSB PDB
PDBbind
12-mer
5icy
RCSB PDB
PDBbind
12-mer
5icz
RCSB PDB
PDBbind
12-mer
5id1
RCSB PDB
PDBbind
12-mer
5ih2
RCSB PDB
PDBbind
12-mer
5iop
RCSB PDB
PDBbind
12-mer
5ir1
RCSB PDB
PDBbind
12-mer
5itf
RCSB PDB
PDBbind
12-mer
5iv2
RCSB PDB
PDBbind
12-mer
5ivn
RCSB PDB
PDBbind
12-mer
5ivz
RCSB PDB
PDBbind
12-mer
5ixq
RCSB PDB
PDBbind
12-mer
5iyv
RCSB PDB
PDBbind
12-mer
5lgr
RCSB PDB
PDBbind
12-mer
5moc
RCSB PDB
PDBbind
12-mer
5n7x
RCSB PDB
PDBbind
12-mer
5n8j
RCSB PDB
PDBbind
12-mer
5t1k
RCSB PDB
PDBbind
12-mer
5t1l
RCSB PDB
PDBbind
12-mer
5t1m
RCSB PDB
PDBbind
12-mer
5tbn
RCSB PDB
PDBbind
12-mer
5th2
RCSB PDB
PDBbind
12-mer
5v1d
RCSB PDB
PDBbind
12-mer
5w4s
RCSB PDB
PDBbind
12-mer
5w5s
RCSB PDB
PDBbind
12-mer
5w5u
RCSB PDB
PDBbind
12-mer
5w6i
RCSB PDB
PDBbind
12-mer
5w6r
RCSB PDB
PDBbind
12-mer
5w6t
RCSB PDB
PDBbind
12-mer
5w6u
RCSB PDB
PDBbind
12-mer
5wle
RCSB PDB
PDBbind
12-mer
5wxf
RCSB PDB
PDBbind
12-mer
5wxo
RCSB PDB
PDBbind
12-mer
5xup
RCSB PDB
PDBbind
12-mer
5xwr
RCSB PDB
PDBbind
12-mer
5xxk
RCSB PDB
PDBbind
12-mer
5y1u
RCSB PDB
PDBbind
12-mer
5y59
RCSB PDB
PDBbind
12-mer
6bgg
RCSB PDB
PDBbind
12-mer
6e83
RCSB PDB
PDBbind
12-mer
6f7t
RCSB PDB
PDBbind
12-mer
6f8g
RCSB PDB
PDBbind
12-mer
6rr0
RCSB PDB
PDBbind
12-mer
6qtr
RCSB PDB
PDBbind
12-mer
6qto
RCSB PDB
PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
6peu
RCSB PDB
PDBbind
12-mer
6o3x
RCSB PDB
PDBbind
12-mer
6nk0
RCSB PDB
PDBbind
12-mer
6mm5
RCSB PDB
PDBbind
12-mer
6k5t
RCSB PDB
PDBbind
12-mer
6k5r
RCSB PDB
PDBbind
12-mer
6iam
RCSB PDB
PDBbind
12-mer
6hy2
RCSB PDB
PDBbind
12-mer
6byk
RCSB PDB
PDBbind
12-mer
6bw4
RCSB PDB
PDBbind
12-mer
6bw3
RCSB PDB
PDBbind
12-mer
6a8g
RCSB PDB
PDBbind
12-mer
5zop
RCSB PDB
PDBbind
12-mer
Entry Information
PDB ID
4x8p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Set1/Ash2 histone methyltransferase complex subunit ASH2
Ligand Name
12-mer
EC.Number
E.C.-.-.-.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=3.3uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Genes Dev. Vol. 29: pp. 123-128
Ligand Properties
Formula
C
6
5
H
9
5
N
1
5
O
2
7
Molecular Weight
1518.530
Exact Mass
1517.650
No. of atoms
202
No. of bonds
203
Polar Surface Area
715.31
LOGP Value
4.33 (
Computed with XLOGP3
)
-3.10 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 27
No. of Rotatable Bonds: 57
No. of Nitrogen and Oxygen Atoms: 42
No. of Rings: 2
Canonical SMILES
CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)[NH3+])Cc1ccc(cc1)O)CCC(=O)O)CCC(=O)O)CCC[NH+]=C(N)N)CCC(=O)O)CO)CCC(=O)O)Cc1ccccc1)CC(=O)O)C
InChI String
InChI=1S/C65H93N15O27/c1-4-31(2)52(63(105)70-32(3)64(106)107)80-61(103)44(29-51(93)94)78-60(102)43(27-33-9-6-5-7-10-33)77-57(99)40(19-24-49(89)90)75-62(104)45(30-81)79-58(100)41(20-25-50(91)92)72-54(96)37(11-8-26-69-65(67)68)71-55(97)38(17-22-47(85)86)73-56(98)39(18-23-48(87)88)74-59(101)42(28-34-12-14-35(82)15-13-34)76-53(95)36(66)16-21-46(83)84/h5-7,9-10,12-15,31-32,36-45,52,81-82H,4,8,11,16-30,66H2,1-3H3,(H,70,105)(H,71,97)(H,72,96)(H,73,98)(H,74,101)(H,75,104)(H,76,95)(H,77,99)(H,78,102)(H,79,100)(H,80,103)(H,83,84)(H,85,86)(H,87,88)(H,89,90)(H,91,92)(H,93,94)(H,106,107)(H4,67,68,69)/p+2/t31-,32-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,52-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q9UBL3
Q15291
Entrez Gene ID
NCBI Entrez Gene ID:
9070
5929
ASD
Information of known allosteric effects of PDB entries
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